Application of radiometric surface temperature for surface energy balance estimation: John Monteith's contributions

USDA-ARS?s Scientific Manuscript database

Over 25 years ago, Huband and Monteith paper’s investigating the radiative surface temperature and the surface energy balance of a wheat canopy, highlighted the key issues in computing fluxes with radiometric surface temperature. These included the relationship between radiometric and aerodynamic s...

Combining observations in the reflective solar and thermal domains for improved carbon and energy flux estimation

USDA-ARS?s Scientific Manuscript database

This study investigates the utility of integrating remotely sensed estimates of leaf chlorophyll (Cab) into a therma-based Two-Source Energy Balance (TSEB) model that estimates land-surface CO2 and energy fluxes using an analytical, light-use-efficiency (LUE) based model of canopy resistance. The LU...

Estimation of the Relationship Between Remotely Sensed Anthropogenic Heat Discharge and Building Energy Use

NASA Technical Reports Server (NTRS)

Zhou, Yuyu; Weng, Qihao; Gurney, Kevin R.; Shuai, Yanmin; Hu, Xuefei

2012-01-01

This paper examined the relationship between remotely sensed anthropogenic heat discharge and energy use from residential and commercial buildings across multiple scales in the city of Indianapolis, Indiana, USA. The anthropogenic heat discharge was estimated with a remote sensing-based surface energy balance model, which was parameterized using land cover, land surface temperature, albedo, and meteorological data. The building energy use was estimated using a GIS-based building energy simulation model in conjunction with Department of Energy/Energy Information Administration survey data, the Assessor's parcel data, GIS floor areas data, and remote sensing-derived building height data. The spatial patterns of anthropogenic heat discharge and energy use from residential and commercial buildings were analyzed and compared. Quantitative relationships were evaluated across multiple scales from pixel aggregation to census block. The results indicate that anthropogenic heat discharge is consistent with building energy use in terms of the spatial pattern, and that building energy use accounts for a significant fraction of anthropogenic heat discharge. The research also implies that the relationship between anthropogenic heat discharge and building energy use is scale-dependent. The simultaneous estimation of anthropogenic heat discharge and building energy use via two independent methods improves the understanding of the surface energy balance in an urban landscape. The anthropogenic heat discharge derived from remote sensing and meteorological data may be able to serve as a spatial distribution proxy for spatially-resolved building energy use, and even for fossil-fuel CO2 emissions if additional factors are considered.

Sea ice - atmosphere interaction: Application of multispectral satellite data in polar surface energy flux estimates

NASA Technical Reports Server (NTRS)

Steffen, Konrad; Schweiger, A.; Maslanik, J.; Key, J.; Haefliger, M.; Weaver, R.

1991-01-01

In the past six months, work has continued on energy flux sensitivity studies, ice surface temperature retrievals, corrections to Advanced Very High Resolution Radiometer (AVHRR) thermal infrared data, modelling of cloud fraction retrievals, and radiation climatologies. We tentatively conclude that the SSM/I may not provide accurate enough estimates of ice concentration and type to improve our shorter term energy flux estimates. SSM/I derived parameters may still be applicable in longer term climatological flux characterizations. We hold promise for a system coupling observation to a ice deformation model. Such a model may provide information on ice distribution which can be used in energy flux calculations. Considerable variation was found in modelled energy flux estimates when bulk transfer coefficients are modulated by lead fetch. It is still unclear what the optimum formulation is and this will be the subject of further work. Data sets for ice surface temperature retrievals were assembled and preliminary data analysis was started. Finally, construction of a conceptual framework for further modelling of the Arctic radiation flux climatology was started.

Estimating morning changes in land surface temperature from MODIS day/night land surface temperature: Applications for surface energy balance modeling

USDA-ARS?s Scientific Manuscript database

Observations of land surface temperature (LST) are crucial for the monitoring of surface energy fluxes from satellite. Methods that require high temporal resolution LST observations (e.g., from geostationary orbit) can be difficult to apply globally because several geostationary sensors are required...

Procedure for estimating fracture energy from fracture surface roughness

DOEpatents

Williford, Ralph E.

1989-01-01

The fracture energy of a material is determined by first measuring the length of a profile of a section through a fractured surface of the material taken on a plane perpendicular to the mean plane of that surface, then determining the fractal dimensionality of the surface. From this, the yield strength of the material, and the Young's Modulus of that material, the fracture energy is calculated.

A new approach to estimating evaporation from lakes and reservoirs based on energy balance and remote sensing data

NASA Astrophysics Data System (ADS)

Majidi, Maysam; Sadeghi, Morteza; Shafiei, Mojtaba; Alizadeh, Amin; Farid, Alireza; Azad, Mohammadreza; Vazifedoust, Majid

2016-04-01

Estimating evaporation from water bodies such as lakes and reservoirs is commonly a difficult task, especially due to the lack of reliable and available ground data. Remote sensing (RS) data has shown a great potential for filling the gap. Nonetheless, interpretation of the RS data (e.g. optical reflectance, thermal emission, etc.) for estimating water evaporation has remained as a challenge. In this paper, we present a novel approach for estimating water evaporation based on satellite RS data and some readily measurable ground data. In the proposed approach, named as "Reference and Water surface Energy Balance (RWEB)", we define a reference surface and then solve the energy balance equation simultaneously for the reference surfaces and water surface. This approach was tested over the Doosti dam reservoir (north east of Iran) using whether station and RS data as well as water temperature measured biweekly along the study. Accuracy of the RWEB algorithm was examined by comparison to the standard "Bowen Ratio Energy Balance (BREB)" RS algorithm. The RMSD value of 0.047 mm/year indicated a good agreement between RWEB and BREB algorithms, while RWEB provides an easier-to-use approach regarding its required input variables.

Contribution of the hydrostatic pressure to the shape of silver island particles

NASA Astrophysics Data System (ADS)

Anno, E.; Hoshino, R.

1984-09-01

We have investigated the shape change of silver island particles caused by the surface energy reduction. When the surface energy was reduced by the reaction with hydrogen sulfide, the flattening of the particles was observed. As is well known, the similar shape change takes place when the particle size increases. Therefore, the particle shape is considered to depend both on the surface energy and the particle size. From this consideration, we predict the contribution of the hydrostatic pressure P to the particle shape. As evidence of this contribution, we consider the existence of the critical size below which P is larger than the adhesive force FA between deposit and substrate surface. Investigating the influence of the flattening due to the surface energy reduction on the size distribution, the critical size is found and estimated to be about 80 Å in diameter. This value is comparable with that estimated from the condition P = FA.

Local energy flux estimates for unstable conditions using variance data in semiarid rangelands

USGS Publications Warehouse

Kustas, William P.; Blanford, J.H.; Stannard, D.I.; Daughtry, C.S.T.; Nichols, W.D.; Weltz, M.A.

1994-01-01

A network of meteorological stations was installed during the Monsoon '90 field campaign in the Walnut Gulch experimental watershed. The study area has a fairly complex surface. The vegetation cover is heterogeneous and sparse, and the terrain is mildly hilly, but dissected by ephemeral channels. Besides measurement of some of the standard weather data such as wind speed, air temperature, and solar radiation, these sites also contained instruments for estimating the local surface energy balance. The approach utilized measurements of net radiation (Rn), soil heat flux (G) and Monin-Obukhov similarity theory applied to first- and second-order turbulent statistics of wind speed and temperature for determining the sensible heat flux (H). The latent heat flux (LE) was solved as a residual in the surface energy balance equation, namely, LE = −(Rn + G + H). This procedure (VAR-RESID) for estimating the energy fluxes satisfied monetary constraints and the requirement for low maintenance and continued operation through the harsh environmental conditions experienced in semiarid regions. Comparison of energy fluxes using this approach with more traditional eddy correlation techniques showed differences were within 20% under unstable conditions. Similar variability in flux estimates over the study area was present in the eddy correlation data. Hence, estimates of H and LE using the VAR-RESID approach under unstable conditions were considered satisfactory. Also, with second-order statistics of vertical velocity collected at several sites, the local momentum roughness length was estimated. This is an important parameter used in modeling the turbulent transfer of momentum and sensible heat fluxes across the surface-atmosphere interface.

Evapotranspiration from areas of native vegetation in west-central Florida

USGS Publications Warehouse

Bidlake, W.R.; Woodham, W.M.; Lopez, M.A.

1993-01-01

A study was made to examine the suitability of three different micrometeorological methods for estimating evapotranspiration from selected areas of native vegetation in west-central Florida and to estimate annual evapotranspiration from those areas. Evapotranspiration was estimated using the energy- balance Bowen ratio and eddy correlation methods. Potential evapotranspiration was computed using the Penman equation. The energy-balance Bowen ratio method was used to estimate diurnal evapotrans- piration at unforested sites and yielded reasonable results; however, measurements indicated that the magnitudes of air temperature and vapor-pressure gradients above the forested sites were too small to obtain reliable evapotranspiration measurements with the energy balance Bowen ratio system. Analysis of the surface energy-balance indicated that sensible and latent heat fluxes computed using standard eddy correlation computation methods did not adequately account for available energy. Eddy correlation data were combined with the equation for the surface energy balance to yield two additional estimates of evapotranspiration. Daily potential evapotranspiration and evapotranspira- tion estimated using the energy-balance Bowen ratio method were not correlated at a unforested, dry prairie site, but they were correlated at a marsh site. Estimates of annual evapotranspiration for sites within the four vegetation types, which were based on energy-balance Bowen ratio and eddy correlation measurements, were 1,010 millimeters for dry prairie sites, 990 millimeters for marsh sites, 1,060 millimeters for pine flatwood sites, and 970 millimeters for a cypress swamp site.

Energy and water balance determination in an advective environment:From direct measurement to microclimate based estimation

USDA-ARS?s Scientific Manuscript database

The contributions of John Monteith are perhaps nowhere more widely acknowledged than in the community of scientists and engineers concerned with estimation of evapotranspiration. His addition of surface energy balance flux resistance formulations to the evaporation estimation formula of Penman presa...

Multisource Estimation of Long-term Global Terrestrial Surface Radiation

NASA Astrophysics Data System (ADS)

Peng, L.; Sheffield, J.

2017-12-01

Land surface net radiation is the essential energy source at the earth's surface. It determines the surface energy budget and its partitioning, drives the hydrological cycle by providing available energy, and offers heat, light, and energy for biological processes. Individual components in net radiation have changed historically due to natural and anthropogenic climate change and land use change. Decadal variations in radiation such as global dimming or brightening have important implications for hydrological and carbon cycles. In order to assess the trends and variability of net radiation and evapotranspiration, there is a need for accurate estimates of long-term terrestrial surface radiation. While large progress in measuring top of atmosphere energy budget has been made, huge discrepancies exist among ground observations, satellite retrievals, and reanalysis fields of surface radiation, due to the lack of observational networks, the difficulty in measuring from space, and the uncertainty in algorithm parameters. To overcome the weakness of single source datasets, we propose a multi-source merging approach to fully utilize and combine multiple datasets of radiation components separately, as they are complementary in space and time. First, we conduct diagnostic analysis of multiple satellite and reanalysis datasets based on in-situ measurements such as Global Energy Balance Archive (GEBA), existing validation studies, and other information such as network density and consistency with other meteorological variables. Then, we calculate the optimal weighted average of multiple datasets by minimizing the variance of error between in-situ measurements and other observations. Finally, we quantify the uncertainties in the estimates of surface net radiation and employ physical constraints based on the surface energy balance to reduce these uncertainties. The final dataset is evaluated in terms of the long-term variability and its attribution to changes in individual components. The goal of this study is to provide a merged observational benchmark for large-scale diagnostic analyses, remote sensing and land surface modeling.

Surface Energy Balance System for Estimating Daily Evapotranspiration Rates in the Texas High Plains

USDA-ARS?s Scientific Manuscript database

Numerous energy balance (EB) algorithms have been developed to use remote sensing data for mapping evapotranspiration (ET) on a regional basis. Adopting any single or a combination of these models for an operational ET remote sensing program requires thorough evaluation. The Surface Energy Balance S...

Mapping land water and energy balance relations through conditional sampling of remote sensing estimates of atmospheric forcing and surface states

NASA Astrophysics Data System (ADS)

Farhadi, Leila; Entekhabi, Dara; Salvucci, Guido

2016-04-01

In this study, we develop and apply a mapping estimation capability for key unknown parameters that link the surface water and energy balance equations. The method is applied to the Gourma region in West Africa. The accuracy of the estimation method at point scale was previously examined using flux tower data. In this study, the capability is scaled to be applicable with remotely sensed data products and hence allow mapping. Parameters of the system are estimated through a process that links atmospheric forcing (precipitation and incident radiation), surface states, and unknown parameters. Based on conditional averaging of land surface temperature and moisture states, respectively, a single objective function is posed that measures moisture and temperature-dependent errors solely in terms of observed forcings and surface states. This objective function is minimized with respect to parameters to identify evapotranspiration and drainage models and estimate water and energy balance flux components. The uncertainty of the estimated parameters (and associated statistical confidence limits) is obtained through the inverse of Hessian of the objective function, which is an approximation of the covariance matrix. This calibration-free method is applied to the mesoscale region of Gourma in West Africa using multiplatform remote sensing data. The retrievals are verified against tower-flux field site data and physiographic characteristics of the region. The focus is to find the functional form of the evaporative fraction dependence on soil moisture, a key closure function for surface and subsurface heat and moisture dynamics, using remote sensing data.

Diamond /111/ studied by electron energy loss spectroscopy in the characteristic loss region

NASA Technical Reports Server (NTRS)

Pepper, S. V.

1982-01-01

Unoccupied surface states on diamond (111) annealed at greater than 900 C are studied by electron energy loss spectroscopy with valence band excitation. A feature found at 2.1 eV loss energy is attributed to an excitation from occupied surface states into unoccupied surface states of energy within the bulk band gap. A surface band gap of approximately 1 eV is estimated. This result supports a previous suggestion for unoccupied band gap states based on core level energy loss spectroscopy. Using the valence band excitation energy loss spectrosocpy, it is also suggested that hydrogen is removed from the as-polished diamond surface by a Menzel-Gomer-Redhead mechanism.

Evidence for a positron bound state on the surface of a topological insulator

NASA Astrophysics Data System (ADS)

Shastry, K.; Weiss, A. H.; Barbiellini, B.; Assaf, B. A.; Lim, Z. H.; Joglekar, P. V.; Heiman, D.

2015-06-01

We describe experiments aimed at probing the sticking of positrons to the surfaces of topological insulators using the Positron Annihilation induced Auger Electron Spectrometer (PAES). A magnetically guided beam was used to deposit positrons at the surface of Bi2Te2Se sample at energy of ∼2eV. Peaks observed in the energy spectra and intensities of electrons emitted as a result of positron annihilation showed peaks at energies corresponding to Auger peaks in Bi, Teand Se providing clear evidence of Auger emission associated with the annihilation of positrons in a surface bound state. Theoretical estimates of the binding energy of this state are compared with estimates obtained by measuring the incident beam energy threshold for secondary electron emission and the temperature dependence positronium(Ps) emission. The experiments provide strong evidence for the existence of a positron bound state at the surface of Bi2Te2Se and indicate the practicality of using positron annihilation to selectively probe the critically important top most layer of topological insulator system.

Vortex energy landscape from real space imaging analysis of YBa2Cu3O7 with different defect structures

NASA Astrophysics Data System (ADS)

Luccas, R. F.; Granados, X.; Obradors, X.; Puig, T.

2014-10-01

A methodology based on real space vortex image analysis is presented able to estimate semi-quantitatively the relevant energy densities of an arbitrary array of vortices, map the interaction energy distributions and evaluate the pinning energy associated to particular defects. The combined study using nanostructuration tools, a vortex visualization technique and the energy method is seen as an opportunity to estimate vortex pinning potentials strengths. Particularly, spatial distributions of vortex energy densities induced by surface nanoindented scratches are evaluated and compared to those of twin boundaries. This comparative study underlines the remarkable role of surface nanoscratches in pinning vortices and its potentiality in the design of novel devices for pinning and guiding vortex motion.

Total photoelectron yield spectroscopy of energy distribution of electronic states density at GaN surface and SiO2/GaN interface

NASA Astrophysics Data System (ADS)

Ohta, Akio; Truyen, Nguyen Xuan; Fujimura, Nobuyuki; Ikeda, Mitsuhisa; Makihara, Katsunori; Miyazaki, Seiichi

2018-06-01

The energy distribution of the electronic state density of wet-cleaned epitaxial GaN surfaces and SiO2/GaN structures has been studied by total photoelectron yield spectroscopy (PYS). By X-ray photoelectron spectroscopy (XPS) analysis, the energy band diagram for a wet-cleaned epitaxial GaN surface such as the energy level of the valence band top and electron affinity has been determined to obtain a better understanding of the measured PYS signals. The electronic state density of GaN surface with different carrier concentrations in the energy region corresponding to the GaN bandgap has been evaluated. Also, the interface defect state density of SiO2/GaN structures was also estimated by not only PYS analysis but also capacitance–voltage (C–V) characteristics. We have demonstrated that PYS analysis enables the evaluation of defect state density filled with electrons at the SiO2/GaN interface in the energy region corresponding to the GaN midgap, which is difficult to estimate by C–V measurement of MOS capacitors.

The Energy Budget of the Polar Atmosphere in MERRA

NASA Technical Reports Server (NTRS)

Cullather, Richard I.; Bosilovich, Michael G.

2010-01-01

Components of the atmospheric energy budget from the Modern Era Retrospective-analysis for Research and Applications (MERRA) are evaluated in polar regions for the period 1979-2005 and compared with previous estimates, in situ observations, and contemporary reanalyses. Closure of the energy budget is reflected by the analysis increments term, which results from virtual enthalpy and latent heating contributions and averages -11 W/sq m over the north polar cap and -22 W/sq m over the south polar cap. Total energy tendency and energy convergence terms from MERRA agree closely with previous study for northern high latitudes but convergence exceeds previous estimates for the south polar cap by 46 percent. Discrepancies with the Southern Hemisphere transport are largest in autumn and may be related to differences in topography with earlier reanalyses. For the Arctic, differences between MERRA and other sources in TOA and surface radiative fluxes maximize in May. These differences are concurrent with the largest discrepancies between MERRA parameterized and observed surface albedo. For May, in situ observations of the upwelling shortwave flux in the Arctic are 80 W/sq m larger than MERRA, while the MERRA downwelling longwave flux is underestimated by 12 W/sq m throughout the year. Over grounded ice sheets, the annual mean net surface energy flux in MERRA is erroneously non-zero. Contemporary reanalyses from the Climate Forecast Center (CFSR) and the Interim Re-Analyses of the European Centre for Medium Range Weather Forecasts (ERA-I) are found to have better surface parameterizations, however these collections are also found to have significant discrepancies with observed surface and TOA energy fluxes. Discrepancies among available reanalyses underscore the challenge of reproducing credible estimates of the atmospheric energy budget in polar regions.

Evaluation of Modeling Schemes to Estimate Evapotranspiration and Root Zone Soil Water Content over Vineyard using a Scintillometer and Remotely Sensed Surface Energy Balance

NASA Astrophysics Data System (ADS)

Geli, H. M. E.; Gonzalez-Piqueras, J.; Isidro, C., Sr.

2016-12-01

Actual crop evapotranspiration (ETa) and root zone soil water content (SMC) are key operational variable to monitor water consumption and water stress condition for improve vineyard grapes productivity and quality. This analysis, evaluates the estimation of ETa and SMC based on two modeling approaches. The first approach is a hybrid model that couples a thermal-based two source energy balance (TSEB) model (Norman et al. 1995) and water balance model to estimate the two variable (Geli 2012). The second approach is based on Large Aperture Scintillometer (LAS)-based estimates of sensible heat flux. The LAS-based estimates of sensible heat fluxes were used to calculate latent heat flux as the residual of surface energy balance equation on hourly basis which was converted to daily ETa. The calculated ETa from the scintillometer was then couple with the water balance approach to provide updated ETa_LAS and SMC_LAS. Both estimates of ETa and SMC based on LAS (i.e. ETa_LAS and SMC_LAS) and TSEB (ETa_TSEB and SMC_TSEB) were compared with ground-based observation from eddy covariance and soil water content measurements at multiple depths. The study site is an irrigated vineyard located in Central Spain Primary with heterogeneous surface conditions in term of irrigation practices and the ground based observation over the vineyard were collected during the summer of 2007. Preliminary results of the inter-comparison of the two approaches suggests relatively good between both modeling approaches and ground-based observations with RMSE lower than 1.2 mm/day for ETa and lower than 20% for SMC. References Norman, J. M., Kustas, W. P., & Humes, K. S. (1995). A two-source approach for estimating soil and vegetation energy fluxes in observations of directional radiometric surface temperature. Agricultural and Forest Meteorology, 77, 263293. Geli, Hatim M. E. (2012). Modeling spatial surface energy fluxes of agricultural and riparian vegetation using remote sensing, Ph. D. dissertation, Department of Civil and Environmental Engineering, Utah State University.

Observing changes in atmospheric heat content

NASA Astrophysics Data System (ADS)

Balcerak, Ernie

2011-10-01

Globally, air temperatures near the surface over land have been rising in recent decades, and this has been presented as solid evidence of global warming. However, some scientists have argued that total heat content (energy), rather than temperature, should be used as a metric of warming trends. Surface air temperature is only one component of the energy content of the surface atmosphere—kinetic energy and latent heat also contribute. Peterson et al. present the first study to use observational data to estimate global changes in surface energy of the atmosphere over time. They include temperature, kinetic energy, and latent heat in their analysis. The authors found that total global surface atmospheric energy and heat content have increased since the 1970s, even though kinetic energy decreased slightly and in some regions latent heat declined while temperature increased.

Sea ice-atmospheric interaction: Application of multispectral satellite data in polar surface energy flux estimates

NASA Technical Reports Server (NTRS)

Steffen, Konrad; Key, J.; Maslanik, J.; Schweiger, A.

1993-01-01

This is the third annual report on: Sea Ice-Atmosphere Interaction - Application of Multispectral Satellite Data in Polar Surface Energy Flux Estimates. The main emphasis during the past year was on: radiative flux estimates from satellite data; intercomparison of satellite and ground-based cloud amounts; radiative cloud forcing; calibration of the Advanced Very High Resolution Radiometer (AVHRR) visible channels and comparison of two satellite derived albedo data sets; and on flux modeling for leads. Major topics covered are arctic clouds and radiation; snow and ice albedo, and leads and modeling.

Mapping surface energy balance components by combining Landsat Thematic Mapper and ground-based meteorological data

NASA Technical Reports Server (NTRS)

Moran, M. Susan; Jackson, Ray D.; Raymond, Lee H.; Gay, Lloyd W.; Slater, Philip N.

1989-01-01

Surface energy balance components were evaluated by combining satellite-based spectral data with on-site measurements of solar irradiance, air temperature, wind speed, and vapor pressure. Maps of latent heat flux density and net radiant flux density were produced using Landsat TM data for three dates. The TM-based estimates differed from Bowen-ratio and aircraft-based estimates by less than 12 percent over mature fields of cotton, wheat, and alfalfa.

Multilayer Relaxation and Surface Energies of Metallic Surfaces

NASA Technical Reports Server (NTRS)

Bozzolo, Guillermo; Rodriguez, Agustin M.; Ferrante, John

1994-01-01

The perpendicular and parallel multilayer relaxations of fcc (210) surfaces are studied using equivalent crystal theory (ECT). A comparison with experimental and theoretical results is made for AI(210). The effect of uncertainties in the input parameters on the magnitudes and ordering of surface relaxations for this semiempirical method is estimated. A new measure of surface roughness is proposed. Predictions for the multilayer relaxations and surface energies of the (210) face of Cu and Ni are also included.

A comparison of operational remote sensing-based models for estimating crop evapotranspiration

USDA-ARS?s Scientific Manuscript database

The integration of remotely sensed data into models of actual evapotranspiration has allowed for the estimation of water consumption across agricultural regions. Two modeling approaches have been successfully applied. The first approach computes a surface energy balance using the radiometric surface...

An intercomparison of three remote sensing-based energy balance models using large aperture scintillometer measurements over a wheat-corn production region

USDA-ARS?s Scientific Manuscript database

This paper compares three remote sensing-based models for estimating evapotranspiration (ET), namely the Surface Energy Balance System (SEBS), the Two-Source Energy Balance (TSEB) model, and the surface Temperature-Vegetation index Triangle (TVT). The models used as input MODIS/TERRA products and gr...

Comparison of Three Operative Models for Estimating the Surface Water Deficit using ASTER Reflective and Thermal Data

PubMed Central

García, Mónica; Villagarcía, Luis; Contreras, Sergio; Domingo, Francisco; Puigdefábregas, Juan

2007-01-01

Three operative models with minimum input data requirements for estimating the partition of available surface energy into sensible and latent heat flux using ASTER data have been evaluated in a semiarid area in SE Spain. The non-evaporative fraction (NEF) is proposed as an indicator of the surface water deficit. The best results were achieved with NEF estimated using the “Simplified relationship” for unstable conditions (NEFSeguin) and with the S-SEBI (Simplified Surface Energy Balance Index) model corrected for atmospheric conditions (NEFS-SEBIt,) which both produced equivalent results. However, results with a third model, NEFCarlson, that estimates the exchange coefficient for sensible heat transfer from NDVI, were unrealistic for sites with scarce vegetation cover. These results are very promising for an operative monitoring of the surface water deficit, as validation with field data shows reasonable errors, within those reported in the literature (RMSE were 0.18 and 0.11 for the NEF, and 29.12 Wm-2 and 25.97 Wm-2 for sensible heat flux, with the Seguin and S-SEBIt models, respectively).

Using a thermal-based two source energy balance model with time-differencing to estimate surface energy fluxes with day-night MODIS observations

NASA Astrophysics Data System (ADS)

Guzinski, R.; Anderson, M. C.; Kustas, W. P.; Nieto, H.; Sandholt, I.

2013-07-01

The Dual Temperature Difference (DTD) model, introduced by Norman et al. (2000), uses a two source energy balance modelling scheme driven by remotely sensed observations of diurnal changes in land surface temperature (LST) to estimate surface energy fluxes. By using a time-differential temperature measurement as input, the approach reduces model sensitivity to errors in absolute temperature retrieval. The original formulation of the DTD required an early morning LST observation (approximately 1 h after sunrise) when surface fluxes are minimal, limiting application to data provided by geostationary satellites at sub-hourly temporal resolution. The DTD model has been applied primarily during the active growth phase of agricultural crops and rangeland vegetation grasses, and has not been rigorously evaluated during senescence or in forested ecosystems. In this paper we present modifications to the DTD model that enable applications using thermal observations from polar orbiting satellites, such as Terra and Aqua, with day and night overpass times over the area of interest. This allows the application of the DTD model in high latitude regions where large viewing angles preclude the use of geostationary satellites, and also exploits the higher spatial resolution provided by polar orbiting satellites. A method for estimating nocturnal surface fluxes and a scheme for estimating the fraction of green vegetation are developed and evaluated. Modification for green vegetation fraction leads to significantly improved estimation of the heat fluxes from the vegetation canopy during senescence and in forests. When the modified DTD model is run with LST measurements acquired with the Moderate Resolution Imaging Spectroradiometer (MODIS) on board the Terra and Aqua satellites, generally satisfactory agreement with field measurements is obtained for a number of ecosystems in Denmark and the United States. Finally, regional maps of energy fluxes are produced for the Danish Hydrological ObsErvatory (HOBE) in western Denmark, indicating realistic patterns based on land use.

Upscaling surface energy fluxes over the North Slope of Alaska using airborne eddy-covariance measurements and environmental response functions

NASA Astrophysics Data System (ADS)

Serafimovich, Andrei; Metzger, Stefan; Hartmann, Jörg; Kohnert, Katrin; Zona, Donatella; Sachs, Torsten

2018-03-01

The objective of this study was to upscale airborne flux measurements of sensible heat and latent heat and to develop high resolution flux maps. In order to support the evaluation of coupled atmospheric/land-surface models we investigated spatial patterns of energy fluxes in relation to land-surface properties. We used airborne eddy-covariance measurements acquired by the POLAR 5 research aircraft in June-July 2012 to analyze surface fluxes. Footprint-weighted surface properties were then related to 21 529 sensible heat flux observations and 25 608 latent heat flux observations using both remote sensing and modelled data. A boosted regression tree technique was used to estimate environmental response functions between spatially and temporally resolved flux observations and corresponding biophysical and meteorological drivers. In order to improve the spatial coverage and spatial representativeness of energy fluxes we used relationships extracted across heterogeneous Arctic landscapes to infer high-resolution surface energy flux maps, thus directly upscaling the observational data. These maps of projected sensible heat and latent heat fluxes were used to assess energy partitioning in northern ecosystems and to determine the dominant energy exchange processes in permafrost areas. This allowed us to estimate energy fluxes for specific types of land cover, taking into account meteorological conditions. Airborne and modelled fluxes were then compared with measurements from an eddy-covariance tower near Atqasuk. Our results are an important contribution for the advanced, scale-dependent quantification of surface energy fluxes and provide new insights into the processes affecting these fluxes for the main vegetation types in high-latitude permafrost areas.

Reconstruction of Energy Surfaces from Friction Force Microscopy Measurements with the Jarzynski Equality

NASA Astrophysics Data System (ADS)

Berkovich, Ronen; Klafter, Joseph; Urbakh, Michael

Free energy is one of the most fundamental thermodynamic functions, determining relative phase stability and serving as a generating function for other thermodynamic quantities. The calculation of free energies is a challenging enterprise. In equilibrium statistical mechanics, the free energy is related to the canonical partition function. The partition function itself involves integrations over all degrees of freedom in the system and, in most cases, cannot be easily calculated directly. In 1997, Jarzynski proved a remarkable equality that allows computing the equilibrium free-energy difference between two states from the probability distribution of the nonequilibrium work done on the system to switch between the two states. The Jarzynski equality provides a powerful free-energy difference estimator from a set of irreversible experiments. This method is closely related to free-energy perturbation approach, which is also a computational technique for estimating free-energy differences. The ability to map potential profiles and topologies is of major significance to areas as diverse as biological recognition and nanoscale friction. This capability has been demonstrated for frictional studies where a force between the tip of the scanning force microscope and the surface is probed. The surface free-energy corrugation produces a detectable friction forces. Thus, friction force microscopy (FFM) should be able to discriminate between energetically different areas on the probed surface. Here, we apply the Jarzynski equality for the analysis of FFM measurements and thus obtain a variation of the free energy along a surface.

Direct Observation of Domain-Wall Surface Tension by Deflating or Inflating a Magnetic Bubble

NASA Astrophysics Data System (ADS)

Zhang, Xueying; Vernier, Nicolas; Zhao, Weisheng; Yu, Haiming; Vila, Laurent; Zhang, Yue; Ravelosona, Dafiné

2018-02-01

The surface energy of a magnetic domain wall (DW) strongly affects its static and dynamic behaviors. However, this effect is seldom directly observed, and some of the related phenomena are not well understood. Moreover, a reliable method to quantify the DW surface energy is still absent. Here, we report a series of experiments in which the DW surface energy becomes a dominant parameter. We observe that a semicircular magnetic domain bubble can spontaneously collapse under the Laplace pressure induced by DW surface energy. We further demonstrate that the surface energy can lead to a geometrically induced pinning when the DW propagates in a Hall cross or from a nanowire into a nucleation pad. Based on these observations, we develop two methods to quantify the DW surface energy, which can be very helpful in the estimation of intrinsic parameters such as Dzyaloshinskii-Moriya interactions or exchange stiffness in magnetic ultrathin films.

A strategy for analysis of (molecular) equilibrium simulations: Configuration space density estimation, clustering, and visualization

NASA Astrophysics Data System (ADS)

Hamprecht, Fred A.; Peter, Christine; Daura, Xavier; Thiel, Walter; van Gunsteren, Wilfred F.

2001-02-01

We propose an approach for summarizing the output of long simulations of complex systems, affording a rapid overview and interpretation. First, multidimensional scaling techniques are used in conjunction with dimension reduction methods to obtain a low-dimensional representation of the configuration space explored by the system. A nonparametric estimate of the density of states in this subspace is then obtained using kernel methods. The free energy surface is calculated from that density, and the configurations produced in the simulation are then clustered according to the topography of that surface, such that all configurations belonging to one local free energy minimum form one class. This topographical cluster analysis is performed using basin spanning trees which we introduce as subgraphs of Delaunay triangulations. Free energy surfaces obtained in dimensions lower than four can be visualized directly using iso-contours and -surfaces. Basin spanning trees also afford a glimpse of higher-dimensional topographies. The procedure is illustrated using molecular dynamics simulations on the reversible folding of peptide analoga. Finally, we emphasize the intimate relation of density estimation techniques to modern enhanced sampling algorithms.

Generating Converged Accurate Free Energy Surfaces for Chemical Reactions with a Force-Matched Semiempirical Model.

PubMed

Kroonblawd, Matthew P; Pietrucci, Fabio; Saitta, Antonino Marco; Goldman, Nir

2018-04-10

We demonstrate the capability of creating robust density functional tight binding (DFTB) models for chemical reactivity in prebiotic mixtures through force matching to short time scale quantum free energy estimates. Molecular dynamics using density functional theory (DFT) is a highly accurate approach to generate free energy surfaces for chemical reactions, but the extreme computational cost often limits the time scales and range of thermodynamic states that can feasibly be studied. In contrast, DFTB is a semiempirical quantum method that affords up to a thousandfold reduction in cost and can recover DFT-level accuracy. Here, we show that a force-matched DFTB model for aqueous glycine condensation reactions yields free energy surfaces that are consistent with experimental observations of reaction energetics. Convergence analysis reveals that multiple nanoseconds of combined trajectory are needed to reach a steady-fluctuating free energy estimate for glycine condensation. Predictive accuracy of force-matched DFTB is demonstrated by direct comparison to DFT, with the two approaches yielding surfaces with large regions that differ by only a few kcal mol -1 .

Generating Converged Accurate Free Energy Surfaces for Chemical Reactions with a Force-Matched Semiempirical Model

DOE PAGES

Kroonblawd, Matthew P.; Pietrucci, Fabio; Saitta, Antonino Marco; ...

2018-03-15

Here, we demonstrate the capability of creating robust density functional tight binding (DFTB) models for chemical reactivity in prebiotic mixtures through force matching to short time scale quantum free energy estimates. Molecular dynamics using density functional theory (DFT) is a highly accurate approach to generate free energy surfaces for chemical reactions, but the extreme computational cost often limits the time scales and range of thermodynamic states that can feasibly be studied. In contrast, DFTB is a semiempirical quantum method that affords up to a thousandfold reduction in cost and can recover DFT-level accuracy. Here, we show that a force-matched DFTBmore » model for aqueous glycine condensation reactions yields free energy surfaces that are consistent with experimental observations of reaction energetics. Convergence analysis reveals that multiple nanoseconds of combined trajectory are needed to reach a steady-fluctuating free energy estimate for glycine condensation. Predictive accuracy of force-matched DFTB is demonstrated by direct comparison to DFT, with the two approaches yielding surfaces with large regions that differ by only a few kcal mol –1.« less

Generating Converged Accurate Free Energy Surfaces for Chemical Reactions with a Force-Matched Semiempirical Model

DOE Office of Scientific and Technical Information (OSTI.GOV)

Kroonblawd, Matthew P.; Pietrucci, Fabio; Saitta, Antonino Marco

Here, we demonstrate the capability of creating robust density functional tight binding (DFTB) models for chemical reactivity in prebiotic mixtures through force matching to short time scale quantum free energy estimates. Molecular dynamics using density functional theory (DFT) is a highly accurate approach to generate free energy surfaces for chemical reactions, but the extreme computational cost often limits the time scales and range of thermodynamic states that can feasibly be studied. In contrast, DFTB is a semiempirical quantum method that affords up to a thousandfold reduction in cost and can recover DFT-level accuracy. Here, we show that a force-matched DFTBmore » model for aqueous glycine condensation reactions yields free energy surfaces that are consistent with experimental observations of reaction energetics. Convergence analysis reveals that multiple nanoseconds of combined trajectory are needed to reach a steady-fluctuating free energy estimate for glycine condensation. Predictive accuracy of force-matched DFTB is demonstrated by direct comparison to DFT, with the two approaches yielding surfaces with large regions that differ by only a few kcal mol –1.« less

Estimation of Key Parameters of the Coupled Energy and Water Model by Assimilating Land Surface Data

NASA Astrophysics Data System (ADS)

Abdolghafoorian, A.; Farhadi, L.

2017-12-01

Accurate estimation of land surface heat and moisture fluxes, as well as root zone soil moisture, is crucial in various hydrological, meteorological, and agricultural applications. Field measurements of these fluxes are costly and cannot be readily scaled to large areas relevant to weather and climate studies. Therefore, there is a need for techniques to make quantitative estimates of heat and moisture fluxes using land surface state observations that are widely available from remote sensing across a range of scale. In this work, we applies the variational data assimilation approach to estimate land surface fluxes and soil moisture profile from the implicit information contained Land Surface Temperature (LST) and Soil Moisture (SM) (hereafter the VDA model). The VDA model is focused on the estimation of three key parameters: 1- neutral bulk heat transfer coefficient (CHN), 2- evaporative fraction from soil and canopy (EF), and 3- saturated hydraulic conductivity (Ksat). CHN and EF regulate the partitioning of available energy between sensible and latent heat fluxes. Ksat is one of the main parameters used in determining infiltration, runoff, groundwater recharge, and in simulating hydrological processes. In this study, a system of coupled parsimonious energy and water model will constrain the estimation of three unknown parameters in the VDA model. The profile of SM (LST) at multiple depths is estimated using moisture diffusion (heat diffusion) equation. In this study, the uncertainties of retrieved unknown parameters and fluxes are estimated from the inverse of Hesian matrix of cost function which is computed using the Lagrangian methodology. Analysis of uncertainty provides valuable information about the accuracy of estimated parameters and their correlation and guide the formulation of a well-posed estimation problem. The results of proposed algorithm are validated with a series of experiments using a synthetic data set generated by the simultaneous heat and water (SHAW) model. In addition, the feasibility of extending this algorithm to use remote sensing observations that have low temporal resolution is examined by assimilating the limited number of land surface moisture and temperature observations.

Mapping apparent stress and energy radiation over fault zones of major earthquakes

USGS Publications Warehouse

McGarr, A.; Fletcher, Joe B.

2002-01-01

Using published slip models for five major earthquakes, 1979 Imperial Valley, 1989 Loma Prieta, 1992 Landers, 1994 Northridge, and 1995 Kobe, we produce maps of apparent stress and radiated seismic energy over their fault surfaces. The slip models, obtained by inverting seismic and geodetic data, entail the division of the fault surfaces into many subfaults for which the time histories of seismic slip are determined. To estimate the seismic energy radiated by each subfault, we measure the near-fault seismic-energy flux from the time-dependent slip there and then multiply by a function of rupture velocity to obtain the corresponding energy that propagates into the far-field. This function, the ratio of far-field to near-fault energy, is typically less than 1/3, inasmuch as most of the near-fault energy remains near the fault and is associated with permanent earthquake deformation. Adding the energy contributions from all of the subfaults yields an estimate of the total seismic energy, which can be compared with independent energy estimates based on seismic-energy flux measured in the far-field, often at teleseismic distances. Estimates of seismic energy based on slip models are robust, in that different models, for a given earthquake, yield energy estimates that are in close agreement. Moreover, the slip-model estimates of energy are generally in good accord with independent estimates by others, based on regional or teleseismic data. Apparent stress is estimated for each subfault by dividing the corresponding seismic moment into the radiated energy. Distributions of apparent stress over an earthquake fault zone show considerable heterogeneity, with peak values that are typically about double the whole-earthquake values (based on the ratio of seismic energy to seismic moment). The range of apparent stresses estimated for subfaults of the events studied here is similar to the range of apparent stresses for earthquakes in continental settings, with peak values of about 8 MPa in each case. For earthquakes in compressional tectonic settings, peak apparent stresses at a given depth are substantially greater than corresponding peak values from events in extensional settings; this suggests that crustal strength, inferred from laboratory measurements, may be a limiting factor. Lower bounds on shear stresses inferred from the apparent stress distribution of the 1995 Kobe earthquake are consistent with tectonic-stress estimates reported by Spudich et al. (1998), based partly on slip-vector rake changes.

Surface energy from order parameter profile: At the QCD phase transition

NASA Technical Reports Server (NTRS)

Frei, Z.; Patkos, A.

1989-01-01

The order parameter profile between coexisting confined and plasma regions at the quantum chromodynamic (QCD) phase transition is constructed. The dimensionless combination of the surface energy (Sigma) and the correlation length (Zeta) is estimated to be Sigma Zeta 3 approximately equals 0.8.

Using a thermal-based two source energy balance model with time-differencing to estimate surface energy fluxes with day-night MODIS observations

NASA Astrophysics Data System (ADS)

Guzinski, R.; Anderson, M. C.; Kustas, W. P.; Nieto, H.; Sandholt, I.

2013-02-01

The Dual Temperature Difference (DTD) model, introduced by Norman et al. (2000), uses a two source energy balance modelling scheme driven by remotely sensed observations of diurnal changes in land surface temperature (LST) to estimate surface energy fluxes. By using a time differential temperature measurement as input, the approach reduces model sensitivity to errors in absolute temperature retrieval. The original formulation of the DTD required an early morning LST observation (approximately 1 h after sunrise) when surface fluxes are minimal, limiting application to data provided by geostationary satellites at sub-hourly temporal resolution. The DTD model has been applied primarily during the active growth phase of agricultural crops and rangeland vegetation grasses, and has not been rigorously evaluated during senescence or in forested ecosystems. In this paper we present modifications to the DTD model that enable applications using thermal observation from polar orbiting satellites, such as Terra and Aqua, with day and night overpass times over the area of interest. This allows the application of the DTD model in high latitude regions where large viewing angles preclude the use of geostationary satellites, and also exploits the higher spatial resolution provided by polar orbiting satellites. A method for estimating nocturnal surface fluxes and a scheme for estimating the fraction of green vegetation are developed and evaluated. Modification for green vegetation fraction leads to significantly improved estimation of the heat fluxes from the vegetation canopy during senescence and in forests. Land-cover based modifications to the Priestley-Taylor scheme, used to estimate transpiration fluxes, are explored based on prior findings for conifer forests. When the modified DTD model is run with LST measurements acquired with the Moderate Resolution Imaging Spectroradiometer (MODIS) on board the Terra and Aqua satellites, generally satisfactory agreement with field measurements is obtained for a number of ecosystems in Denmark and the United States. Finally, regional maps of energy fluxes are produced for the Danish Hydrological ObsErvatory (HOBE) in western Denmark, indicating realistic patterns based on land use.

A revised energy-balance framework for the Earth

NASA Astrophysics Data System (ADS)

Dessler, A. E.

2017-12-01

Some of the most important conclusions of climate science are based on energy balance calculations, in which solar energy absorbed by the Earth system is set equal to infrared energy radiated to space. Traditionally, energy radiated to space is assumed to be proportional to surface temperature. We show here problems with this framework, including potential biases in estimates of climate sensitivity based on the 20th-century historical record. This could potentially explain why estimates of equilibrium climate sensitivity (ECS) using observations over the 20th century yield values lower than other estimates. We then present a modified version of the energy balance framework in which energy radiated to space is assumed to be proportional to tropical atmospheric temperature. We use this new framework to estimate ECS and obtain an estimate of 3°C, with a likely range (66% confidence interval) of 2.2-4.1°C.

Uncertainty analysis of the Operational Simplified Surface Energy Balance (SSEBop) model at multiple flux tower sites

USGS Publications Warehouse

Chen, Mingshi; Senay, Gabriel B.; Singh, Ramesh K.; Verdin, James P.

2016-01-01

Evapotranspiration (ET) is an important component of the water cycle – ET from the land surface returns approximately 60% of the global precipitation back to the atmosphere. ET also plays an important role in energy transport among the biosphere, atmosphere, and hydrosphere. Current regional to global and daily to annual ET estimation relies mainly on surface energy balance (SEB) ET models or statistical and empirical methods driven by remote sensing data and various climatological databases. These models have uncertainties due to inevitable input errors, poorly defined parameters, and inadequate model structures. The eddy covariance measurements on water, energy, and carbon fluxes at the AmeriFlux tower sites provide an opportunity to assess the ET modeling uncertainties. In this study, we focused on uncertainty analysis of the Operational Simplified Surface Energy Balance (SSEBop) model for ET estimation at multiple AmeriFlux tower sites with diverse land cover characteristics and climatic conditions. The 8-day composite 1-km MODerate resolution Imaging Spectroradiometer (MODIS) land surface temperature (LST) was used as input land surface temperature for the SSEBop algorithms. The other input data were taken from the AmeriFlux database. Results of statistical analysis indicated that the SSEBop model performed well in estimating ET with an R2 of 0.86 between estimated ET and eddy covariance measurements at 42 AmeriFlux tower sites during 2001–2007. It was encouraging to see that the best performance was observed for croplands, where R2 was 0.92 with a root mean square error of 13 mm/month. The uncertainties or random errors from input variables and parameters of the SSEBop model led to monthly ET estimates with relative errors less than 20% across multiple flux tower sites distributed across different biomes. This uncertainty of the SSEBop model lies within the error range of other SEB models, suggesting systematic error or bias of the SSEBop model is within the normal range. This finding implies that the simplified parameterization of the SSEBop model did not significantly affect the accuracy of the ET estimate while increasing the ease of model setup for operational applications. The sensitivity analysis indicated that the SSEBop model is most sensitive to input variables, land surface temperature (LST) and reference ET (ETo); and parameters, differential temperature (dT), and maximum ET scalar (Kmax), particularly during the non-growing season and in dry areas. In summary, the uncertainty assessment verifies that the SSEBop model is a reliable and robust method for large-area ET estimation. The SSEBop model estimates can be further improved by reducing errors in two input variables (ETo and LST) and two key parameters (Kmax and dT).

Dynamics of heat storage in evapotranspiration estimate

USDA-ARS?s Scientific Manuscript database

One of the widely discussed reasons for a lack of surface energy balance closure when using eddy covariance is neglect of storage term elements. Storage as related to the surface energy balance refers to all heat stored below the observation level of eddies. It represents the sum of several componen...

Performance of five surface energy balance models for estimating daily evapotranspiration in high biomass sorghum

NASA Astrophysics Data System (ADS)

Wagle, Pradeep; Bhattarai, Nishan; Gowda, Prasanna H.; Kakani, Vijaya G.

2017-06-01

Robust evapotranspiration (ET) models are required to predict water usage in a variety of terrestrial ecosystems under different geographical and agrometeorological conditions. As a result, several remote sensing-based surface energy balance (SEB) models have been developed to estimate ET over large regions. However, comparison of the performance of several SEB models at the same site is limited. In addition, none of the SEB models have been evaluated for their ability to predict ET in rain-fed high biomass sorghum grown for biofuel production. In this paper, we evaluated the performance of five widely used single-source SEB models, namely Surface Energy Balance Algorithm for Land (SEBAL), Mapping ET with Internalized Calibration (METRIC), Surface Energy Balance System (SEBS), Simplified Surface Energy Balance Index (S-SEBI), and operational Simplified Surface Energy Balance (SSEBop), for estimating ET over a high biomass sorghum field during the 2012 and 2013 growing seasons. The predicted ET values were compared against eddy covariance (EC) measured ET (ETEC) for 19 cloud-free Landsat image. In general, S-SEBI, SEBAL, and SEBS performed reasonably well for the study period, while METRIC and SSEBop performed poorly. All SEB models substantially overestimated ET under extremely dry conditions as they underestimated sensible heat (H) and overestimated latent heat (LE) fluxes under dry conditions during the partitioning of available energy. METRIC, SEBAL, and SEBS overestimated LE regardless of wet or dry periods. Consequently, predicted seasonal cumulative ET by METRIC, SEBAL, and SEBS were higher than seasonal cumulative ETEC in both seasons. In contrast, S-SEBI and SSEBop substantially underestimated ET under too wet conditions, and predicted seasonal cumulative ET by S-SEBI and SSEBop were lower than seasonal cumulative ETEC in the relatively wetter 2013 growing season. Our results indicate the necessity of inclusion of soil moisture or plant water stress component in SEB models for the improvement of their performance, especially under too dry or wet environments.

Absolute binding free energies between T4 lysozyme and 141 small molecules: calculations based on multiple rigid receptor configurations

PubMed Central

Xie, Bing; Nguyen, Trung Hai; Minh, David D. L.

2017-01-01

We demonstrate the feasibility of estimating protein-ligand binding free energies using multiple rigid receptor configurations. Based on T4 lysozyme snapshots extracted from six alchemical binding free energy calculations with a flexible receptor, binding free energies were estimated for a total of 141 ligands. For 24 ligands, the calculations reproduced flexible-receptor estimates with a correlation coefficient of 0.90 and a root mean square error of 1.59 kcal/mol. The accuracy of calculations based on Poisson-Boltzmann/Surface Area implicit solvent was comparable to previously reported free energy calculations. PMID:28430432

Excitonic mechanism of the photoinduced surface restructuring of copper

DOE Office of Scientific and Technical Information (OSTI.GOV)

Molotskii, Michel

An explanation for the photoinduced reconstruction of Cu single-crystal surfaces that was observed by Ernst et al. [Science 279, 679 (1998)] under the influence of visible light is proposed. It is suggested that reconstruction can be attributed to the energy released during the nonradiative decay of excitons that were excited by light irradiation and captured on surface active centers. The estimates performed show that exciton decay on surface steps and adatoms releases enough energy to create surface defects.

Soil Moisture or Groundwater?

NASA Astrophysics Data System (ADS)

Swenson, S. C.; Lawrence, D. M.

2017-12-01

Partitioning the vertically integrated water storage variations estimated from GRACE satellite data into the components of which it is comprised requires independent information. Land surface models, which simulate the transfer and storage of moisture and energy at the land surface, are often used to estimate water storage variability of snow, surface water, and soil moisture. To obtain an estimate of changes in groundwater, the estimates of these storage components are removed from GRACE data. Biases in the modeled water storage components are therefore present in the residual groundwater estimate. In this study, we examine how soil moisture variability, estimated using the Community Land Model (CLM), depends on the vertical structure of the model. We then explore the implications of this uncertainty in the context of estimating groundwater variations using GRACE data.

A Reexamination of the Emergy Input to a System from the ...

EPA Pesticide Factsheets

The wind energy absorbed in the global boundary layer (GBL, 900 mb surface) is the basis for calculating the wind emergy input for any system on the Earth’s surface. Estimates of the wind emergy input to a system depend on the amount of wind energy dissipated, which can have a range of magnitudes for a given velocity depending on surface drag and atmospheric stability at the location and time period under study. In this study, we develop a method to consider this complexity in estimating the emergy input to a system from the wind. A new calculation of the transformity of the wind energy dissipated in the GBL (900 mb surface) based on general models of atmospheric circulation in the planetary boundary layer (PBL, 100 mb surface) is presented and expressed on the 12.0E+24 seJ y-1 geobiosphere baseline to complete the information needed to calculate the emergy input from the wind to the GBL of any system. The average transformity of wind energy dissipated in the GBL (below 900 mb) was 1241±650 sej J-1. The analysis showed that the transformity of the wind varies over the course of a year such that summer processes may require a different wind transformity than processes occurring with a winter or annual time boundary. This is a paper in the proceedings of Emergy Synthesis 9, thus it will be available online for those interested in this subject. The paper describes a new and more accurate way to estimate the wind energy input to any system. It also has a new cal

Upscaling and Downscaling of Land Surface Fluxes with Surface Temperature

NASA Astrophysics Data System (ADS)

Kustas, W. P.; Anderson, M. C.; Hain, C.; Albertson, J. D.; Gao, F.; Yang, Y.

2015-12-01

Land surface temperature (LST) is a key surface boundary condition that is significantly correlated to surface flux partitioning between latent and sensible heat. The spatial and temporal variation in LST is driven by radiation, wind, vegetation cover and roughness as well as soil moisture status in the surface and root zone. Data from airborne and satellite-based platforms provide LST from ~10 km to sub meter resolutions. A land surface scheme called the Two-Source Energy Balance (TSEB) model has been incorporated into a multi-scale regional modeling system ALEXI (Atmosphere Land Exchange Inverse) and a disaggregation scheme (DisALEXI) using higher resolution LST. Results with this modeling system indicates that it can be applied over heterogeneous land surfaces and estimate reliable surface fluxes with minimal in situ information. Consequently, this modeling system allows for scaling energy fluxes from subfield to regional scales in regions with little ground data. In addition, the TSEB scheme has been incorporated into a large Eddy Simulation (LES) model for investigating dynamic interactions between variations in the land surface state reflected in the spatial pattern in LST and the lower atmospheric air properties affecting energy exchange. An overview of research results on scaling of fluxes and interactions with the lower atmosphere from the subfield level to regional scales using the TSEB, ALEX/DisALEX and the LES-TSEB approaches will be presented. Some unresolved issues in the use of LST at different spatial resolutions for estimating surface energy balance and upscaling fluxes, particularly evapotranspiration, will be discussed.

Surface diffusion on SrTiO3 (100): A temperature accelerated dynamics and first principles study

NASA Astrophysics Data System (ADS)

Hong, Minki; Wohlwend, Jennifer L.; Behera, Rakesh K.; Phillpot, Simon R.; Sinnott, Susan B.; Uberuaga, Blas P.

2013-11-01

Temperature accelerated dynamics (TAD) with an empirical potential is used to predict diffusion mechanisms and energy barriers associated with surface diffusion of adatoms and surface vacancies on (100) SrTiO3 (STO). Specifically, Sr, O, and Ti adatoms and vacancies are investigated on each termination - SrO and TiO2 - of the SrTiO3 surface. We find that the empirical potential predicts different surface mobility of adatoms depending on the surface termination: they are mobile with relatively low diffusion barriers on the SrO-terminated surface, whereas they are largely immobile on the TiO2-terminated surface. One important finding is that, of the two binding sites on the SrO-terminated surface, one is typically very close in energy to the saddle point. Thus, one of the two sites is a good estimator of the migration energy of the adatom, a conclusion supported by select density functional theory (DFT) calculations. Motivated by this result, we calculate the migration energies for a number of metal elements on the SrO-terminated surface: Ti, Ba, La, and Al. The DFT results also reveal that the details of the migration mechanism depend on the charge state of the diffusing species and that the ability of the empirical potential to properly estimate the migration mechanism depends on the magnitude and variability of the charge transfer between the adatom and the surface.

Application of the Generalized Nonlinear Complementary Relationship for Estimating Evaporation in North China

NASA Astrophysics Data System (ADS)

Yu, M.; Wu, B.

2017-12-01

As an important part of the coupled Eco-Hydrological processes, evaporation is the bond for exchange of energy and heat between the surface and the atmosphere. However, the estimation of evaporation remains a challenge compared with other main hydrological factors in water cycle. The complementary relationship which proposed by Bouchet (1963) has laid the foundation for various approaches to estimate evaporation from land surfaces, the essence of the principle is a relationship between three types of evaporation in the environment. It can simply implemented with routine meteorological data without the need for resistance parameters of the vegetation and bare land, which are difficult to observed and complicated to estimate in most surface flux models. On this basis the generalized nonlinear formulation was proposed by Brutsaert (2015). The daily evaporation can be estimated once the potential evaporation (Epo) and apparent potential evaporation (Epa) are known. The new formulation has a strong physical basis and can be expected to perform better under natural water stress conditions, nevertheless, the model has not been widely validated over different climate types and underlying surface patterns. In this study, we attempted to apply the generalized nonlinear complementary relationship in North China, three flux stations in North China are used for testing the universality and accuracy of this model against observed evaporation over different vegetation types, including Guantao Site, Miyun Site and Huailai Site. Guantao Site has double-cropping systems and crop rotations with summer maize and winter wheat; the other two sites are dominated by spring maize. Detailed measurements of meteorological factors at certain heights above ground surface from automatic weather stations offered necessary parameters for daily evaporation estimation. Using the Bowen ratio, the surface energy measured by the eddy covariance systems at the flux stations is adjusted on a daily scale to satisfy the surface energy closure. After calibration the estimated daily evaporation are in good agreement with EC-measured flux data with a mean correlation coefficient in excess of 0.85. The results indicate that the generalized nonlinear complementary relationship can be applied in plant growing and non-growing season in North China.

Estimating Morning Change in Land Surface Temperature from MODIS Day/Night Observations: Applications for Surface Energy Balance Modeling.

PubMed

Hain, Christopher R; Anderson, Martha C

2017-10-16

Observations of land surface temperature (LST) are crucial for the monitoring of surface energy fluxes from satellite. Methods that require high temporal resolution LST observations (e.g., from geostationary orbit) can be difficult to apply globally because several geostationary sensors are required to attain near-global coverage (60°N to 60°S). While these LST observations are available from polar-orbiting sensors, providing global coverage at higher spatial resolutions, the temporal sampling (twice daily observations) can pose significant limitations. For example, the Atmosphere Land Exchange Inverse (ALEXI) surface energy balance model, used for monitoring evapotranspiration and drought, requires an observation of the morning change in LST - a quantity not directly observable from polar-orbiting sensors. Therefore, we have developed and evaluated a data-mining approach to estimate the mid-morning rise in LST from a single sensor (2 observations per day) of LST from the Moderate Resolution Imaging Spectroradiometer (MODIS) sensor on the Aqua platform. In general, the data-mining approach produced estimates with low relative error (5 to 10%) and statistically significant correlations when compared against geostationary observations. This approach will facilitate global, near real-time applications of ALEXI at higher spatial and temporal coverage from a single sensor than currently achievable with current geostationary datasets.

A simple tool for estimating city-wide annual electrical energy savings from cooler surfaces

DOE PAGES

Pomerantz, Melvin; Rosado, Pablo J.; Levinson, Ronnen

2015-07-26

We present a simple method to estimate the maximum possible energy saving that might be achieved by increasing the albedo of surfaces in a large city. We restrict this to the "indirect effect", the cooling of outside air that lessens the demand for air conditioning (AC). Given the power demand of the electric utilities and data about the city, we can use a single linear equation to estimate the maximum saving. For example, the result for an albedo change of 0.2 of pavements in a typical warm city in California, such as Sacramento, is that the saving is less thanmore » about 2 kWh per m 2 per year. This may help decision makers choose which heat island mitigation techniques are economical from an energy-saving perspective.« less

Fluoroalkylated Silicon-Containing Surfaces - Estimation of Solid Surface Energy

DTIC Science & Technology

2010-10-20

surface tension liquids such as octane (γlv = 21.6 mN/m) and methanol (γlv = 22.7 mN/m), requires an appropriately chosen surface micro/nano-texture in...addition to a low solid surface energy (γsv). 1H,1H,2H,2H- Heptadecafluorodecyl polyhedral oligomeric silsesquioxane (fluorodecyl POSS) offers one of...27.5 mN/m), while Girifalco-Good analysis was performed using a set of polar and non-polar liquids with a wider range of liquid surface tension (15.5

Atomic steps on an ultraflat Si(111) surface upon sublimation

DOE Office of Scientific and Technical Information (OSTI.GOV)

Sitnikov, S. V., E-mail: sitnikov@isp.nsc.ru; Latyshev, A. V.; Kosolobov, S. S.

2016-05-15

The kinetics of atomic steps on an ultraflat Si(111) surface is studied by in situ ultrahigh-vacuum reflection electron microscopy at temperatures of 1050–1350°C. For the first time it is experimentally shown that the rate of displacement of an atomic step during sublimation nonlinearly depends on the width of the adjacent terrace. It is established that the atomic mechanism of mass-transport processes at the surface at temperatures higher than 1200°C is controlled by nucleation and the diffusion of surface vacancies rather than of adsorbed Si atoms. The studies make it possible to estimate the activation energy of the dissolution of vacanciesmore » from the surface into the bulk of Si. The estimated activation energy is (4.3 ± 0.05) eV.« less

Testing an Energy Balance Model for Estimating Actual Evapotranspiration Using Remotely Sensed Data. [Hannover, West Germany barley and wheat fields

NASA Technical Reports Server (NTRS)

Gurney, R. J.; Camillo, P. J.

1985-01-01

An energy-balance model is used to estimate daily evapotranspiration for 3 days for a barley field and a wheat field near Hannover, Federal Republic of Germany. The model was calibrated using once-daily estimates of surface temperatures, which may be remotely sensed. The evaporation estimates were within the 95% error bounds of independent eddy correlation estimates for the daytime periods for all three days for both sites, but the energy-balance estimates are generally higher; it is unclear which estimate is biassed. Soil moisture in the top 2 cm of soil, which may be remotely sensed, may be used to improve these evaporation estimates under partial ground cover. Sensitivity studies indicate the amount of ground data required is not excessive.

Improved Estimates of Temporally Coherent Internal Tides and Energy Fluxes from Satellite Altimetry

NASA Technical Reports Server (NTRS)

Ray, Richard D.; Chao, Benjamin F. (Technical Monitor)

2002-01-01

Satellite altimetry has opened a surprising new avenue to observing internal tides in the open ocean. The tidal surface signatures are very small, a few cm at most, but in many areas they are robust, owing to averaging over many years. By employing a simplified two dimensional wave fitting to the surface elevations in combination with climatological hydrography to define the relation between the surface height and the current and pressure at depth, we may obtain rough estimates of internal tide energy fluxes. Initial results near Hawaii with Topex/Poseidon (T/P) data show good agreement with detailed 3D (three dimensional) numerical models, but the altimeter picture is somewhat blurred owing to the widely spaced T/P tracks. The resolution may be enhanced somewhat by using data from the ERS-1 (ESA (European Space Agency) Remote Sensing) and ERS-2 satellite altimeters. The ERS satellite tracks are much more closely spaced (0.72 deg longitude vs. 2.83 deg for T/P), but the tidal estimates are less accurate than those for T/P. All altimeter estimates are also severely affected by noise in regions of high mesoscale variability, and we have obtained some success in reducing this contamination by employing a prior correction for mesoscale variability based on ten day detailed sea surface height maps developed by Le Traon and colleagues. These improvements allow us to more clearly define the internal tide surface field and the corresponding energy fluxes. Results from throughout the global ocean will be presented.

An intercomparison study of TSM, SEBS, and SEBAL using high-resolution imagery and lysimetric data

USDA-ARS?s Scientific Manuscript database

Over the past three decades, numerous remote sensing based ET mapping algorithms were developed. These algorithms provided a robust, economical, and efficient tool for ET estimations at field and regional scales. The Two Source Model (TSM), Surface Energy Balance System (SEBS), and Surface Energy Ba...

Comparison of four different energy balance models for estimating evapotranspiration in the Midwestern United States

USGS Publications Warehouse

Singh, Ramesh K.; Senay, Gabriel B.

2016-01-01

The development of different energy balance models has allowed users to choose a model based on its suitability in a region. We compared four commonly used models—Mapping EvapoTranspiration at high Resolution with Internalized Calibration (METRIC) model, Surface Energy Balance Algorithm for Land (SEBAL) model, Surface Energy Balance System (SEBS) model, and the Operational Simplified Surface Energy Balance (SSEBop) model—using Landsat images to estimate evapotranspiration (ET) in the Midwestern United States. Our models validation using three AmeriFlux cropland sites at Mead, Nebraska, showed that all four models captured the spatial and temporal variation of ET reasonably well with an R2 of more than 0.81. Both the METRIC and SSEBop models showed a low root mean square error (<0.93 mm·day−1) and a high Nash–Sutcliffe coefficient of efficiency (>0.80), whereas the SEBAL and SEBS models resulted in relatively higher bias for estimating daily ET. The empirical equation of daily average net radiation used in the SEBAL and SEBS models for upscaling instantaneous ET to daily ET resulted in underestimation of daily ET, particularly when the daily average net radiation was more than 100 W·m−2. Estimated daily ET for both cropland and grassland had some degree of linearity with METRIC, SEBAL, and SEBS, but linearity was stronger for evaporative fraction. Thus, these ET models have strengths and limitations for applications in water resource management.

Quantifying the Uncertainty in Estimates of Surface Atmosphere Fluxes by Evaluation of SEBS and SCOPE Models

NASA Astrophysics Data System (ADS)

Timmermans, J.; van der Tol, C.; Verhoef, A.; Wang, L.; van Helvoirt, M.; Verhoef, W.; Su, Z.

2009-11-01

An earth observation based evapotranspiration (ET) product is essential to achieving the GEWEX CEOP science objectives and to achieve the GEOSS water resources societal benefit areas. Conventional techniques that employ point measurements to estimate the components of the energy balance are only representative for local scales and cannot be extended to large areas because of the heterogeneity of the land surface and the dynamic nature of heat transfer processes.The objective of this research is to quantify the uncertainties of evapotranspiration estimates by the Surface Energy Balance System (SEBS) algorithm through validation against the detailed Soil Canopy Observation, Photochemistry and Energy fluxes process (SCOPE) model with site optimized parameters. This SCOPE model takes both radiative processes and biochemical processes into account; it combines the SAIL radiative transfer model with the energy balance at leaf level to simulate the interaction between surface and atmosphere. In this paper the validation results are presented for a semi long term dataset in Reading on 2002.The comparison between the two models showed a high correlation over the complete growth of maize capturing the daily variation to good extent. The absolute values of the SEBS model are however much lower compared to those of the SCOPE model. This is due to the fact the SEBS model uses a surface resistance parameterization that is unable to account of high vegetation. An update of the SEBS model will resolve this problem.

Estimation of Regional Evapotranspiration Using Remotely Sensed Land Surface Temperature. Part 2: Application of Equilibrium Evaporation Model to Estimate Evapotranspiration by Remote Sensing Technique. [Japan

NASA Technical Reports Server (NTRS)

Kotoda, K.; Nakagawa, S.; Kai, K.; Yoshino, M. M.; Takeda, K.; Seki, K.

1985-01-01

In a humid region like Japan, it seems that the radiation term in the energy balance equation plays a more important role for evapotranspiration then does the vapor pressure difference between the surface and lower atmospheric boundary layer. A Priestley-Taylor type equation (equilibrium evaporation model) is used to estimate evapotranspiration. Net radiation, soil heat flux, and surface temperature data are obtained. Only temperature data obtained by remotely sensed techniques are used.

Assessment of the global monthly mean surface insolation estimated from satellite measurements using global energy balance archive data

NASA Technical Reports Server (NTRS)

Li, Zhanqing; Whitlock, Charles H.; Charlock, Thomas P.

1995-01-01

Global sets of surface radiation budget (SRB) have been obtained from satellite programs. These satellite-based estimates need validation with ground-truth observations. This study validates the estimates of monthly mean surface insolation contained in two satellite-based SRB datasets with the surface measurements made at worldwide radiation stations from the Global Energy Balance Archive (GEBA). One dataset was developed from the Earth Radiation Budget Experiment (ERBE) using the algorithm of Li et al. (ERBE/SRB), and the other from the International Satellite Cloud Climatology Project (ISCCP) using the algorithm of Pinker and Laszlo and that of Staylor (GEWEX/SRB). Since the ERBE/SRB data contain the surface net solar radiation only, the values of surface insolation were derived by making use of the surface albedo data contained GEWEX/SRB product. The resulting surface insolation has a bias error near zero and a root-mean-square error (RMSE) between 8 and 28 W/sq m. The RMSE is mainly associated with poor representation of surface observations within a grid cell. When the number of surface observations are sufficient, the random error is estimated to be about 5 W/sq m with present satellite-based estimates. In addition to demonstrating the strength of the retrieving method, the small random error demonstrates how well the ERBE derives from the monthly mean fluxes at the top of the atmosphere (TOA). A larger scatter is found for the comparison of transmissivity than for that of insolation. Month to month comparison of insolation reveals a weak seasonal trend in bias error with an amplitude of about 3 W/sq m. As for the insolation data from the GEWEX/SRB, larger bias errors of 5-10 W/sq m are evident with stronger seasonal trends and almost identical RMSEs.

Utility of remote sensing-based surface energy balance models to track water stress in rain-fed switchgrass under dry and wet conditions

NASA Astrophysics Data System (ADS)

Bhattarai, Nishan; Wagle, Pradeep; Gowda, Prasanna H.; Kakani, Vijaya G.

2017-11-01

The ability of remote sensing-based surface energy balance (SEB) models to track water stress in rain-fed switchgrass (Panicum virgatum L.) has not been explored yet. In this paper, the theoretical framework of crop water stress index (CWSI; 0 = extremely wet or no water stress condition and 1 = extremely dry or no transpiration) was utilized to estimate CWSI in rain-fed switchgrass using Landsat-derived evapotranspiration (ET) from five remote sensing based single-source SEB models, namely Surface Energy Balance Algorithm for Land (SEBAL), Mapping ET with Internalized Calibration (METRIC), Surface Energy Balance System (SEBS), Simplified Surface Energy Balance Index (S-SEBI), and Operational Simplified Surface Energy Balance (SSEBop). CWSI estimates from the five SEB models and a simple regression model that used normalized difference vegetation index (NDVI), near-surface temperature difference, and measured soil moisture (SM) as covariates were compared with those derived from eddy covariance measured ET (CWSIEC) for the 32 Landsat image acquisition dates during the 2011 (dry) and 2013 (wet) growing seasons. Results indicate that most SEB models can predict CWSI reasonably well. For example, the root mean square error (RMSE) ranged from 0.14 (SEBAL) to 0.29 (SSEBop) and the coefficient of determination (R2) ranged from 0.25 (SSEBop) to 0.72 (SEBAL), justifying the added complexity in CWSI modeling as compared to results from the simple regression model (R2 = 0.55, RMSE = 0.16). All SEB models underestimated CWSI in the dry year but the estimates from SEBAL and S-SEBI were within 7% of the mean CWSIEC and explained over 60% of variations in CWSIEC. In the wet year, S-SEBI mostly overestimated CWSI (around 28%), while estimates from METRIC, SEBAL, SEBS, and SSEBop were within 8% of the mean CWSIEC. Overall, SEBAL was the most robust model under all conditions followed by METRIC, whose performance was slightly worse and better than SEBAL in dry and wet years, respectively. Underestimation of CWSI under extremely dry soil conditions and the substantial role of SM in the regression model suggest that integration of SM in SEB models could improve their performances under dry conditions. These insights will provide useful guidance on the broader applicability of SEB models for mapping water stresses in switchgrass under varying geographical and meteorological conditions.

Absolute surface energy calculations of Wurtzite (0001)/(000-1): a study of ZnO and GaN

NASA Astrophysics Data System (ADS)

Zhang, Jingzhao; Zhang, Yiou; Tse, Kinfai; Deng, Bei; Xu, Hu; Zhu, Junyi

The accurate absolute surface energies of (0001)/(000-1) surfaces of wurtzite structures are crucial in determining the thin film growth mode of important energy materials. However, the surface energies still remain to be solved due to the intrinsic difficulty of calculating dangling bond energy of asymmetrically bonded surface atoms. We used a pseudo-hydrogen passivation method to estimate the dangling bond energy and calculate the polar surfaces of ZnO and GaN. The calculations were based on the pseudo chemical potentials obtained from a set of tetrahedral clusters or simple pseudo-molecules, using density functional theory approaches, for both GGA and HSE. And the surface energies of (0001)/(000-1) surfaces of wurtzite ZnO and GaN we obtained showed relatively high self-consistencies. A wedge structure calculation with a new bottom surface passivation scheme of group I and group VII elements was also proposed and performed to show converged absolute surface energy of wurtzite ZnO polar surfaces. Part of the computing resources was provided by the High Performance Cluster Computing Centre, Hong Kong Baptist University. This work was supported by the start-up funding and direct Grant with the Project code of 4053134 at CUHK.

Atomistic simulations of bulk, surface and interfacial polymer properties

NASA Astrophysics Data System (ADS)

Natarajan, Upendra

In chapter I, quasi-static molecular mechanics based simulations are used to estimate the activation energy of phenoxy rings flips in the amorphous region of a semicrystalline polyimide. Intra and intermolecular contributions to the flip activation energy, the torsional cooperativity accompanying the flip, and the effect of the flip on the motion in the glassy bulk state, are looked at. Also, comparison of the weighted mean activation energy is made with experimental data from solid state NMR measurements; the simulated value being 17.5 kcal/mol., while the experimental value was observed to be 10.5 kcal/mol. Chapter II deals with construction of random copolymer thin films of styrene-butadiene (SB) and styrene-butadiene-acrylonitrile (SBA). The structure and properties of the free surfaces presented by these thin films are analysed by, the atom mass density profiles, backbone bond orientation function, and the spatial distribution of acrylonitrile groups and styrene rings. The surface energies of SB and SBA are calculated using an atomistic equation and are compared with experimental data in the literature. In chapter III, simulations of polymer-polymer interfaces between like and unlike polymers, specifically cis-polybutadiene (PBD) and atatic polypropylene (PP), are presented. The structure of an incompatible polymer-polymer interface, and the estimation of the thermodynamic work of adhesion and interfacial energy between different incompatible polymers, form the focus here. The work of adhesion is calculated using an atomistic equation and is further used in a macroscopic equation to estimate the interfacial energy. The interfacial energy is compared with typical values for other immiscible systems in the literature. The interfacial energy compared very well with interfacial energy values for a few other immiscible hydrocarbon pairs. In chapter IV, the study proceeds to look at the interactions between nonpolar and polar small molecules with SB and SBA thin film surfaces. Toluene, hexadecane and water molecules are separately simulated to interact with SB and SBA surfaces in vacuum. The energetics of interaction are calculated atomistically and used in the atomistic equation to calculate the interfacial energy or the interaction energy. Comparisons with experimental data are not made due to the small concentrations of the molecules on the polymer surface. However, fundamental understanding of the structure of the system and the breakup of the energetics are provided by such a study.

Spatiotemporal variability of water and energy fluxes: TERENO- prealpine hydrometeorological data analysis and inverse modeling with GEOtop and PEST

NASA Astrophysics Data System (ADS)

Soltani, M.; Kunstmann, H.; Laux, P.; Mauder, M.

2016-12-01

In mountainous and prealpine regions echohydrological processes exhibit rapid changes within short distances due to the complex orography and strong elevation gradients. Water- and energy fluxes between the land surface and the atmosphere are crucial drivers for nearly all ecosystem processes. The aim of this research is to analyze the variability of surface water- and energy fluxes by both comprehensive observational hydrometeorological data analysis and process-based high resolution hydrological modeling for a mountainous and prealpine region in Germany. We particularly focus on the closure of the observed energy balance and on the added value of energy flux observations for parameter estimation in our hydrological model (GEOtop) by inverse modeling using PEST. Our study area is the catchment of the river Rott (55 km2), being part of the TERENO prealpine observatory in Southern Germany, and we focus particularly on the observations during the summer episode May to July 2013. We present the coupling of GEOtop and the parameter estimation tool PEST, which is based on the Gauss-Marquardt-Levenberg method, a gradient-based nonlinear parameter estimation algorithm. Estimation of the surface energy partitioning during the data analysis process revealed that the latent heat flux was considered as the main consumer of available energy. The relative imbalance was largest during nocturnal periods. An energy imbalance was observed at the eddy-covariance site Fendt due to either underestimated turbulent fluxes or overestimated available energy. The calculation of the simulated energy and water balances for the entire catchment indicated that 78% of net radiation leaves the catchment as latent heat flux, 17% as sensible heat, and 5% enters the soil in the form of soil heat flux. 45% of the catchment aggregated precipitation leaves the catchment as discharge and 55% as evaporation. Using the developed GEOtop-PEST interface, the hydrological model is calibrated by comparing simulated and observed discharge, soil moisture and -temperature, sensible-, latent-, and soil heat fluxes. A reasonable quality of fit could be achieved. Uncertainty- and covariance analyses are performed, allowing the derivation of confidence intervals for all estimated parameters.

[A review on research of land surface water and heat fluxes].

PubMed

Sun, Rui; Liu, Changming

2003-03-01

Many field experiments were done, and soil-vegetation-atmosphere transfer(SVAT) models were stablished to estimate land surface heat fluxes. In this paper, the processes of experimental research on land surface water and heat fluxes are reviewed, and three kinds of SVAT model(single layer model, two layer model and multi-layer model) are analyzed. Remote sensing data are widely used to estimate land surface heat fluxes. Based on remote sensing and energy balance equation, different models such as simplified model, single layer model, extra resistance model, crop water stress index model and two source resistance model are developed to estimate land surface heat fluxes and evapotranspiration. These models are also analyzed in this paper.

Surface roughness estimation of MBE grown CdTe/GaAs(211)B by ex-situ spectroscopic ellipsometry

DOE Office of Scientific and Technical Information (OSTI.GOV)

Karakaya, Merve, E-mail: mervegunnar@iyte.edu.tr; Bilgilisoy, Elif; Arı, Ozan

Spectroscopic ellipsometry (SE) ranging from 1.24 eV to 5.05 eV is used to obtain the film thickness and optical properties of high index (211) CdTe films. A three-layer optical model (oxide/CdTe/GaAs) was chosen for the ex-situ ellipsometric data analysis. Surface roughness cannot be determined by the optical model if oxide is included. We show that roughness can be accurately estimated, without any optical model, by utilizing the correlation between SE data (namely the imaginary part of the dielectric function, or phase angle, ψ) and atomic force microscopy (AFM) roughness. and ψ values at 3.31 eV, which corresponds to E{sub 1}more » critical transition energy of CdTe band structure, are chosen for the correlation since E{sub 1} gives higher resolution than the other critical transition energies. On the other hand, due to the anisotropic characteristic of (211) oriented CdTe surfaces, SE data ( and ψ) shows varieties for different azimuthal angle measurements. For this reason, in order to estimate the surface roughness by considering these correlations, it is shown that SE measurements need to be taken at the same surface azimuthal angle. Estimating surface roughness in this manner is an accurate way to eliminate cumbersome surface roughness measurement by AFM.« less

Monitoring the spring-summer surface energy budget transition in the Gobi Desert using AVHRR GAC data. [Global Area Coverage

NASA Technical Reports Server (NTRS)

Smith, Eric A.; Reiter, Elmar R.

1986-01-01

A research program has been started in which operationally available weather satellites radiance data are used to reconstruct various properties of the diurnal surface energy budget over sites for which detailed estimates of the complete radiation, heat, and moisture exchange process are available. In this paper, preliminary analysis of the 1985 Gobi Desert summer period results is presented. The findings demonstrate various important relationships concerning the feasibility of retrieving the amplitudes of the diurnal surface energy budget processes for daytime and nighttime conditions.

Estimation of surface heat and moisture fluxes over a prairie grassland. I - In situ energy budget measurements incorporating a cooled mirror dew point hygrometer

NASA Technical Reports Server (NTRS)

Smith, Eric A.; Crosson, William L.; Tanner, Bertrand D.

1992-01-01

Attention is focused on in situ measurements taken during FIFE required to support the development and validation of a biosphere model. Seasonal time series of surface flux measurements obtained from two surface radiation and energy budget stations utilized to support the FIFE surface flux measurement subprogram are examined. Data collection and processing procedures are discussed along with the measurement analysis for the complete 1987 test period.

Hard X rays and low-energy gamma rays from the Moon: Dependence of the continuum on the regolith composition and the solar activity

NASA Astrophysics Data System (ADS)

Banerjee, D.; Gasnault, O.

2008-07-01

The primary aim of the high-energy X-ray spectrometer (HEX) experiment on the Chandrayaan-1 mission to the Moon is to characterize the movement of volatiles on the lunar surface through the detection of the 46.5 keV line from 210Pb, a decay product of 222Rn. An important consideration for design and operation of HEX is to estimate the continuum background signal expected from the lunar surface, as well as its dependence on solar activity and lunar composition. We have developed a Monte Carlo code utilizing Geant4 for simulating the interaction of cosmic rays in the lunar regolith, and we estimated the variation in the continuum background in the energy region of interest for various lunar compositions. Dependence of the continuum background on solar activity was also evaluated considering ferroan anorthositic (FAN) composition. Our results suggest the viability of inferring lithologic characteristics of planetary surfaces based on a study of low-energy gamma ray emission.

An Investigation on the role of Planetary Boundary Layer Parameterization scheme on the performance of a hydrostatic atmospheric model over a Coastal Region

NASA Astrophysics Data System (ADS)

Anurose, J. T.; Subrahamanyam, Bala D.

2012-07-01

As part of the ocean/land-atmosphere interaction, more than half of the total kinetic energy is lost within the lowest part of atmosphere, often referred to as the planetary boundary layer (PBL). A comprehensive understanding of the energetics of this layer and turbulent processes responsible for dissipation of kinetic energy within the PBL require accurate estimation of sensible and latent heat flux and momentum flux. In numerical weather prediction (NWP) models, these quantities are estimated through different surface-layer and PBL parameterization schemes. This research article investigates different factors influencing the accuracy of a surface-layer parameterization scheme used in a hydrostatic high-resolution regional model (HRM) in the estimation of surface-layer turbulent fluxes of heat, moisture and momentum over the coastal regions of the Indian sub-continent. Results obtained from this sensitivity study of a parameterization scheme in HRM revealed the role of surface roughness length (z_{0}) in conjunction with the temperature difference between the underlying ground surface and atmosphere above (ΔT = T_{G} - T_{A}) in the estimated values of fluxes. For grid points over the land surface where z_{0} is treated as a constant throughout the model integration time, ΔT showed relative dominance in the estimation of sensible heat flux. In contrast to this, estimation of sensible and latent heat flux over ocean were found to be equally sensitive on the method adopted for assigning the values of z_{0} and also on the magnitudes of ΔT.

Infrasound observation of the apparent North Korean nuclear test of 25 May 2009

NASA Astrophysics Data System (ADS)

Che, Il-Young; Kim, Tae Sung; Jeon, Jeong-Soo; Lee, Hee-Il

2009-11-01

On 25 May 2009, a seismic event (mb 4.6) was recorded from a source in northeastern North Korea, close to the location of a previous seismic event on 9 October 2006. Both events have been declared to be nuclear tests by North Korea. For the more recent test, five seismo-acoustic arrays in South Korea recorded epicentral infrasonic signals. The signals are characterized by amplitudes from 0.16 to 0.35 microbar and dominant frequencies between 0.8 and 4.3 Hz. Celerities determined for the arrivals suggest that most of the infrasonic energy travelled as a stratospheric phase. Based on observed stratospheric amplitudes, the epicentral infrasonic energy was estimated to be equivalent to that expected from 3.0 tons of high explosives detonated on the surface. We conclude that this small energy estimate is due to the atmospheric coupling from the strong surface ground motion rather than the direct transfer of explosion energy to the air. This relatively small infrasonic to seismic energy ratio could be used to distinguish the event from a common surface explosion.

Applications of a thermal-based two-source energy balance model using Priestley-Taylor approach for surface temperature partitioning (TSEB_PTT) under advective conditions

USDA-ARS?s Scientific Manuscript database

Operational application of the two source energy balance model (TSEB) which can estimate evaportranspiration (ET) and the components evaporation (E), transpiration (T) of the land surface in different climates is very useful for many applications in hydrology and agriculture. The TSEB model uses an ...

Application of remote sensing-based two-source energy balance model for mapping field surface fluxes with composite and component surface temperatures

USDA-ARS?s Scientific Manuscript database

Operational application of a remote sensing-based two source energy balance model (TSEB) to estimate evaportranspiration (ET) and the components evaporation (E), transpiration (T) at a range of space and time scales is very useful for managing water resources in arid and semiarid watersheds. The TSE...

A Reexamination of the Emergy Input to a System from the Wind.

EPA Science Inventory

The wind energy absorbed in the global boundary layer (GBL, 900 mb surface) is the basis for calculating the wind emergy input for any system on the Earth’s surface. Estimates of the wind emergy input to a system depend on the amount of wind energy dissipated, which can have a ra...

Satellite remote sensing of surface energy and mass balance - Results from FIFE

NASA Technical Reports Server (NTRS)

Hall, F. G.; Markham, B. J.; Wang, J. R.; Huemmrich, F.; Sellers, P. J.; Strebel, D. E.; Kanemasu, E. T.; Kelly, Robert D.; Blad, Blaine L.

1991-01-01

Results obtained from the FIFE experiments conducted in 1987 and 1989 are summarized. Data analyses indicate that the hypotheses linking energy balance components to surface biology and remote sensing are reasonable at a point level, and that satellite remote sensing can potentially provide useful estimates of the surface energy budget. An investigation of atmospheric scattering and absorption effects on satellite remote sensing of surface radiance shows that the magnitude of atmospheric opacity variations within the FIFE site and with season can have a large effect on satellite measured values of surface radiances. Comparisons of atmospherically corrected TM radiances with surface measured radiances agreed to within about two percent at the visible and near-infrared wavelengths and to 6 percent in the midinfrared.

Calculation of Quasi-Particle Energies of Aromatic Self-Assembled Monolayers on Au(111).

PubMed

Li, Yan; Lu, Deyu; Galli, Giulia

2009-04-14

We present many-body perturbation theory calculations of the electronic properties of phenylene diisocyanide self-assembled monolayers (SAMs) on a gold surface. Using structural models obtained within density functional theory (DFT), we have investigated how the SAM molecular energies are modified by self-energy corrections and how they are affected by the presence of the surface. We have employed a combination of GW (G = Green's function; W = screened Coulomb interaction) calculations of the SAM quasi-particle energies and a semiclassical image potential model to account for surface polarization effects. We find that it is essential to include both quasi-particle corrections and surface screening in order to provide a reasonable estimate of the energy level alignment at a SAM-metal interface. In particular, our results show that within the GW approximation the energy distance between phenylene diisocyanide SAM energy levels and the gold surface Fermi level is much larger than that found within DFT, e.g., more than double in the case of low packing densities of the SAM.

Landsat and Sentinel-2A Surface Albedo Estimation and Evaluation Against In Situ Measurements Across the US SURFRAD Network

NASA Astrophysics Data System (ADS)

Franch, B.; Skakun, S.; Vermote, E.; Roger, J. C.

2017-12-01

Surface albedo is an essential parameter not only for developing climate models, but also for most energy balance studies. While climate models are usually applied at coarse resolution, the energy balance studies, which are mainly focused on agricultural applications, require a high spatial resolution. The albedo, estimated through the angular integration of the BRDF, requires an appropriate angular sampling of the surface. However, Sentinel-2A sampling characteristics, with nearly constant observation geometry and low illumination variation, prevent from deriving a surface albedo product. In this work, we apply an algorithm developed to derive a Landsat surface albedo to Sentinel-2A. It is based on the BRDF parameters estimated from the MODerate Resolution Imaging Spectroradiometer (MODIS) CMG surface reflectance product (M{O,Y}D09) using the VJB method (Vermote et al., 2009). Sentinel-2A unsupervised classification images are used to disaggregate the BRDF parameters to the Sentinel-2 spatial resolution. We test the results over five different sites of the US SURFRAD network and plot the results versus albedo field measurements. Additionally, we also test this methodology using Landsat-8 images.

Surface energy balance estimates at local and regional scales using optical remote sensing from an aircraft platform and atmospheric data collected over semiarid rangelands

USGS Publications Warehouse

Kustas, William P.; Moran, M.S.; Humes, K.S.; Stannard, D.I.; Pinter, P. J.; Hipps, L.E.; Swiatek, E.; Goodrich, D.C.

1994-01-01

Remotely sensed data in the visible, near-infrared, and thermal-infrared wave bands were collected from a low-flying aircraft during the Monsoon '90 field experiment. Monsoon '90 was a multidisciplinary experiment conducted in a semiarid watershed. It had as one of its objectives the quantification of hydrometeorological fluxes during the “monsoon” or wet season. The remote sensing observations along with micrometeprological and atmospheric boundary layer (ABL) data were used to compute the surface energy balance over a range of spatial scales. The procedure involved averaging multiple pixels along transects flown over the meteorological and flux (METFLUX) stations. Average values of the spectral reflectance and thermal-infrared temperatures were computed for pixels of order 10−1 to 101 km in length and were used with atmospheric data for evaluating net radiation (Rn), soil heat flux (G), and sensible (H) and latent (LE) heat fluxes at these same length scales. The model employs a single-layer resistance approach for estimating H that requires wind speed and air temperature in the ABL and a remotely sensed surface temperature. The values of Rn and G are estimated from remote sensing information together with near-surface observations of air temperature, relative humidity, and solar radiation. Finally, LE is solved as the residual term in the surface energy balance equation. Model calculations were compared to measurements from the METFLUX network for three days having different environmental conditions. Average percent differences for the three days between model and the METFLUX estimates of the local fluxes were about 5% for Rn, 20% for Gand H, and 15% for LE. Larger differences occurred during partly cloudy conditions because of errors in interpreting the remote sensing data and the higher spatial and temporal variation in the energy fluxes. Minor variations in modeled energy fluxes were observed when the pixel size representing the remote sensing inputs changed from 0.2 to 2 km. Regional scale estimates of the surface energy balance using bulk ABL properties for the model parameters and input variables and the 10-km pixel data differed from the METFLUX network averages by about 4% for Rn, 10% for G and H, and 15% for LE. Model sensitivity in calculating the turbulent fluxes H and LE to possible variations in key model parameters (i.e., the roughness lengths for heat and momentum) was found to be fairly significant. Therefore the reliability of the methods for estimating key model parameters and potential errors needs further testing over different ecosystems and environmental conditions.

Carbon Monoxide Hydrogenation on Ice Surfaces.

PubMed

Kuwahata, Kazuaki; Ohno, Kaoru

2018-03-14

We have performed density functional calculations to investigate the carbon monoxide hydrogenation reaction (H+CO→HCO), which is important in interstellar clouds. We found that the activation energy of the reaction on amorphous ice is lower than that on crystalline ice. In the course of this study, we demonstrated that it is roughly possible to use the excitation energy of the reactant molecule (CO) in place of the activation energy. This relationship holds also for small water clusters at the CCSD level of calculation and the two-layer-level ONIOM (CCSD : X3LYP) calculation. Generally, since it is computationally demanding to estimate activation energies of chemical reactions in a circumstance of many water molecules, this relationship enables one to determine the activation energy of this reaction on ice surfaces from the knowledge of the excitation energy of CO only. Incorporating quantum-tunneling effects, we discuss the reaction rate on ice surfaces. Our estimate that the reaction rate on amorphous ice is almost twice as large as that on crystalline ice is qualitatively consistent with the experimental evidence reported by Hidaka et al. [Chem. Phys. Lett., 2008, 456, 36.]. © 2018 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

Free Energy Reconstruction from Metadynamics or Adiabatic Free Energy Dynamics Simulations.

PubMed

Cuendet, Michel A; Tuckerman, Mark E

2014-08-12

In molecular dynamics simulations, most enhanced sampling methods are traditionally associated with one particular estimator to calculate the free energy surface (FES), such as the histogram, the mean force, or the bias potential. Here, we start from the realization that four enhanced sampling methods, metadynamics and well-tempered metadynamics (in their extended Lagrangian form), as well as driven adiabatic free energy dynamics (dAFED) and unified free energy dynamics (UFED), can be used in combination with any of the three above-mentioned FES estimators. We compare the convergence properties of these estimators on the alanine dipeptide and a sodium ion solvation shell. We find that the mean force estimator is superior in all cases. We also show that it can be marginally beneficial to combine information from the histogram and the force, provided that both are of comparable accuracy.

Reintroducing radiometric surface temperature into the Penman-Monteith formulation

NASA Astrophysics Data System (ADS)

Mallick, Kaniska; Boegh, Eva; Trebs, Ivonne; Alfieri, Joseph G.; Kustas, William P.; Prueger, John H.; Niyogi, Dev; Das, Narendra; Drewry, Darren T.; Hoffmann, Lucien; Jarvis, Andrew J.

2015-08-01

Here we demonstrate a novel method to physically integrate radiometric surface temperature (TR) into the Penman-Monteith (PM) formulation for estimating the terrestrial sensible and latent heat fluxes (H and λE) in the framework of a modified Surface Temperature Initiated Closure (STIC). It combines TR data with standard energy balance closure models for deriving a hybrid scheme that does not require parameterization of the surface (or stomatal) and aerodynamic conductances (gS and gB). STIC is formed by the simultaneous solution of four state equations and it uses TR as an additional data source for retrieving the "near surface" moisture availability (M) and the Priestley-Taylor coefficient (α). The performance of STIC is tested using high-temporal resolution TR observations collected from different international surface energy flux experiments in conjunction with corresponding net radiation (RN), ground heat flux (G), air temperature (TA), and relative humidity (RH) measurements. A comparison of the STIC outputs with the eddy covariance measurements of λE and H revealed RMSDs of 7-16% and 40-74% in half-hourly λE and H estimates. These statistics were 5-13% and 10-44% in daily λE and H. The errors and uncertainties in both surface fluxes are comparable to the models that typically use land surface parameterizations for determining the unobserved components (gS and gB) of the surface energy balance models. However, the scheme is simpler, has the capabilities for generating spatially explicit surface energy fluxes and independent of submodels for boundary layer developments. This article was corrected on 27 AUG 2015. See the end of the full text for details.

Temporal upscaling of instantaneous evapotranspiration on clear-sky days using the constant reference evaporative fraction method with fixed or variable surface resistances at two cropland sites

NASA Astrophysics Data System (ADS)

Tang, Ronglin; Li, Zhao-Liang; Sun, Xiaomin; Bi, Yuyun

2017-01-01

Surface evapotranspiration (ET) is an important component of water and energy in land and atmospheric systems. This paper investigated whether using variable surface resistances in the reference ET estimates from the full-form Penman-Monteith (PM) equation could improve the upscaled daily ET estimates in the constant reference evaporative fraction (EFr, the ratio of actual to reference grass/alfalfa ET) method on clear-sky days using ground-based measurements. Half-hourly near-surface meteorological variables and eddy covariance (EC) system-measured latent heat flux data on clear-sky days were collected at two sites with different climatic conditions, namely, the subhumid Yucheng station in northern China and the arid Yingke site in northwestern China and were used as the model input and ground-truth, respectively. The results showed that using the Food and Agriculture Organization (FAO)-PM equation, the American Society of Civil Engineers-PM equation, and the full-form PM equation to estimate the reference ET in the constant EFr method produced progressively smaller upscaled daily ET at a given time from midmorning to midafternoon. Using all three PM equations produced the best results at noon at both sites regardless of whether the energy imbalance of the EC measurements was closed. When the EC measurements were not corrected for energy imbalance, using variable surface resistance in the full-form PM equation could improve the ET upscaling in the midafternoon, but worse results may occur in the midmorning to noon. Site-to-site and time-to-time variations were found in the performances of a given PM equation (with fixed or variable surface resistances) before and after the energy imbalance was closed.

Hydration property of globular proteins: An analysis of solvation free energy by energy representation method

NASA Astrophysics Data System (ADS)

Saito, Hiroaki; Matubayasi, Nobuyuki; Nishikawa, Kiyoshi; Nagao, Hidemi

2010-09-01

Molecular dynamics simulations and solvation free energy calculations of five globular proteins (BPTI, RNase A, Lysozyme, β-lactoglobulin A, and α-chymotrypsinogen A) have been carried out to elucidate the hydration properties. Solvation free energies of the proteins with explicit solvent were estimated by energy representation (ER) method. The calculated solvation free energies were correlated with the solvent accessible surface area of hydrophilic portion, being consistent with the hydrophilic property of the proteins. These results showed that the ER method should be a powerful tool for estimating the hydration property of proteins, showing a progress of the free energy calculation with explicit solvent.

Estimation of equilibrium surface precipitation constants for trivalent metal sorption onto hydrous ferric oxide and calcite

NASA Astrophysics Data System (ADS)

Ragavan, Anpalaki J.; Adams, Dean V.

2009-06-01

Equilibrium constants for modeling surface precipitation of trivalent metal cations ( M) onto hydrous ferric oxide and calcite were estimated from linear correlations of standard state Gibbs free energies of formation, ( ΔGf,MvX(ss)0) of the surface precipitates. The surface precipitation reactions were derived from Farley et. al. [K.J. Farley, D.A. Dzombak, F.M.M. Morel, J. Colloid Interface Sci. 106 (1985) 226] surface precipitation model, which are based on surface complexation model coupled with solid solution representation for surface precipitation on the solid surface. The ΔGf,MvX(ss)0 values were correlated through the following linear free energy relations ΔGf,M(OH)3(ss)0-791.70r=0.1587ΔGn,M0-1273.07 and ΔGf,M2(CO3)3(ss)0-197.241r=0.278ΔGn,M0-1431.27 where 'ss' stands for the end-member solid component of surface precipitate, ΔGf,MvX(ss)0 is in kJ/mol, r is the Shannon-Prewitt radius of M in a given coordination state (nm), and ΔGn,M0 is the non-solvation contribution to the Gibbs free energy of formation of the aqueous M ion. Results indicate that the above surface precipitation correlations are useful tools where experimental data are not available.

Energy Costs of Urban Water Supply Systems: Evidence from India (Invited)

NASA Astrophysics Data System (ADS)

Malghan, D.; Mehta, V. K.; Goswami, R.

2013-12-01

For the first time in human history more people around the globe now live in urban centres rather than in rural settings. Although India's urban population proportion at 31% is still below the global average, it has been urbanizing rapidly. The population growth rate in urban India is more than two-and-half times that of rural India. The current Indian urban population, of over 370 million people, exceeds that of the total population of every other country on the planet with the exception of China. Supplying water to India's burgeoning urban agglomerations poses a challenge in terms of social equity, biophysical sustainability, and economic efficiency. A typical Indian city relies on both surface and ground water sources. Several Indian cities import surface water from distances that now exceed a hundred kilometres and across gradients of up to three thousand metres. While the depleting groundwater levels as a result of rapidly growing demand from urban India is at least anecdotally understood even when reliable estimates are not available, the energy costs of supplying water to urban India has thus far not received academic or policy attention it deserves. We develop a simple framework to integrate distributed groundwater models with water consumption data to estimate the energy and emissions associated with supplying water to urban centres. We assemble a unique data set from seventy five of the largest urban agglomerations in India and derive estimated values of energy consumption and carbon emissions associated with water provision in urban India. Our analysis shows that in every major city, the energy cost associated with long distance import of surface water significantly exceeds groundwater extraction. However, with rapidly depleting groundwater levels, we estimate inflection points for select cities when energy costs of groundwater extraction will exceed energy required to import surface water into the city. In addition to the national snapshot, we also perform detailed, spatially explicit analysis for the city of Bangalore which is an urban agglomeration that is home to more than ten million people. Combining a distributed groundwater model with data from the public utility supplying water to the city, and a large primary household survey data (n=29000), we develop a high resolution map for the city showing the water-energy nexus for across different parts of the city. The city of Bangalore imports nearly as much surface water (from a river source hundred kilometres away and across a gradient of 500 metres) as the annual rainfall falling on the city. The leakage from the vast wast water supply network and return flows are major components of the groundwater recharge budget, and our case study helps highlight how a nuanced understanding of urban hydrology is crucial to estimating the energy costs of urban water supply.

Earth radiation balance as observed and represented in CMIP5 models

NASA Astrophysics Data System (ADS)

Wild, Martin; Folini, Doris; Schär, Christoph; Loeb, Norman; König-Langlo, Gert

2014-05-01

The genesis and evolution of Earth's climate is largely regulated by the Earth radiation balance. Despite of its key role in the context of climate change, substantial uncertainties still exist in the quantification of the magnitudes of its different components, and its representation in climate models. While the net radiative energy flows in and out of the climate system at the top of atmosphere are now known with considerable accuracy from new satellite programs such as CERES and SORCE, the energy distribution within the climate system and at the Earth's surface is less well determined. Accordingly, the magnitudes of the components of the surface energy balance have recently been controversially disputed, and potential inconsistencies between the estimated magnitudes of the global energy and water cycle have been emphasized. Here we summarize this discussion as presented in Chapter 2.3 of the 5th IPCC assessment report (AR5). In this context we made an attempt to better constrain the magnitudes of the surface radiative components with largest uncertainties. In addition to satellite observations, we thereby made extensive use of the growing number of surface observations to constrain the radiation balance not only from space, but also from the surface. We combined these observations with the latest modeling efforts performed for AR5 (CMIP5) to infer best estimates for the global mean surface radiative components. Our analyses favor global mean values of downward surface solar and thermal radiation near 185 and 342 Wm-2, respectively, which are most compatible with surface observations (Wild et al. 2013). These estimates are on the order of 10 Wm-2 lower and higher, respectively, than in some of the previous global energy balance assessments, including those presented in previous IPCC reports. It is encouraging that these estimates, which make full use of the information contained in the surface networks, coincide within 2 Wm-2 with the latest satellite-derived estimates (Kato et al. 2013), which are completely independently determined. This enhances confidence in these recent surface flux estimates. IPCC AR5 further presents increasing evidence from direct observations that the surface radiative fluxes undergo significant changes on decadal timescales, not only in their thermal components as expected from the increasing greenhouse effect, but also in the amount of solar radiation that reaches the Earth surface. In the thermal range, surface observations suggest an overall increase of downward thermal radiation in line with latest projections from the CMIP5 models and expectations from an increasing greenhouse effect. On the other hand the strong decadal changes in surface solar radiation seen in the observations ("dimming/brightening") are not fully captured by current climate models. These decadal changes in surface solar radiation may largely affect various aspects of climate change. Selected related references: Hartmann, D.L., A.M.G. Klein Tank, M. Rusticucci, L. Alexander, S. Brönnimann, Y. Charabi, F. Dentener, E. Dlugokencky, D. Easterling, A. Kaplan, B. Soden, P. Thorne, M. Wild and P.M. Zhai, 2013: Observations: Atmosphere and Surface. In: Climate Change 2013: The Physical Science Basis. Contribution of Working Group I to the Fifth Assessment Report of the Intergovernmental Panel on Climate Change [Stocker, T.F., D. Qin, G.-K. Plattner, M. Tignor, S.K. Allen, J. Boschung, A. Nauels, Y. Xia, V. Bex and P.M. Midgley (eds.)]. Cambridge University Press, Cambridge, United Kingdom and New York, NY, USA. Kato, S., Loeb, N.G., Rose, F.G., Doelling, D.R., Rutan, D.A., Caldwell, T.E., Yu, L.S, and Weller, R.A., 2013: Surface irradiances consistent with CERES-derived top-of-atmosphere shortwave and longwave irradiances. Journal of Climate 26 (9):2719-2740. doi:Doi 10.1175/Jcli-D-12-00436.1 Wild, M., 2012: New Directions: A facelift for the picture of the global energy balance. Atmospheric Environment, 55, 366-367. Wild, M. 2012: Enlightening Global Dimming and Brightening. Bull. Amer. Meteor. Soc., 93, 27-37, doi:10.1175/BAMS-D-11-00074.1 Wild, M., Folini, D., Schär, C., Loeb, N., Dutton, E.G., and König-Langlo, G., 2013: The global energy balance from a surface perspective, Clim. Dyn., 40, 3107-3134, Doi:10.1007/s00382-012-1569-8.

Evaluating ET estimates from the Simplified Surface Energy Balance (SSEB) model using METRIC model output

NASA Astrophysics Data System (ADS)

Senay, G. B.; Budde, M. E.; Allen, R. G.; Verdin, J. P.

2008-12-01

Evapotranspiration (ET) is an important component of the hydrologic budget because it expresses the exchange of mass and energy between the soil-water-vegetation system and the atmosphere. Since direct measurement of ET is difficult, various modeling methods are used to estimate actual ET (ETa). Generally, the choice of method for ET estimation depends on the objective of the study and is further limited by the availability of data and desired accuracy of the ET estimate. Operational monitoring of crop performance requires processing large data sets and a quick response time. A Simplified Surface Energy Balance (SSEB) model was developed by the U.S. Geological Survey's Famine Early Warning Systems Network to estimate irrigation water use in remote places of the world. In this study, we evaluated the performance of the SSEB model with the METRIC (Mapping Evapotranspiration at high Resolution and with Internalized Calibration) model that has been evaluated by several researchers using the Lysimeter data. The METRIC model has been proven to provide reliable ET estimates in different regions of the world. Reference ET fractions of both models (ETrF of METRIC vs. ETf of SSEB) were generated and compared using individual Landsat thermal images collected from 2000 though 2005 in Idaho, New Mexico, and California. In addition, the models were compared using monthly and seasonal total ETa estimates. The SSEB model reproduced both the spatial and temporal variability exhibited by METRIC on land surfaces, explaining up to 80 percent of the spatial variability. However, the ETa estimates over water bodies were systematically higher in the SSEB output, which could be improved by using a correction coefficient to take into account the absorption of solar energy by deeper water layers that has little contribution to the ET process. This study demonstrated the usefulness of the SSEB method for large-scale agro-hydrologic applications for operational monitoring and assessing of crop performance and regional water balance dynamics.

On the transfer of radiation at asteroidal surfaces in relation to their orbit deflection - II

NASA Astrophysics Data System (ADS)

Yabushita, Shin

1998-08-01

The efficiency of absorption of X-rays generated by a nuclear explosion at the surface of an asteroid, estimated earlier, is used to calculate the explosion yield needed to deflect the orbit of an asteroid. Following the work of Ahrens & Harris, it is shown that a recoil velocity of 1 cm s^-1 is required to deflect an asteroid from a collision course with the Earth, and the necessary yield of explosion energy is estimated. If it is assumed that the scaling law between the energy and the diameter of the resulting crater, obtained from experiments carried out on the Earth, remains valid on the asteroid surface, where gravity is much weaker, an explosion energy of 8 and 800 megaton (Mton) equivalent of TNT would be required for asteroids of diameter 1 and 10 km respectively. If, on the other hand, the crater diameter is proportional to a certain power of the gravity g, the power being determined from a dimension analysis, 130 kton and 12 Mton would be required to endow asteroids of diameters 1 and 10 km with the required velocity, respectively. The result indicates that in order to estimate the required explosion energy, a better understanding of cratering under gravity much weaker than on the Earth would be required.

Utility of remote sensing-based surface energy balance models to track water stress in rain-fed switchgrass under dry and wet conditions

USDA-ARS?s Scientific Manuscript database

The ability of remote sensing-based surface energy balance (SEB) models to track water stress in rain-fed switchgrass has not been explored yet. In this paper, the theoretical framework of crop water stress index (CWSI) was utilized to estimate CWSI in rain-fed switchgrass (Panicum virgatum L.) usin...

Intermolecular Casimir-Polder forces in water and near surfaces

NASA Astrophysics Data System (ADS)

Thiyam, Priyadarshini; Persson, Clas; Sernelius, Bo E.; Parsons, Drew F.; Malthe-Sørenssen, Anders; Boström, Mathias

2014-09-01

The Casimir-Polder force is an important long-range interaction involved in adsorption and desorption of molecules in fluids. We explore Casimir-Polder interactions between methane molecules in water, and between a molecule in water near SiO2 and hexane surfaces. Inclusion of the finite molecular size in the expression for the Casimir-Polder energy leads to estimates of the dispersion contribution to the binding energies between molecules and between one molecule and a planar surface.

Relationship of surface fuels to fire radiative energy as estimated from airborne lidar and thermal infrared imaging

NASA Astrophysics Data System (ADS)

Hudak, A. T.; Dickinson, M. B.; Kremens, R.; Loudermilk, L.; O'Brien, J.; Satterberg, K.; Strand, E. K.; Ottmar, R. D.

2013-12-01

Longleaf pine stand structure and function are dependent on frequent fires, so fire managers maintain healthy longleaf pine ecosystems by frequently burning surface fuels with prescribed fires. Eglin Air Force Base (AFB) in the Florida panhandle boasts the largest remnant of longleaf pine forest, providing a productive setting for fire scientists to make multi-scale measurements of fuels, fire behavior, and fire effects in collaboration with Eglin AFB fire managers. Data considered in this analysis were collected in five prescribed burn units: two forested units burned in 2011 and a forested unit and two grassland units burned in 2012. Our objective was to demonstrate the linear relationship between biomass and fire energy that has been shown in the laboratory, but using two independent remotely sensed airborne datasets collected at the unit level: 1) airborne lidar flown over the burn units immediately prior to the burns, and 2) thermal infrared image time series flown over the burn units at 2-3 minute intervals. Airborne lidar point cloud data were reduced to 3 m raster metrics of surface vegetation height and cover, which were in turn used to map surface fuel loads at 3 m resolution. Plot-based measures of prefire surface fuels were used for calibration/validation. Preliminary results based on 2011 data indicate airborne lidar can explain ~30% of variation in surface fuel loads. Multi-temporal thermal infrared imagery (WASP) collected at 3 m resolution were calibrated to units of fire radiative power (FRP), using simultaneous FRP measures from ground-based radiometers, and then temporally integrated to estimate fire radiative energy (FRE) release at the unit level. Prior to AGU, FRP and FRE will be compared to estimates of the same variables derived from ground-based FLIR thermal infrared imaging cameras, each deployed with a nadir view from a tripod, at three sites per burn unit. A preliminary proof-of-concept, comparing FRE derived from a tripod-based FLIR (3.2 MW), to another FLIR deployed with an oblique view from atop a 36 m boom lift (2.1 MW), demonstrated reasonable agreement. Unit-level estimates of FRE will also be compared to estimates of surface fuel consumption (~5 Mg/ha) that were summarized at the unit level from pre- and post-fire clip plots of surface fuel biomass. At AGU, we will also compare predictions of surface fuel loads to estimates of energy release, as mapped at 3 m resolution from these independent remotely sensed data sources. These results will serve to demonstrate our ability to remotely measure and relate fuel loads to fire behavior at a landscape level.

Diagnosing land management and climate change impacts on snowmelt in semi-arid agricultural cold regions with an improved snowmelt model

NASA Astrophysics Data System (ADS)

Harder, P.; Pomeroy, J. W.; Helgason, W.

2017-12-01

Spring snowmelt is the most important hydrological event in semi-arid agricultural cold regions, recharging soil moisture and generating the majority of annual runoff. Adoption of no-till agricultural practices means vast areas of the Canadian Prairies, and other analogous regions, are characterized by standing crop stubble. The emergence of stubble during snowmelt will have important implications for the snowpack energy balance. In addition, spatiotemporally dynamic snowcover heterogeneity leads to enhancement of turbulent flux contributions to melt by advection of energy from warm moist bare ground to snow. Stubble emergence and advection are generally unaccounted for in snow models. To address these challenges a stubble-snow-atmosphere surface energy balance model is developed that relates stubble parameters to the snow surface energy balance. Existing fractal understandings of snowcover geometry are applied to a conceptualized boundary layer integration model to estimate a sensible and latent heat advection efficiency. The small-scale nature of stubble-snow-atmosphere interactions makes direct validation of the energy balance terms challenging. However, the energy balance estimates are assessed by comparing to measured snow and stubble surface temperatures, snow surface incoming shortwave radiation and areal average turbulent fluxes. Advection estimates are validated from a two-dimensional air temperature, water vapor and windspeed profiles. Snowcover geometry relationships are validated/updated with unmanned air vehicle observations. Observations for model assessment occurred in 2015 and 2016 on wheat and canola stubble fields in north-central Saskatchewan, Canada. The model is not calibrated to melt rates, yet compares well with available observations, providing confidence in the model structure and parameterization. Sensitivity analysis using the model revealed compensatory relationships in energy balance terms resulting in limited reduction of energy available for snowmelt as stubble height increases. The proposed model is used to diagnose the influence of stubble management and climate change on melt processes to reveal the potential implications on runoff generation, infiltration and land-atmosphere interactions.

GEWEX Water and Energy Budget Study

NASA Technical Reports Server (NTRS)

Roads, J.; Bainto, E.; Masuda, K.; Rodell, Matthew; Rossow, W. B.

2008-01-01

Closing the global water and energy budgets has been an elusive Global Energy and Water-cycle Experiment (GEWEX) goal. It has been difficult to gather many of the needed global water and energy variables and processes, although, because of GEWEX, we now have globally gridded observational estimates for precipitation and radiation and many other relevant variables such as clouds and aerosols. Still, constrained models are required to fill in many of the process and variable gaps. At least there are now several atmospheric reanalyses ranging from the early National Centers for Environmental Prediction/National Center for Atmospheric Research (NCEP/NCAR) and NCEP/Department of Energy (DOE) reanalyses to the more recent ERA40 and JRA-25 reanalyses. Atmospheric constraints include requirements that the models state variables remain close to in situ observations or observed satellite radiances. This is usually done by making short-term forecasts from an analyzed initial state; these short-term forecasts provide the next guess, which is corrected by comparison to available observations. While this analysis procedure is likely to result in useful global descriptions of atmospheric temperature, wind and humidity, there is no guarantee that relevant hydroclimate processes like precipitation, which we can observe and evaluate, and evaporation over land, which we cannot, have similar verisimilitude. Alternatively, the Global Land Data Assimilation System (GLDAS), drives uncoupled land surface models with precipitation, surface solar radiation, and surface meteorology (from bias-corrected reanalyses during the study period) to simulate terrestrial states and surface fluxes. Further constraints are made when a tuned water balance model is used to characterize the global runoff observational estimates. We use this disparate mix of observational estimates, reanalyses, GLDAS and calibrated water balance simulations to try to characterize and close global and terrestrial atmospheric and surface water and energy budgets to within 10-20% for long term (1986-1995), large-scale global to regional annual means.

Dynamic soft tissue deformation estimation based on energy analysis

NASA Astrophysics Data System (ADS)

Gao, Dedong; Lei, Yong; Yao, Bin

2016-10-01

The needle placement accuracy of millimeters is required in many needle-based surgeries. The tissue deformation, especially that occurring on the surface of organ tissue, affects the needle-targeting accuracy of both manual and robotic needle insertions. It is necessary to understand the mechanism of tissue deformation during needle insertion into soft tissue. In this paper, soft tissue surface deformation is investigated on the basis of continuum mechanics, where a geometry model is presented to quantitatively approximate the volume of tissue deformation. The energy-based method is presented to the dynamic process of needle insertion into soft tissue based on continuum mechanics, and the volume of the cone is exploited to quantitatively approximate the deformation on the surface of soft tissue. The external work is converted into potential, kinetic, dissipated, and strain energies during the dynamic rigid needle-tissue interactive process. The needle insertion experimental setup, consisting of a linear actuator, force sensor, needle, tissue container, and a light, is constructed while an image-based method for measuring the depth and radius of the soft tissue surface deformations is introduced to obtain the experimental data. The relationship between the changed volume of tissue deformation and the insertion parameters is created based on the law of conservation of energy, with the volume of tissue deformation having been obtained using image-based measurements. The experiments are performed on phantom specimens, and an energy-based analytical fitted model is presented to estimate the volume of tissue deformation. The experimental results show that the energy-based analytical fitted model can predict the volume of soft tissue deformation, and the root mean squared errors of the fitting model and experimental data are 0.61 and 0.25 at the velocities 2.50 mm/s and 5.00 mm/s. The estimating parameters of the soft tissue surface deformations are proven to be useful for compensating the needle-targeting error in the rigid needle insertion procedure, especially for percutaneous needle insertion into organs.

Assessment of MERRA-2 Land Surface Energy Flux Estimates

NASA Technical Reports Server (NTRS)

Draper, Clara; Reichle, Rolf; Koster, Randal

2017-01-01

In MERRA-2, observed precipitation is inserted in place of model-generated precipitation at the land surface. The use of observed precipitation was originally developed for MERRA-Land(a land-only replay of MERRA with model-generated precipitation replaced with observations).Previously shown that the land hydrology in MERRA-2 and MERRA-Land is better than MERRA. We test whether the improved land surface hydrology in MERRA-2 leads to the expected improvements in the land surface energy fluxes and 2 m air temperatures (T2m).

Study of solids by use of nonthermalized positrons

NASA Astrophysics Data System (ADS)

Nielsen, Bent; Lynn, K. G.; Chen, Yen-C.

1986-10-01

We have measured the energy distribution of positrons reemitted from the surfaces of solids after being implanted at low energy. It is shown that this provides a unique possibility to study energy losses of a charged particle down to near-thermal energy. Such measurements are used to estimate the positron thermalization time in Al. A dramatic change in this energy distribution was observed after oxidation of the Al surface. We attribute this to the band gap of the oxide. Trapping of epithermal positrons with a remarkably high cross section was observed for both Al and Cu.

Modern Estimates of Global Water Cycle Fluxes

NASA Astrophysics Data System (ADS)

Rodell, M.; Beaudoing, H. K.; L'Ecuyer, T. S.; Olson, W. S.

2014-12-01

The goal of the first phase of the NASA Energy and Water Cycle Study (NEWS) Water and Energy Cycle Climatology project was to develop "state of the global water cycle" and "state of the global energy cycle" assessments based on data from modern ground and space based observing systems and data integrating models. Here we describe results of the water cycle assessment, including mean annual and monthly fluxes over continents and ocean basins during the first decade of the millennium. To the extent possible, the water flux estimates are based on (1) satellite measurements and (2) data-integrating models. A careful accounting of uncertainty in each flux was applied within a routine that enforced multiple water and energy budget constraints simultaneously in a variational framework, in order to produce objectively-determined, optimized estimates. Simultaneous closure of the water and energy budgets caused the ocean evaporation and precipitation terms to increase by about 10% and 5% relative to the original estimates, mainly because the energy budget required turbulent heat fluxes to be substantially larger in order to balance net radiation. In the majority of cases, the observed annual, surface and atmospheric water budgets over the continents and oceans close with much less than 10% residual. Observed residuals and optimized uncertainty estimates are considerably larger for monthly surface and atmospheric water budget closure, often nearing or exceeding 20% in North America, Eurasia, Australia and neighboring islands, and the Arctic and South Atlantic Oceans. The residuals in South America and Africa tend to be smaller, possibly because cold land processes are a non-issue. Fluxes are poorly observed over the Arctic Ocean, certain seas, Antarctica, and the Australasian and Indonesian Islands, leading to reliance on atmospheric analysis estimates. Other details of the study and future directions will be discussed.

Estimated Radiation on Mars, Hits per Cell Nucleus

NASA Image and Video Library

2002-03-01

This global map of Mars, based on data from NASA Mars Odyssey, shows estimates for amounts of high-energy-particle cosmic radiation reaching the surface, a serious health concern for any future human exploration of the planet.

Estimating radiative feedbacks from stochastic fluctuations in surface temperature and energy imbalance

NASA Astrophysics Data System (ADS)

Proistosescu, C.; Donohoe, A.; Armour, K.; Roe, G.; Stuecker, M. F.; Bitz, C. M.

2017-12-01

Joint observations of global surface temperature and energy imbalance provide for a unique opportunity to empirically constrain radiative feedbacks. However, the satellite record of Earth's radiative imbalance is relatively short and dominated by stochastic fluctuations. Estimates of radiative feedbacks obtained by regressing energy imbalance against surface temperature depend strongly on sampling choices and on assumptions about whether the stochastic fluctuations are primarily forced by atmospheric or oceanic variability (e.g. Murphy and Forster 2010, Dessler 2011, Spencer and Braswell 2011, Forster 2016). We develop a framework around a stochastic energy balance model that allows us to parse the different contributions of atmospheric and oceanic forcing based on their differing impacts on the covariance structure - or lagged regression - of temperature and radiative imbalance. We validate the framework in a hierarchy of general circulation models: the impact of atmospheric forcing is examined in unforced control simulations of fixed sea-surface temperature and slab ocean model versions; the impact of oceanic forcing is examined in coupled simulations with prescribed ENSO variability. With the impact of atmospheric and oceanic forcing constrained, we are able to predict the relationship between temperature and radiative imbalance in a fully coupled control simulation, finding that both forcing sources are needed to explain the structure of the lagged-regression. We further model the dependence of feedback estimates on sampling interval by considering the effects of a finite equilibration time for the atmosphere, and issues of smoothing and aliasing. Finally, we develop a method to fit the stochastic model to the short timeseries of temperature and radiative imbalance by performing a Bayesian inference based on a modified version of the spectral Whittle likelihood. We are thus able to place realistic joint uncertainty estimates on both stochastic forcing and radiative feedbacks derived from observational records. We find that these records are, as of yet, too short to be useful in constraining radiative feedbacks, and we provide estimates of how the uncertainty narrows as a function of record length.

Energy Balance Bowen Ratio (EBBR) Handbook

DOE Office of Scientific and Technical Information (OSTI.GOV)

Cook, D. R.

2016-01-01

The Energy Balance Bowen Ratio (EBBR) system produces 30-minute estimates of the vertical fluxes of sensible and latent heat at the local surface. Flux estimates are calculated from observations of net radiation, soil surface heat flux, and the vertical gradients of temperature and relative humidity (RH). Meteorological data collected by the EBBR are used to calculate bulk aerodynamic fluxes, which are used in the Bulk Aerodynamic Technique (BA) EBBR value-added product (VAP) to replace sunrise and sunset spikes in the flux data. A unique aspect of the system is the automatic exchange mechanism (AEM), which helps to reduce errors frommore » instrument offset drift.« less

Energy Balance Bowen Ratio Station (EBBR) Handbook

DOE Office of Scientific and Technical Information (OSTI.GOV)

Cook, DR

2011-02-23

The energy balance Bowen ratio (EBBR) system produces 30-minute estimates of the vertical fluxes of sensible and latent heat at the local surface. Flux estimates are calculated from observations of net radiation, soil surface heat flux, and the vertical gradients of temperature and relative humidity (RH). Meteorological data collected by the EBBR are used to calculate bulk aerodynamic fluxes, which are used in the Bulk Aerodynamic Technique (BA) EBBR value-added product (VAP) to replace sunrise and sunset spikes in the flux data. A unique aspect of the system is the automatic exchange mechanism (AEM), which helps to reduce errors frommore » instrument offset drift.« less

Simulation of Surface Energy Fluxes and Snow Interception Using a Higher Order Closure Multi-Layer Soil-Vegetation-Atmospheric Model: The Effect of Canopy Shape and Structure

NASA Astrophysics Data System (ADS)

McGowan, L. E.; Dahlke, H. E.; Paw U, K. T.

2015-12-01

Snow cover is a critical driver of the Earth's surface energy budget, climate change, and water resources. Variations in snow cover not only affect the energy budget of the land surface but also represent a major water supply source. In California, US estimates of snow depth, extent, and melt in the Sierra Nevada are critical to estimating the amount of water available for both California agriculture and urban users. However, accurate estimates of snow cover and snow melt processes in forested area still remain a challenge. Canopy structure influences the vertical and spatiotemporal distribution of snow, and therefore ultimately determines the degree and extent by which snow alters both the surface energy balance and water availability in forested regions. In this study we use the Advanced Canopy-Atmosphere-Soil algorithm (ACASA), a multi-layer soil-vegetation-atmosphere numerical model, to simulate the effect of different snow-covered canopy structures on the energy budget, and temperature and other scalar profiles within different forest types in the Sierra Nevada, California. ACASA incorporates a higher order turbulence closure scheme which allows the detailed simulation of turbulent fluxes of heat and water vapor as well as the CO2 exchange of several layers within the canopy. As such ACASA can capture the counter gradient fluxes within canopies that may occur frequently, but are typically unaccounted for, in most snow hydrology models. Six different canopy types were modeled ranging from coniferous forests (e.g. most biomass near the ground) to top-heavy (e.g. most biomass near the top of the crown) deciduous forests to multi-layered forest canopies (e.g. mixture of young and mature trees). Preliminary results indicate that the canopy shape and structure associated with different canopy types fundamentally influence the vertical scalar profiles (including those of temperature, moisture, and wind speed) in the canopy and thus alter the interception and snow melt dynamics in forested land surfaces. The turbulent transport dynamics, including counter-gradient fluxes, and radiation features including land surface albedo, are discussed in the context of the snow energy balance.

Measurement of surface energy balance components in dryland wheat/fallow and limited-irrigation corn

USDA-ARS?s Scientific Manuscript database

Water evaporation from soil and plant surfaces and plant transpiration comprise land surface/canopy evapotranspiration (ET), which is essential to estimate for land-atmosphere interaction and crop water use. There are no direct measurements of ET, and the most direct methods (e.g., weighing lysimet...

Global shortwave energy budget at the earth's surface from ERBE observations

NASA Technical Reports Server (NTRS)

Breon, Francois-Marie; Frouin, Robert

1994-01-01

A method is proposed to compute the net solar (shortwave) irradiance at the earth's surface from Earth Radiation Budget Experiment (ERBE) data in the S4 format. The S4 data are monthly averaged broadband planetary albedo collected at selected times during the day. Net surface shortwave irradiance is obtained from the shortwave irradiance incident at the top of the atmosphere (known) by subtracting both the shortwave energy flux reflected by the earth-atmosphere system (measured) and the energy flux absorbed by the atmosphere (modeled). Precalculated atmospheric- and surface-dependent functions that characterize scattering and absorption in the atmosphere are used, which makes the method easily applicable and computationally efficient. Four surface types are distinguished, namely, ocean, vegetation, desert, and snow/ice. Over the tropical Pacific Ocean, the estimates based on ERBE data compare well with those obtained from International Satellite Cloud Climatology Project (ISCCP) B3 data. For the 9 months analyzed the linear correlation coefficient and the standard difference between the two datasets are 0.95 and 14 W/sq m (about 6% of the average shortwave irradiance), respectively, and the bias is 15 W/sq m (higher ERBE values). The bias, a strong function of ISCCP satellite viewing zenith angle, is mostly in the ISCCP-based estimates. Over snow/ice, vegetation, and desert no comparison is made with other satellite-based estimates, but theoretical calculations using the discrete ordinate method suggest that over highly reflective surfaces (snow/ice, desert) the model, which accounts crudely for multiple reflection between the surface and clouds, may substantially overestimate the absorbed solar energy flux at the surface, especially when clouds are optically thick. The monthly surface shortwave irradiance fields produced for 1986 exhibit the main features characteristic of the earth's climate. As found in other studies, our values are generally higher than Esbensen and Kushnir's by as much as 80 W/sq m in the tropical oceans. A cloud parameter, defined as the difference between clear-sky and actual irradiances normalized to top-of-atmosphere clear-sky irradiance, is also examined. This parameter, minimally affected by sun zenith angle, is higher in the midlatitude regions of storm tracks than in the intertropical convergence zone (ITCZ), suggesting that, on average, the higher cloud coverage in midlatitudes is more effective at reducing surface shortwave irradiance than opaque, convective, yet sparser clouds in the ITCZ. Surface albedo estimates are realistic, generally not exceeding 0.06 in the ocean, as high as 0.9 in polar regions, and reaching 0.5 in the Sahara and Arabian deserts.

Surface-induced dissociation and chemical reactions of C2D4(+) on stainless steel, carbon (HOPG), and two different diamond surfaces.

PubMed

Feketeová, Linda; Zabka, Jan; Zappa, Fabio; Grill, Verena; Scheier, Paul; Märk, Tilmann D; Herman, Zdenek

2009-06-01

Surface-induced interactions of the projectile ion C(2)D(4)(+) with room-temperature (hydrocarbon covered) stainless steel, carbon highly oriented pyrolytic graphite (HOPG), and two different types of diamond surfaces (O-terminated and H-terminated) were investigated over the range of incident energies from a few eV up to 50 eV. The relative abundance of the product ions in dependence on the incident energy of the projectile ion [collision-energy resolved mass spectra, (CERMS) curves] was determined. The product ion mass spectra contained ions resulting from direct dissociation of the projectile ions, from chemical reactions with the hydrocarbons on the surface, and (to a small extent) from sputtering of the surface material. Sputtering of the surface layer by low-energy Ar(+) ions (5-400 eV) indicated the presence of hydrocarbons on all studied surfaces. The CERMS curves of the product ions were analyzed to obtain both CERMS curves for the products of direct surface-induced dissociation of the projectile ion and CERMS curves of products of surface reactions. From the former, the fraction of energy converted in the surface collision into the internal excitation of the projectile ion was estimated as 10% of the incident energy. The internal energy of the surface-excited projectile ions was very similar for all studied surfaces. The H-terminated room-temperature diamond surface differed from the other surfaces only in the fraction of product ions formed in H-atom transfer surface reactions (45% of all product ions formed versus 70% on the other surfaces).

A modified force-restore approach to modeling snow-surface heat fluxes

Treesearch

Charles H. Luce; David G. Tarboton

2001-01-01

Accurate modeling of the energy balance of a snowpack requires good estimates of the snow surface temperature. The snow surface temperature allows a balance between atmospheric heat fluxes and the conductive flux into the snowpack. While the dependency of atmospheric fluxes on surface temperature is reasonably well understood and parameterized, conduction of heat from...

Monte Carlo simulations on atropisomerism of thienotriazolodiazepines applicable to slow transition phenomena using potential energy surfaces by ab initio molecular orbital calculations.

PubMed

Morikami, Kenji; Itezono, Yoshiko; Nishimoto, Masahiro; Ohta, Masateru

2014-01-01

Compounds with a medium-sized flexible ring often show atropisomerism that is caused by the high-energy barriers between long-lived conformers that can be isolated and often have different biological properties to each other. In this study, the frequency of the transition between the two stable conformers, aS and aR, of thienotriazolodiazepine compounds with flexible 7-membered rings was estimated computationally by Monte Carlo (MC) simulations and validated experimentally by NMR experiments. To estimate the energy barriers for transitions as precisely as possible, the potential energy (PE) surfaces used in the MC simulations were calculated by molecular orbital (MO) methods. To accomplish the MC simulations with the MO-based PE surfaces in a practical central processing unit (CPU) time, the MO-based PE of each conformer was pre-calculated and stored before the MC simulations, and then only referred to during the MC simulations. The activation energies for transitions calculated by the MC simulations agreed well with the experimental ΔG determined by the NMR experiments. The analysis of the transition trajectories of the MC simulations revealed that the transition occurred not only through the transition states, but also through many different transition paths. Our computational methods gave us quantitative estimates of atropisomerism of the thienotriazolodiazepine compounds in a practical period of time, and the method could be applicable for other slow-dynamics phenomena that cannot be investigated by other atomistic simulations.

A direct estimate of evapotranspiration over the Amazon basin and implications for our understanding of carbon and water cycling

NASA Astrophysics Data System (ADS)

Swann, A. L. S.; Koven, C.; Lombardozzi, D.; Bonan, G. B.

2017-12-01

Evapotranspiration (ET) is a critical term in the surface energy budget as well as the water cycle. There are few direct measurements of ET, and thus the magnitude and variability is poorly constrained at large spatial scales. Estimates of the annual cycle of ET over the Amazon are critical because they influence predictions of the seasonal cycle of carbon fluxes, as well as atmospheric dynamics and circulation. We estimate ET for the Amazon basin using a water budget approach, by differencing rainfall, discharge, and time-varying storage from the Gravity Recovery and Climate Experiment. We find that the climatological annual cycle of ET over the Amazon basin upstream of Óbidos shows suppression of ET during the wet season, and higher ET during the dry season, consistent with flux tower based observations in seasonally dry forests. We also find a statistically significant decrease in ET over the time period 2002-2015 of -1.46 mm/yr. Our direct estimate of the seasonal cycle of ET is largely consistent with previous indirect estimates, including energy budget based approaches, an up-scaled station based estimate, and land surface model estimates, but suggests that suppression of ET during the wet season is underestimated by existing products. We further quantify possible contributors to the phasing of the seasonal cycle and downward time trend using land surface models.

The physical basis for estimating wave energy spectra from SAR imagery

NASA Technical Reports Server (NTRS)

Lyzenga, David R.

1987-01-01

Ocean surface waves are imaged by synthetic aperture radar (SAR) through a combination of the effects of changes in the surface slope, surface roughness, and surface motion. Over a limited range of conditions, each of these effects can be described in terms of a linear modulation-transfer function. In such cases, the wave-height spectrum can be estimated in a straightforward manner from the SAR image-intensity spectrum. The range of conditions over which this assumption of linearity is valid is investigated using a numerical simulation model, and the implications of various departures from linearity are discussed.

Estimate of Rayleigh-to-Love wave ratio in the secondary microseism by colocated ring laser and seismograph

NASA Astrophysics Data System (ADS)

Tanimoto, Toshiro; Hadziioannou, Céline; Igel, Heiner; Wasserman, Joachim; Schreiber, Ulrich; Gebauer, André

2015-04-01

Using a colocated ring laser and an STS-2 seismograph, we estimate the ratio of Rayleigh-to-Love waves in the secondary microseism at Wettzell, Germany, for frequencies between 0.13 and 0.30 Hz. Rayleigh wave surface acceleration was derived from the vertical component of STS-2, and Love wave surface acceleration was derived from the ring laser. Surface wave amplitudes are comparable; near the spectral peak about 0.22 Hz, Rayleigh wave amplitudes are about 20% higher than Love wave amplitudes, but outside this range, Love wave amplitudes become higher. In terms of the kinetic energy, Rayleigh wave energy is about 20-35% smaller on average than Love wave energy. The observed secondary microseism at Wettzell thus consists of comparable Rayleigh and Love waves but contributions from Love waves are larger. This is surprising as the only known excitation mechanism for the secondary microseism, described by Longuet-Higgins (1950), is equivalent to a vertical force and should mostly excite Rayleigh waves.

Theory of nanobubble formation and induced force in nanochannels

NASA Astrophysics Data System (ADS)

Arai, Noriyoshi; Koishi, Takahiro; Ebisuzaki, Toshikazu

2017-10-01

This paper presents a fundamental theory of nanobubble formation and induced force in confined nanochannels. It is shown that nanobubble formation between hydrophobic plates can be predicted from their surface tension and geometry, with estimated values for the surface free energy and the force acting on the plates in good agreement with the results of molecular dynamics simulation and experimentation. When a bubble is formed between two plates, vertical attractive force and horizontal retract force due to the shifted plates are applied to the plates. The net force exerted on the plates is not dependent on the distance between them. The short-range force between hydrophobic surfaces due to hydrophobic interaction appears to correspond to the force estimated by our theory. We compared between experimental and theoretical values for the binding energy of a molecular motor system to validate our theory. The tendency that the binding energy increases as the size of the protein increases is consistent with the theory.

An adaptive interpolation scheme for molecular potential energy surfaces

NASA Astrophysics Data System (ADS)

Kowalewski, Markus; Larsson, Elisabeth; Heryudono, Alfa

2016-08-01

The calculation of potential energy surfaces for quantum dynamics can be a time consuming task—especially when a high level of theory for the electronic structure calculation is required. We propose an adaptive interpolation algorithm based on polyharmonic splines combined with a partition of unity approach. The adaptive node refinement allows to greatly reduce the number of sample points by employing a local error estimate. The algorithm and its scaling behavior are evaluated for a model function in 2, 3, and 4 dimensions. The developed algorithm allows for a more rapid and reliable interpolation of a potential energy surface within a given accuracy compared to the non-adaptive version.

Mapping surface heat fluxes by assimilating GOES land surface temperature and SMAP products

NASA Astrophysics Data System (ADS)

Lu, Y.; Steele-Dunne, S. C.; Van De Giesen, N.

2017-12-01

Surface heat fluxes significantly affect the land-atmosphere interaction, but their modelling is often hindered by the lack of in-situ measurements and the high spatial heterogeneity. Here, we propose a hybrid particle assimilation strategy to estimate surface heat fluxes by assimilating GOES land surface temperature (LST) data and SMAP products into a simple dual-source surface energy balance model, in which the requirement for in-situ data is minimized. The study aims to estimate two key parameters: a neutral bulk heat transfer coefficient (CHN) and an evaporative fraction (EF). CHN scales the sum of surface energy fluxes, and EF represents the partitioning between flux components. To bridge the huge resolution gap between GOES and SMAP data, SMAP data are assimilated using a particle filter to update soil moisture which constrains EF, and GOES data are assimilated with an adaptive particle batch smoother to update CHN. The methodology is applied to an area in the US Southern Great Plains with forcing data from NLDAS-2 and the GPM mission. Assessment against in-situ observations suggests that the sensible and latent heat flux estimates are greatly improved at both daytime and 30-min scale after assimilation, particularly for latent heat fluxes. Comparison against an LST-only assimilation case demonstrates that despite the coarse resolution, assimilating SMAP data is not only beneficial but also crucial for successful and robust flux estimation, particularly when the modelling uncertainties are large. Since the methodology is independent on in-situ data, it can be easily applied to other areas.

Estimation of Land Surface Fluxes and Their Uncertainty via Variational Data Assimilation Approach

NASA Astrophysics Data System (ADS)

Abdolghafoorian, A.; Farhadi, L.

2016-12-01

Accurate estimation of land surface heat and moisture fluxes as well as root zone soil moisture is crucial in various hydrological, meteorological, and agricultural applications. "In situ" measurements of these fluxes are costly and cannot be readily scaled to large areas relevant to weather and climate studies. Therefore, there is a need for techniques to make quantitative estimates of heat and moisture fluxes using land surface state variables. In this work, we applied a novel approach based on the variational data assimilation (VDA) methodology to estimate land surface fluxes and soil moisture profile from the land surface states. This study accounts for the strong linkage between terrestrial water and energy cycles by coupling the dual source energy balance equation with the water balance equation through the mass flux of evapotranspiration (ET). Heat diffusion and moisture diffusion into the column of soil are adjoined to the cost function as constraints. This coupling results in more accurate prediction of land surface heat and moisture fluxes and consequently soil moisture at multiple depths with high temporal frequency as required in many hydrological, environmental and agricultural applications. One of the key limitations of VDA technique is its tendency to be ill-posed, meaning that a continuum of possibilities exists for different parameters that produce essentially identical measurement-model misfit errors. On the other hand, the value of heat and moisture flux estimation to decision-making processes is limited if reasonable estimates of the corresponding uncertainty are not provided. In order to address these issues, in this research uncertainty analysis will be performed to estimate the uncertainty of retrieved fluxes and root zone soil moisture. The assimilation algorithm is tested with a series of experiments using a synthetic data set generated by the simultaneous heat and water (SHAW) model. We demonstrate the VDA performance by comparing the (synthetic) true measurements (including profile of soil moisture and temperature, land surface water and heat fluxes, and root water uptake) with VDA estimates. In addition, the feasibility of extending the proposed approach to use remote sensing observations is tested by limiting the number of LST observations and soil moisture observations.

30 CFR 1210.20 - What if I disagree with the burden hour estimates?

Code of Federal Regulations, 2011 CFR

2011-07-01

... 30 Mineral Resources 3 2011-07-01 2011-07-01 false What if I disagree with the burden hour estimates? 1210.20 Section 1210.20 Mineral Resources OFFICE OF SURFACE MINING RECLAMATION AND ENFORCEMENT... estimates or suggestions on reducing the burden to the Bureau of Ocean Energy Management, Regulation, and...

Do we understand the temperature profile of air-water interface?

NASA Astrophysics Data System (ADS)

Solcerova, A.; van Emmerik, T. H. M.; Uittenbogaard, R.; van de Ven, F. H. M.; Van De Giesen, N.

2017-12-01

Lakes and reservoirs exchange energy with the atmosphere through long-wave radiation and turbulent heat fluxes. Calculation of those fluxes often depend on the surface temperature. Several recent studies used high resolution Distributed Temperature Sensing (DTS) to measure the temperature of air-water interface. We present results of three of such studies conducted on three different locations with three different climates (Ghana, Israel, The Netherland). Measurements from all presented studies show a distinct temperature drop close to the water surface during daytime. We provide several possible explanations for existence of such deviation of temperature, and discuss the plausibility of each. Explaining the measured temperature drop is crucial for a better understanding of the energy balance of lake surface, and estimation of the surface energy balance.

Heat balances of the surface mixed layer in the equatorial Atlantic and Indian Ocean during FGGE

NASA Technical Reports Server (NTRS)

Molinari, R. L.

1985-01-01

Surface meteorological and surface and subsurface oceanographic data collected during FGGE in the equatorial Atlantic and Indian Oceans are used to estimate the terms in a heat balance relation for the mixed layer. The first balance tested is between changes in mixed layer temperature (MLT) and surface energy fluxes. Away from regions of low variance in MLT time series and equatorial and coastal upwelling, surface fluxes can account for 75 percent of the variance in the observed time series. Differences between observed and estimated MLTs indicate that on the average, maximum errors in surface flux are of the order of 20 to 30 W/sq m. In the Atlantic, the addition of zonal advection does not significantly improve the estimates. However in regions of equatorial upwelling, the eastern Atlantic vertical mixing and meridional advection can play an important role in the evolution of MLTs.

Influence of short chain organic acids and bases on the wetting properties and surface energy of submicrometer ceramic powders.

PubMed

Neirinck, Bram; Soccol, Dimitri; Fransaer, Jan; Van der Biest, Omer; Vleugels, Jef

2010-08-15

The effect of short chained organic acids and bases on the surface energy and wetting properties of submicrometer alumina powder was assessed. The surface chemistry of treated powders was determined by means of Diffuse Reflectance Infrared Fourier Transform spectroscopy and compared to untreated powder. The wetting of powders was measured using a modified Washburn method, based on the use of precompacted powder samples. The geometric factor needed to calculate the contact angle was derived from measurements of the porous properties of the powder compacts. Contact angle measurements with several probe liquids before and after modification allowed a theoretical estimation of the surface energy based on the surface tension component theory. Trends in the surface energy components were linked to observations in infrared spectra. The results showed that the hydrophobic character of the precompacted powder depends on both the chain length and polar group of the modifying agent. Copyright 2010 Elsevier Inc. All rights reserved.

HCMM energy budget data as a model input for assessing regions of high potential groundwater pollution. [South Dakota

NASA Technical Reports Server (NTRS)

Moore, D. G. (Principal Investigator); Heilman, J. L.

1980-01-01

The author has identified the following significant results. Significant relationships were found between surface soil temperatures estimated from HCMM radiometric temperatures and depth to ground water and near surface soil moisture.

Mapping Global Ocean Surface Albedo from Satellite Observations: Models, Algorithms, and Datasets

NASA Astrophysics Data System (ADS)

Li, X.; Fan, X.; Yan, H.; Li, A.; Wang, M.; Qu, Y.

2018-04-01

Ocean surface albedo (OSA) is one of the important parameters in surface radiation budget (SRB). It is usually considered as a controlling factor of the heat exchange among the atmosphere and ocean. The temporal and spatial dynamics of OSA determine the energy absorption of upper level ocean water, and have influences on the oceanic currents, atmospheric circulations, and transportation of material and energy of hydrosphere. Therefore, various parameterizations and models have been developed for describing the dynamics of OSA. However, it has been demonstrated that the currently available OSA datasets cannot full fill the requirement of global climate change studies. In this study, we present a literature review on mapping global OSA from satellite observations. The models (parameterizations, the coupled ocean-atmosphere radiative transfer (COART), and the three component ocean water albedo (TCOWA)), algorithms (the estimation method based on reanalysis data, and the direct-estimation algorithm), and datasets (the cloud, albedo and radiation (CLARA) surface albedo product, dataset derived by the TCOWA model, and the global land surface satellite (GLASS) phase-2 surface broadband albedo product) of OSA have been discussed, separately.

Product energy distributions and energy partitioning in O atom reactions on surfaces

NASA Technical Reports Server (NTRS)

Halpern, Bret; Kori, Moris

1987-01-01

Surface reactions involving O atoms are likely to be highly exoergic, with different consequences if energy is channeled mostly to product molecules or surface modes. Thus the surface may become a source of excited species which can react elsewhere, or a sink for localized heat deposition which may disrupt the surface. The vibrational energy distribution of the product molecule contains strong clues about the flow of released energy. Two instructive examples of energy partitioning at surfaces are the Pt catalyzed oxidations: (1) C(ads) + O(ads) yields CO* (T is greater than 1000 K); and (2) CO(ads) + O(gas) yields CO2* (T is approx. 300 K). The infrared emission spectra of the excited product molecules were recorded and the vibrational population distributions were determined. In reaction 1, energy appeared to be statistically partitioned between the product CO and several Pt atoms. In reaction 2, partitioning was non-statistical; the CO2 asymmetric stretch distribution was inverted. In gas reactions these results would indicate a long lived and short lived activated complex. The requirement that Pt be heated in O atoms to promote reaction of atomic O and CO at room temperature is specifically addressed. Finally, the fraction of released energy that is deposited in the catalyst is estimated.

Energy Estimation of Cosmic Rays with the Engineering Radio Array of the Pierre Auger Observatory

DOE PAGES

Aab, Alexander

2016-06-14

The Auger Engineering Radio Array (AERA) is part of the Pierre Auger Observatory and is used to detect the radio emission of cosmic-ray air showers. These observations are compared to the data of the surface detector stations of the Observatory, which provide well-calibrated information on the cosmic-ray energies and arrival directions. The response of the radio stations in the 30 to 80MHz regime has been thoroughly calibrated to enable the reconstruction of the incoming electric field. For the latter, the energy density is determined from the radio pulses at each observer position and is interpolated using a two dimensional functionmore » that takes into account signal asymmetries due to interference between the geomagnetic and charge excess emission components. We found that the spatial integral over the signal distribution gives a direct measurement of the energy transferred from the primary cosmic ray into radio emission in the AERA frequency range. We measure 15.8MeV of radiation energy for a 1 EeV air shower arriving perpendicularly to the geomagnetic field. This radiation energy – corrected for geometrical effects – is used as a cosmic-ray energy estimator. Performing an absolute energy calibration against the surface-detector information, we observe that this radio-energy estimator scales quadratically with the cosmic-ray energy as expected for coherent emission. Finally we find an energy resolution of the radio reconstruction of 22% for the data set and 17% for a high-quality subset containing only events with at least five radio stations with signal.« less

Multi-Satellite Estimates of Land-Surface Properties for Determination of Energy and Water Budgets

NASA Technical Reports Server (NTRS)

Menzel, W. Paul; Rabin, Robert M.; Neale, Christopher M. U.; Gallo, Kevin; Diak, George R.

1998-01-01

Using the WETNET database, existing methods for the estimation of surface wetness from SSM/I data have been assessed and further developed. A physical-statistical method for optimal estimation of daily surface heat flux and Bowen ratio on the mesoscale has been developed and tested. This method is based on observations of daytime planetary boundary layer (PBL) growth from operational ravansonde and daytime land-surface temperature amplitude from Geostationary Operational Environmental (GOES) satellites. The mesoscale patterns of these heat fluxes have been compared with an AVHRR-based vegetation index and surface wetness (separately estimated from SSM/I and in situ observations). Cases of the 1988 Midwest drought and a surface/atmosphere moisture gradient (dry-line) in the southern Plains were studied. The analyses revealed significant variations in sensible heat flux (S(sub 0), and Bowen ratio, B(sub 0)) associated with vegetation cover and antecedent precipitation. Relationships for surface heat flux (and Bowen ratio) from antecedent precipitation and vegetation index have been developed and compared to other findings. Results from this project are reported in the following reviewed literature.

Estimating surface fluxes over middle and upper streams of the Heihe River Basin with ASTER imagery

NASA Astrophysics Data System (ADS)

Ma, W.; Ma, Y.; Hu, Z.; Su, Z.; Wang, J.; Ishikawa, H.

2011-05-01

Land surface heat fluxes are essential measures of the strengths of land-atmosphere interactions involving energy, heat and water. Correct parameterization of these fluxes in climate models is critical. Despite their importance, state-of-the-art observation techniques cannot provide representative areal averages of these fluxes comparable to the model grid. Alternative methods of estimation are thus required. These alternative approaches use (satellite) observables of the land surface conditions. In this study, the Surface Energy Balance System (SEBS) algorithm was evaluated in a cold and arid environment, using land surface parameters derived from Advanced Spaceborne Thermal Emission and Reflection Radiometer (ASTER) data. Field observations and estimates from SEBS were compared in terms of net radiation flux (Rn), soil heat flux (G0), sensible heat flux (H) and latent heat flux (λE) over a heterogeneous land surface. As a case study, this methodology was applied to the experimental area of the Watershed Allied Telemetry Experimental Research (WATER) project, located on the mid-to-upstream sections of the Heihe River in northwest China. ASTER data acquired between 3 May and 4 June 2008, under clear-sky conditions were used to determine the surface fluxes. Ground-based measurements of land surface heat fluxes were compared with values derived from the ASTER data. The results show that the derived surface variables and the land surface heat fluxes furnished by SEBS in different months over the study area are in good agreement with the observed land surface status under the limited cases (some cases looks poor results). So SEBS can be used to estimate turbulent heat fluxes with acceptable accuracy in areas where there is partial vegetation cover in exceptive conditions. It is very important to perform calculations using ground-based observational data for parameterization in SEBS in the future. Nevertheless, the remote-sensing results can provide improved explanations of land surface fluxes over varying land coverage at greater spatial scales.

Assimilation of Satellite-Derived Skin Temperature Observations into Land Surface Models

NASA Technical Reports Server (NTRS)

Reichle, Rolf H.; Kumar, Sujay V.; Mahanama, P. P.; Koster, Randal D.; Liu, Q.

2010-01-01

Land surface (or "skin") temperature (LST) lies at the heart of the surface energy balance and is a key variable in weather and climate models. Here we assimilate LST retrievals from the International Satellite Cloud Climatology Project (ISCCP) into the Noah and Catchment (CLSM) land surface models using an ensemble-based, off-line land data assimilation system. LST is described very differently in the two models. A priori scaling and dynamic bias estimation approaches are applied because satellite and model LST typically exhibit different mean values and variability. Performance is measured against 27 months of in situ measurements from the Coordinated Energy and Water Cycle Observations Project at 48 stations. LST estimates from Noah and CLSM without data assimilation ("open loop") are comparable to each other and superior to that of ISCCP retrievals. For LST, RMSE values are 4.9 K (CLSM), 5.6 K (Noah), and 7.6 K (ISCCP), and anomaly correlation coefficients (R) are 0.62 (CLSM), 0.61 (Noah), and 0.52 (ISCCP). Assimilation of ISCCP retrievals provides modest yet statistically significant improvements (over open loop) of up to 0.7 K in RMSE and 0.05 in anomaly R. The skill of surface turbulent flux estimates from the assimilation integrations is essentially identical to the corresponding open loop skill. Noah assimilation estimates of ground heat flux, however, can be significantly worse than open loop estimates. Provided the assimilation system is properly adapted to each land model, the benefits from the assimilation of LST retrievals are comparable for both models.

Free energy surfaces from nonequilibrium processes without work measurement

NASA Astrophysics Data System (ADS)

Adib, Artur B.

2006-04-01

Recent developments in statistical mechanics have allowed the estimation of equilibrium free energies from the statistics of work measurements during processes that drive the system out of equilibrium. Here a different class of processes is considered, wherein the system is prepared and released from a nonequilibrium state, and no external work is involved during its observation. For such "clamp-and-release" processes, a simple strategy for the estimation of equilibrium free energies is offered. The method is illustrated with numerical simulations and analyzed in the context of tethered single-molecule experiments.

Size- and shape-dependent surface thermodynamic properties of nanocrystals

NASA Astrophysics Data System (ADS)

Fu, Qingshan; Xue, Yongqiang; Cui, Zixiang

2018-05-01

As the fundamental properties, the surface thermodynamic properties of nanocrystals play a key role in the physical and chemical changes. However, it remains ambiguous about the quantitative influence regularities of size and shape on the surface thermodynamic properties of nanocrystals. Thus by introducing interface variables into the Gibbs energy and combining Young-Laplace equation, relations between the surface thermodynamic properties (surface Gibbs energy, surface enthalpy, surface entropy, surface energy and surface heat capacity), respectively, and size of nanocrystals with different shapes were derived. Theoretical estimations of the orders of the surface thermodynamic properties of nanocrystals agree with available experimental values. Calculated results of the surface thermodynamic properties of Au, Bi and Al nanocrystals suggest that when r > 10 nm, the surface thermodynamic properties linearly vary with the reciprocal of particle size, and when r < 10 nm, the effect of particle size on the surface thermodynamic properties becomes greater and deviates from linear variation. For nanocrystals with identical equivalent diameter, the more the shape deviates from sphere, the larger the surface thermodynamic properties (absolute value) are.

Application of the two-source energy balance model to partition evapotranspiration in an arid wine vineyard

NASA Astrophysics Data System (ADS)

Kool, Dilia; Kustas, William P.; Agam, Nurit

2016-04-01

The partitioning of evapotranspiration (ET) into transpiration (T), a productive water use, and soil water evaporation (E), which is generally considered a water loss, is highly relevant to agriculture in the light of increasing desertification and water scarcity. This task is challenged by the complexity of soil and plant interactions, coupled with changes in atmospheric and soil water content conditions. Many of the processes controlling water/energy exchange are not adequately modeled. The two-source energy balance model (TSEB) was evaluated and adapted for independent E and T estimations in an isolated drip-irrigated wine vineyard in the arid Negev desert. The TSEB model estimates ET by computing vegetation and soil energy fluxes using remotely sensed composite surface temperature, local weather data (solar radiation, air temperature and humidity, and wind speed), and vegetation metrics (row spacing, canopy height and width, and leaf area). The soil and vegetation energy fluxes are computed numerically using a system of temperature gradient and resistance equations; where soil and canopy temperatures are derived from the composite surface temperature. For estimation of ET, the TSEB model has been shown to perform well for various agricultural crops under a wide range of environmental conditions, but validation of T and E fluxes is limited to one study in a well-watered cotton crop. Extending the TSEB approach to water-limited vineyards demands careful consideration regarding how the complex canopy structure of vineyards will influence the accuracy of the partitioning between E and T. Data for evaluation of the TSEB model were collected over a season (bud break till harvest). Composite, canopy, and soil surface temperatures were measured using infrared thermometers. The composite vegetation and soil surface energy fluxes were assessed using independent measurements of net radiation, and soil, sensible and latent heat flux. The below canopy energy balance was assessed at the dry midrow position as well as the wet irrigated position directly underneath the vine row, where net radiation and soil heat flux were measured, sensible heat flux was computed indirectly, and E was calculated as the residual. While the below canopy energy balance approach used in this study allowed continuous assessment of E at daily intervals, instantaneous E fluxes could not be assessed due to vertical variability in shading below the canopy. Seasonal partitioning indicated that total E amounted to 9-11% of ET. Initial evaluation of the TSEB model indicated that discrepancies between modeled and measured fluxes can largely be attributed to net radiation partitioning. In addition, large diurnal variation at the soil surface requires adaptation of the soil heat flux formulations. Improved estimation of energy fluxes by accounting for the relatively complex canopy structure of vineyards will be highlighted.

Influence of inhomogeneous surface heat capacity on the estimation of radiative response coefficients in a two-zone energy balance model

NASA Astrophysics Data System (ADS)

Park, Jungmin; Choi, Yong-Sang

2018-04-01

Observationally constrained values of the global radiative response coefficient are pivotal to assess the reliability of modeled climate feedbacks. A widely used approach is to measure transient global radiative imbalance related to surface temperature changes. However, in this approach, a potential error in the estimate of radiative response coefficients may arise from surface inhomogeneity in the climate system. We examined this issue theoretically using a simple two-zone energy balance model. Here, we dealt with the potential error by subtracting the prescribed radiative response coefficient from those calculated within the two-zone framework. Each zone was characterized by the different magnitude of the radiative response coefficient and the surface heat capacity, and the dynamical heat transport in the atmosphere between the zones was parameterized as a linear function of the temperature difference between the zones. Then, the model system was forced by randomly generated monthly varying forcing mimicking time-varying forcing like an observation. The repeated simulations showed that inhomogeneous surface heat capacity causes considerable miscalculation (down to -1.4 W m-2 K-1 equivalent to 31.3% of the prescribed value) in the global radiative response coefficient. Also, the dynamical heat transport reduced this miscalculation driven by inhomogeneity of surface heat capacity. Therefore, the estimation of radiative response coefficients using the surface temperature-radiation relation is appropriate for homogeneous surface areas least affected by the exterior.

Use of ground-based remotely sensed data for surface energy balance evaluation of a semiarid rangeland

USGS Publications Warehouse

Moran, M.S.; Kustas, William P.; Vidal, A.; Stannard, D.I.; Blanford, J.H.; Nichols, W.D.

1994-01-01

An interdisciplinary field experiment was conducted to study the water and energy balance of a semiarid rangeland watershed in southeast Arizona during the summer of 1990. Two subwatersheds, one grass dominated and the other shrub dominated, were selected for intensive study with ground-based remote sensing systems and hydrometeorological instrumentation. Surface energy balance was evaluated at both sites using direct and indirect measurements of the turbulent fluxes (eddy correlation, variance, and Bowen ratio methods) and using an aerodynamic approach based on remote measurements of surface reflectance and temperature and conventional meteorological information. Estimates of net radiant flux density (Rn), derived from measurements of air temperature, incoming solar radiation, and surface temperature and radiance compared well with values measured using a net radiometer (mean absolute difference (MAD) ≃ 50 W/m2 over a range from 115 to 670 W/m2). Soil heat flux density (G) was estimated using a relation between G/Rn and a spectral vegetation index computed from the red and near-infrared surface reflectance. These G estimates compared well with conventional measurements of G using buried soil heat flux plates (MAD ≃ 20 W/m2 over a range from −13 to 213 W/m2). In order to account for the effects of sparse vegetation, semiempirical adjustments to the single-layer bulk aerodynamic resistance approach were required for evaluation of sensible heat flux density (H). This yielded differences between measurements and remote estimates of H of approximately 33 W/m2 over a range from 13 to 303 W/m2. The resulting estimates of latent heat flux density, LE, were of the same magnitude and trend as measured values; however, a significant scatter was still observed: MAD ≃ 40 W/m2 over a range from 0 to 340 W/m2. Because LE was solved as a residual, there was a cumulative effect of errors associated with remote estimates of Rn, G, and H.

Estimating Turbulent Surface Fluxes from Small Unmanned Aircraft: Evaluation of Current Abilities

NASA Astrophysics Data System (ADS)

de Boer, G.; Lawrence, D.; Elston, J.; Cassano, J. J.; Mack, J.; Wildmann, N.; Nigro, M. A.; Ivey, M.; Wolfe, D. E.; Muschinski, A.

2014-12-01

Heat transfer between the atmosphere and Earth's surface represents a key component to understanding Earth energy balance, making it important in understanding and simulating climate. Arguably, the oceanic air-sea interface and Polar sea-ice-air interface are amongst the most challenging in which to measure these fluxes. This difficulty results partially from challenges associated with infrastructure deployment on these surfaces and partially from an inability to obtain spatially representative values over a potentially inhomogeneous surface. Traditionally sensible (temperature) and latent (moisture) fluxes are estimated using one of several techniques. A preferred method involves eddy-correlation where cross-correlation between anomalies in vertical motion (w) and temperature (T) or moisture (q) is used to estimate heat transfer. High-frequency measurements of these quantities can be derived using tower-mounted instrumentation. Such systems have historically been deployed over land surfaces or on ships and buoys to calculate fluxes at the air-land or air-sea interface, but such deployments are expensive and challenging to execute, resulting in a lack of spatially diverse measurements. A second ("bulk") technique involves the observation of horizontal windspeed, temperature and moisture at a given altitude over an extended time period in order to estimate the surface fluxes. Small Unmanned Aircraft Systems (sUAS) represent a unique platform from which to derive these fluxes. These sUAS can be small ( 1 m), lightweight ( 700 g), low cost ( $2000) and relatively easy to deploy to remote locations and over inhomogeneous surfaces. We will give an overview of the ability of sUAS to provide measurements necessary for estimating surface turbulent fluxes. This discussion is based on flights in the vicinity of the 1000 ft. Boulder Atmospheric Observatory (BAO) tower, and over the US Department of Energy facility at Oliktok Point, Alaska. We will present initial comparisons between UAS-derived turbulent fluxes and those derived from tower-based instrumentation and discuss differences in the context of sensor technology and flight patterns employed to collect data.

Estimation of the Invisible Energy in Extensive Air Showers with the Data Collected by the Pierre Auger Observatory

NASA Astrophysics Data System (ADS)

Mariazzi, Analisa

The determination of the energy of primary cosmic rays from their extensive air showers using the fluorescence technique requires an estimation of the energy carried away by particles reaching the ground that do not deposit all their energy in the atmosphere. This estimation is typically made using Monte Carlo simulations and depends on the assumed primary particle mass and on model predictions for hadron-air collisions at high energies. In this work we review the method that the Pierre Auger Collaboration uses to obtain the invisible energy directly from hybrid events measured simultaneously with the fluorescence and the surface detectors of the Pierre Auger Observatory. As a corroboration of these results, a new method for the determination of the invisible energy using an independent data set is also presented. Both methods agree within systematic uncertainties, reducing significantly the biases related to differences between the high energy hadronic interaction models and data.

Field-scale and Regional Variability in Evapotranspiration over Crops in California using Eddy Covariance and Surface Renewal

NASA Astrophysics Data System (ADS)

Kent, E. R.; Clay, J. M.; Leinfelder-Miles, M.; Lambert, J. J.; Little, C.; Monteiro, R. O. C.; Monteiro, P. F. C.; Shapiro, K.; Rice, S.; Snyder, R. L.; Daniele, Z.; Paw U, K. T.

2016-12-01

Evapotranspiration (ET) estimated using a single crop coefficient and a grass reference largely ignores variability due to heterogeneity in microclimate, soils, and crop management. We employ a relatively low cost energy balance residual method using surface renewal and eddy covariance measurements to continuously estimate half-hourly and daily ET across more than 15 fields and orchards spanning four crops and two regions of California. In the Sacramento-San Joaquin River Delta, measurements were taken in corn, pasture, and alfalfa fields, with 4-5 stations in each crop type spread across the region. In the Southern San Joaquin Valley, measurements were taken in three different pistachio orchards, with one orchard having six stations instrumented to examine salinity-induced heterogeneity. We analyze field-scale and regional variability in ET and measured surface energy balance components. Cross comparisons between the eddy covariance and the surface renewal measurements confirm the robustness of the surface renewal method. A hybrid approach in which remotely sensed net radiation is combined with in situ measurements of sensible heat flux is also investigated. This work will provide ground-truth data for satellite and aerial-based ET estimates and will inform water management at the field and regional scales.

A review of global terrestrial evapotranspiration: Observation, modeling, climatology, and climatic variability

NASA Astrophysics Data System (ADS)

Wang, Kaicun; Dickinson, Robert E.

2012-06-01

This review surveys the basic theories, observational methods, satellite algorithms, and land surface models for terrestrial evapotranspiration, E (or λE, i.e., latent heat flux), including a long-term variability and trends perspective. The basic theories used to estimate E are the Monin-Obukhov similarity theory (MOST), the Bowen ratio method, and the Penman-Monteith equation. The latter two theoretical expressions combine MOST with surface energy balance. Estimates of E can differ substantially between these three approaches because of their use of different input data. Surface and satellite-based measurement systems can provide accurate estimates of diurnal, daily, and annual variability of E. But their estimation of longer time variability is largely not established. A reasonable estimate of E as a global mean can be obtained from a surface water budget method, but its regional distribution is still rather uncertain. Current land surface models provide widely different ratios of the transpiration by vegetation to total E. This source of uncertainty therefore limits the capability of models to provide the sensitivities of E to precipitation deficits and land cover change.

Instantaneous and daily values of the surface energy balance over agricultural fields using remote sensing and a reference field in an arid environment

USGS Publications Warehouse

Kustas, William P.; Moran, M.S.; Jackson, R. D.; Gay, L.W.; Duell, L.F.W.; Kunkel, K.E.; Matthias, A.D.

1990-01-01

Remotely sensed surface temperature and reflectance in the visible and near infrared wavebands along with ancilliary meteorological data provide the capability of computing three of the four surface energy balance components (i.e., net radiation, soil heat flux, and sensible heat flux) at different spatial and temporal scales. As a result, under nonadvective conditions, this enables the estimation of the remaining term (i.e., the latent heat flux). One of the practical applications with this approach is to produce evapotranspiration (ET) maps for agricultural regions which consist of an array of fields containing different crops at varying stages of growth and soil moisture conditions. Such a situation exists in the semiarid southwest at the University of Arizona Maricopa Agricultural Center, south of Phoenix. For one day (14 June 1987), surface temperature and reflectance measurements from an aircraft 150 m above ground level (agl) were acquired over fields from zero to nearly full cover at four times between 1000 MST and 1130 MST. The diurnal pattern of the surface energy balance was measured over four fields, which included alfalfa at 60% cover, furrowed cotton at 20% and 30% cover, and partially plowed what stubble. Instantaneous and daily values of ET were estimated for a representative area around each flux site with an energy balance model that relies on a reference ET. This reference value was determined with remotely sensed data and several meteorological inputs. The reference ET was adjusted to account for the different surface conditions in the other fields using only remotely sensed variables. A comparison with the flux measurements suggests the model has difficulties with partial canopy conditions, especially related to the estimation of the sensible heat flux. The resulting errors for instantaneous ET were on the order of 100 W m-2 and for daily values of order 2 mm day-1. These findings suggest future research should involve development of methods to account for the variability of meteorological parameters brought about by changes in surface conditions and improvements in the modeling of sensible heat transfer across the surface-atmosphere interface for partial canopy conditions using remote sensing information. ?? 1990.

Stability, surface features, and atom leaching of palladium nanoparticles: toward prediction of catalytic functionality.

PubMed

Ramezani-Dakhel, Hadi; Mirau, Peter A; Naik, Rajesh R; Knecht, Marc R; Heinz, Hendrik

2013-04-21

Surfactant-stabilized metal nanoparticles have shown promise as catalysts although specific surface features and their influence on catalytic performance have not been well understood. We quantify the thermodynamic stability, the facet composition of the surface, and distinct atom types that affect rates of atom leaching for a series of twenty near-spherical Pd nanoparticles of 1.8 to 3.1 nm size using computational models. Cohesive energies indicate higher stability of certain particles that feature an approximate 60/20/20 ratio of {111}, {100}, and {110} facets while less stable particles exhibit widely variable facet composition. Unique patterns of atom types on the surface cause apparent differences in binding energies and changes in reactivity. Estimates of the relative rate of atom leaching as a function of particle size were obtained by the summation of Boltzmann-weighted binding energies over all surface atoms. Computed leaching rates are in good qualitative correlation with the measured catalytic activity of peptide-stabilized Pd nanoparticles of the same shape and size in Stille coupling reactions. The agreement supports rate-controlling contributions by atom leaching in the presence of reactive substrates. The computational approach provides a pathway to estimate the catalytic activity of metal nanostructures of engineered shape and size, and possible further refinements are described.

Effect of ion concentration, solution and membrane permittivity on electric energy storage and capacitance.

PubMed

Tajparast, Mohammad; Glavinović, Mladen I

2018-06-06

Bio-membranes as capacitors store electric energy, but their permittivity is low whereas the permittivity of surrounding solution is high. To evaluate the effective capacitance of the membrane/solution system and determine the electric energy stored within the membrane and in the solution, we estimated their electric variables using Poisson-Nernst-Planck simulations. We calculated membrane and solution capacitances from stored electric energy. The effective capacitance was calculated by fitting a six-capacitance model to charges (fixed and ion) and associated potentials, because it cannot be considered as a result of membrane and solution capacitance in series. The electric energy stored within the membrane (typically much smaller than that in the solution), depends on the membrane permittivity, but also on the external electric field, surface charge density, water permittivity and ion concentration. The effect on capacitances is more specific. Solution capacitance rises with greater solution permittivity or ion concentration, but the membrane capacitance (much smaller than solution capacitance) is only influenced by its permittivity. Interestingly, the effective capacitance is independent of membrane or solution permittivity, but rises as the ion concentration increases and surface charge becomes positive. Experimental estimates of membrane capacitance are thus not necessarily a reliable index of its surface area. Copyright © 2018. Published by Elsevier B.V.

Evidence of a forward energy cascade and Kolmogorov self-similarity in submesoscale ocean surface drifter observations

NASA Astrophysics Data System (ADS)

Poje, Andrew C.; Ã-zgökmen, Tamay M.; Bogucki, Darek J.; Kirwan, A. D.

2017-02-01

Using two-point velocity and position data from the near-simultaneous release of O(100) GPS-tracked surface drifters in the northern Gulf of Mexico, we examine the applicability of classical turbulent scaling laws to upper ocean velocity fields. The dataset allows direct estimates of both velocity structure functions and the temporal evolution of the distribution of particle pair separations. On 100 m-10 km spatial scales, and time scales of order 1-10 days, all metrics of the observed surface fluctuations are consistent with standard Kolmogorov turbulence theory in an energy cascade inertial-range regime. The sign of the third-order structure function is negative and proportional to the separation distance for scales ≲10 km where local, fluctuating Rossby numbers are found to be larger than 0.1. The scale-independent energy dissipation rate, or downscale spectral flux, estimated from Kolmogorov's 4/5th law in this regime closely matches nearby microscale dissipation measurements in the near-surface. In contrast, similar statistics derived from a like-sized set of synthetic drifters advected by purely geostrophic altimetric AVISO data agree well with Kolmogorov-Kraichnan scaling for 2D turbulence in the forward enstrophy cascade range.

Evaluation of the surface free energy of plant surfaces: toward standardizing the procedure

PubMed Central

Fernández, Victoria; Khayet, Mohamed

2015-01-01

Plant surfaces have been found to have a major chemical and physical heterogeneity and play a key protecting role against multiple stress factors. During the last decade, there is a raising interest in examining plant surface properties for the development of biomimetic materials. Contact angle measurement of different liquids is a common tool for characterizing synthetic materials, which is just beginning to be applied to plant surfaces. However, some studies performed with polymers and other materials showed that for the same surface, different surface free energy values may be obtained depending on the number and nature of the test liquids analyzed, materials' properties, and surface free energy calculation methods employed. For 3 rough and 3 rather smooth plant materials, we calculated their surface free energy using 2 or 3 test liquids and 3 different calculation methods. Regardless of the degree of surface roughness, the methods based on 2 test liquids often led to the under- or over-estimation of surface free energies as compared to the results derived from the 3-Liquids method. Given the major chemical and structural diversity of plant surfaces, it is concluded that 3 different liquids must be considered for characterizing materials of unknown physico-chemical properties, which may significantly differ in terms of polar and dispersive interactions. Since there are just few surface free energy data of plant surfaces with the aim of standardizing the calculation procedure and interpretation of the results among for instance, different species, organs, or phenological states, we suggest the use of 3 liquids and the mean surface tension values provided in this study. PMID:26217362

Measurement of the adsorption energy difference between ortho- and para-D2 on an amorphous ice surface.

PubMed

Amiaud, L; Momeni, A; Dulieu, F; Fillion, J H; Matar, E; Lemaire, J-L

2008-02-08

Molecular hydrogen interaction on water ice surfaces is a major process taking place in interstellar dense clouds. By coupling laser detection and classical thermal desorption spectroscopy, it is possible to study the effect of rotation of D(2) on adsorption on amorphous solid water ice surfaces. The desorption profiles of ortho- and para-D(2) are different. This difference is due to a shift in the adsorption energy distribution of the two lowest rotational states. Molecules in J''=1 rotational state are on average more strongly bound to the ice surface than those in J''=0 rotational state. This energy difference is estimated to be 1.4+/-0.3 meV. This value is in agreement with previous calculation and interpretation. The nonspherical wave function J'' =1 has an interaction with the asymmetric part of the adsorption potential and contributes positively in the binding energy.

Energy budget of the volcano Stromboli, Italy

NASA Technical Reports Server (NTRS)

Mcgetchin, T. R.; Chouet, B. A.

1979-01-01

The results of the analyses of movies of eruptions at Stromboli, Italy, and other available data are used to discuss the question of its energy partitioning among various energy transport mechanisms. Energy is transported to the surface from active volcanoes in at least eight modes, viz. conduction (and convection) of the heat through the surface, radiative heat transfer from the vent, acoustical radiation in blast and jet noise, seismic radiation, thermal energy of ejected particles, kinetic energy of ejected particles, thermal energy of ejected gas, and kinetic energy of ejected gas. Estimated values of energy flux from Stromboli by these eight mechanisms are tabulated. The energy budget of Stromboli in its normal mode of activity appears to be dominated by heat conduction (and convection) through the ground surface. Heat carried by eruption gases is the most important of the other energy transfer modes. Radiated heat from the open vent and heat carried by ejected lava particles also contribute to the total flux, while seismic energy accounts for about 0.5% of the total. All other modes are trivial by comparison.

An adaptive interpolation scheme for molecular potential energy surfaces

DOE Office of Scientific and Technical Information (OSTI.GOV)

Kowalewski, Markus, E-mail: mkowalew@uci.edu; Larsson, Elisabeth; Heryudono, Alfa

The calculation of potential energy surfaces for quantum dynamics can be a time consuming task—especially when a high level of theory for the electronic structure calculation is required. We propose an adaptive interpolation algorithm based on polyharmonic splines combined with a partition of unity approach. The adaptive node refinement allows to greatly reduce the number of sample points by employing a local error estimate. The algorithm and its scaling behavior are evaluated for a model function in 2, 3, and 4 dimensions. The developed algorithm allows for a more rapid and reliable interpolation of a potential energy surface within amore » given accuracy compared to the non-adaptive version.« less

Deriving a global land surface albedo product from Landsat MSS, TM, ETM+, and OLI data based on the unified direct estimation approach

USDA-ARS?s Scientific Manuscript database

Surface albedo is widely used in climate and environment applications as an important parameter for controlling the surface energy budget. There is an increasing need for fine resolution (< 100 m) albedo data for use in small scale applications and for validating coarse-resolution datasets; however,...

Estimation of land surface heat fluxes based on visible infrared imaging radiometer suite data: case study in northern China

NASA Astrophysics Data System (ADS)

Li, Xiaojun; Xin, Xiaozhou; Peng, Zhiqing; Zhang, Hailong; Li, Li; Shao, Shanshan; Liu, Qinhuo

2017-10-01

Evapotranspiration (ET) plays an important role in surface-atmosphere interactions and can be monitored using remote sensing data. The visible infrared imaging radiometer suite (VIIRS) sensor is a generation of optical satellite sensors that provide daily global coverage at 375- to 750-m spatial resolutions with 22 spectral channels (0.412 to 12.05 μm) and capable of monitoring ET from regional to global scales. However, few studies have focused on methods of acquiring ET from VIIRS images. The objective of this study is to introduce an algorithm that uses the VIIRS data and meteorological variables to estimate the energy budgets of land surfaces, including the net radiation, soil heat flux, sensible heat flux, and latent heat fluxes. A single-source model that based on surface energy balance equation is used to obtain surface heat fluxes within the Zhangye oasis in China. The results were validated using observations collected during the HiWATER (Heihe Watershed Allied Telemetry Experimental Research) project. To facilitate comparison, we also use moderate resolution imaging spectrometer (MODIS) data to retrieve the regional surface heat fluxes. The validation results show that it is feasible to estimate the turbulent heat flux based on the VIIRS sensor and that these data have certain advantages (i.e., the mean bias error of sensible heat flux is 15.23 W m-2) compared with MODIS data (i.e., the mean bias error of sensible heat flux is -29.36 W m-2). Error analysis indicates that, in our model, the accuracies of the estimated sensible heat fluxes rely on the errors in the retrieved surface temperatures and the canopy heights.

Estimation of excitation forces for wave energy converters control using pressure measurements

NASA Astrophysics Data System (ADS)

Abdelkhalik, O.; Zou, S.; Robinett, R.; Bacelli, G.; Wilson, D.

2017-08-01

Most control algorithms of wave energy converters require prediction of wave elevation or excitation force for a short future horizon, to compute the control in an optimal sense. This paper presents an approach that requires the estimation of the excitation force and its derivatives at present time with no need for prediction. An extended Kalman filter is implemented to estimate the excitation force. The measurements in this approach are selected to be the pressures at discrete points on the buoy surface, in addition to the buoy heave position. The pressures on the buoy surface are more directly related to the excitation force on the buoy as opposed to wave elevation in front of the buoy. These pressure measurements are also more accurate and easier to obtain. A singular arc control is implemented to compute the steady-state control using the estimated excitation force. The estimated excitation force is expressed in the Laplace domain and substituted in the control, before the latter is transformed to the time domain. Numerical simulations are presented for a Bretschneider wave case study.

Nanoimprinted ultrafine line and space nanogratings for liquid crystal alignment.

PubMed

Liu, Yan Jun; Loh, Wei Wei; Leong, Eunice Sok Ping; Kustandi, Tanu Suryadi; Sun, Xiao Wei; Teng, Jing Hua

2012-11-23

Ultrafine 50 nm line and space nanogratings were fabricated using nanoimprint lithography, and were further used as an alignment layer for liquid crystals. The surface morphologies of the nanogratings were characterized and their surface energies were estimated through the measurement of the contact angles for two different liquids. Experimental results show that the surface energies of the nanogratings are anisotropic: the surface free energy towards the direction parallel to the grating lines is higher than that in the direction perpendicular to the grating lines. Electro-optical characteristics were tested from a twisted nematic liquid crystal cell, which was assembled using two identical nanogratings. Experimental results show that such a kind of nanograting is promising as an alternative to the conventional rubbing process for liquid crystal alignment.

A Thermal-based Two-Source Energy Balance Model for Estimating Evapotranspiration over Complex Canopies

USDA-ARS?s Scientific Manuscript database

Land surface temperature (LST) provides valuable information for quantifying root-zone water availability, evapotranspiration (ET) and crop condition as well as providing useful information for constraining prognostic land surface models. This presentation describes a robust but relatively simple LS...

Morphology and the Strength of Intermolecular Contact in Protein Crystals

NASA Technical Reports Server (NTRS)

Matsuura, Yoshiki; Chernov, Alexander A.

2002-01-01

The strengths of intermolecular contacts (macrobonds) in four lysozyme crystals were estimated based on the strengths of individual intermolecular interatomic interaction pairs. The periodic bond chain of these macrobonds accounts for the morphology of protein crystals as shown previously. Further in this paper, the surface area of contact, polar coordinate representation of contact site, Coulombic contribution on the macrobond strength, and the surface energy of the crystal have been evaluated. Comparing location of intermolecular contacts in different polymorphic crystal modifications, we show that these contacts can form a wide variety of patches on the molecular surface. The patches are located practically everywhere on this surface except for the concave active site. The contacts frequently include water molecules, with specific intermolecular hydrogen-bonds on the background of non-specific attractive interactions. The strengths of macrobonds are also compared to those of other protein complex systems. Making use of the contact strengths and taking into account bond hydration we also estimated crystal-water interfacial energies for different crystal faces.

Mars surface radiation exposure for solar maximum conditions and 1989 solar proton events

NASA Technical Reports Server (NTRS)

Simonsen, Lisa C.; Nealy, John E.

1992-01-01

The Langley heavy-ion/nucleon transport code, HZETRN, and the high-energy nucleon transport code, BRYNTRN, are used to predict the propagation of galactic cosmic rays (GCR's) and solar flare protons through the carbon dioxide atmosphere of Mars. Particle fluences and the resulting doses are estimated on the surface of Mars for GCR's during solar maximum conditions and the Aug., Sep., and Oct. 1989 solar proton events. These results extend previously calculated surface estimates for GCR's at solar minimum conditions and the Feb. 1956, Nov. 1960, and Aug. 1972 solar proton events. Surface doses are estimated with both a low-density and a high-density carbon dioxide model of the atmosphere for altitudes of 0, 4, 8, and 12 km above the surface. A solar modulation function is incorporated to estimate the GCR dose variation between solar minimum and maximum conditions over the 11-year solar cycle. By using current Mars mission scenarios, doses to the skin, eye, and blood-forming organs are predicted for short- and long-duration stay times on the Martian surface throughout the solar cycle.

Multi Seasonal and Diurnal Characterization of Sensible Heat Flux in an Arid Land Environment

NASA Astrophysics Data System (ADS)

Al-Mashharawi, S.; Aragon, B.; McCabe, M.

2017-12-01

In sparsely vegetated arid and semi-arid regions, the available energy is transformed primarily into sensible heat, with little to no energy partitioned into latent heat. The characterization of bare soil arid environments are rather poorly understood in the context of both local, regional and global energy budgets. Using data from a long-term surface layer scintillometer and co-located meteorological installation, we examine the diurnal and seasonal patterns of sensible heat flux and the net radiation to soil heat flux ratio. We do this over a bare desert soil located adjacent to an irrigated agricultural field in the central region of Saudi Arabia. The results of this exploratory analysis can be used to inform upon remote sensing techniques for surface flux estimation, to derive and monitor soil heat flux dynamics, estimate the heat transfer resistance and the thermal roughness length over bare soils, and to better inform efforts that model the advective effects that complicate the accurate representation of agricultural energy budgets in the arid zone.

A spatial-temporal method for assessing the energy balance dynamics of partially sealed surfaces.

NASA Astrophysics Data System (ADS)

Pipkins, Kyle; Kleinschmit, Birgit; Wessolek, Gerd

2017-04-01

The effects of different types of sealed surfaces on the surface energy balance have been well-studied in the past. However, these field studies typically aggregate these surfaces into continuous units. The proposed method seeks to disaggregate such surfaces into paving and seam areas using spatial methods, and to consider the temperature dynamics under wet and dry conditions between these two components. This experimental work is undertaken using a thermal camera to record a time series of images over two lysimeters with differing levels of surface sealing. The images are subsequently decomposed into component materials using object-based image analysis and compared on the basis of both the surface materials as well as the spatial configuration of materials. Finally, a surface energy balance method is used to estimate evaporation rates from the surfaces, both separately for the different surface components as well as using the total surface mean. Results are validated using the output of the weighing lysimeter. Our findings will determine whether the explicitly spatial method is an improvement over the mean aggregate method.

The impact of sea surface currents in wave power potential modeling

NASA Astrophysics Data System (ADS)

Zodiatis, George; Galanis, George; Kallos, George; Nikolaidis, Andreas; Kalogeri, Christina; Liakatas, Aristotelis; Stylianou, Stavros

2015-11-01

The impact of sea surface currents to the estimation and modeling of wave energy potential over an area of increased economic interest, the Eastern Mediterranean Sea, is investigated in this work. High-resolution atmospheric, wave, and circulation models, the latter downscaled from the regional Mediterranean Forecasting System (MFS) of the Copernicus marine service (former MyOcean regional MFS system), are utilized towards this goal. The modeled data are analyzed by means of a variety of statistical tools measuring the potential changes not only in the main wave characteristics, but also in the general distribution of the wave energy and the wave parameters that mainly affect it, when using sea surface currents as a forcing to the wave models. The obtained results prove that the impact of the sea surface currents is quite significant in wave energy-related modeling, as well as temporally and spatially dependent. These facts are revealing the necessity of the utilization of the sea surface currents characteristics in renewable energy studies in conjunction with their meteo-ocean forecasting counterparts.

Mapping surface energy balance components by combining landsat thematic mapper and ground-based meteorological data

USGS Publications Warehouse

Moran, M.S.; Jackson, R. D.; Raymond, L.H.; Gay, L.W.; Slater, P.N.

1989-01-01

Surface energy balance components were evaluated by combining satellite-based spectral data with on-site measurements of solar irradiance, air temperature, wind speed, and vapor pressure. Maps of latent heat flux density (??E) and net radiant flux density (Rn) were produced using Landsat Thematic Mapper (TM) data for three dates: 23 July 1985, 5 April 1986, and 24 June 1986. On each date, a Bowen-ratio apparatus, located in a vegetated field, was used to measure ??E and Rn at a point within the field. Estimates of ??E and Rn were also obtained using radiometers aboard an aircraft flown at 150 m above ground level. The TM-based estimates differed from the Bowen-ratio and aircraft-based estimates by less than 12 % over mature fields of cotton, wheat, and alfalfa, where ??E and Rn ranged from 400 to 700 Wm-2. ?? 1989.

[Measurement and estimation methods and research progress of snow evaporation in forests].

PubMed

Li, Hui-Dong; Guan, De-Xin; Jin, Chang-Jie; Wang, An-Zhi; Yuan, Feng-Hui; Wu, Jia-Bing

2013-12-01

Accurate measurement and estimation of snow evaporation (sublimation) in forests is one of the important issues to the understanding of snow surface energy and water balance, and it is also an essential part of regional hydrological and climate models. This paper summarized the measurement and estimation methods of snow evaporation in forests, and made a comprehensive applicability evaluation, including mass-balance methods (snow water equivalent method, comparative measurements of snowfall and through-snowfall, snow evaporation pan, lysimeter, weighing of cut tree, weighing interception on crown, and gamma-ray attenuation technique) and micrometeorological methods (Bowen-ratio energy-balance method, Penman combination equation, aerodynamics method, surface temperature technique and eddy covariance method). Also this paper reviewed the progress of snow evaporation in different forests and its influencal factors. At last, combining the deficiency of past research, an outlook for snow evaporation rearch in forests was presented, hoping to provide a reference for related research in the future.

Core Temperature and Surface Heat Flux During Exercise in Heat While Wearing Body Armor

DTIC Science & Technology

2015-10-26

Table 7, overall dry > humid, there were no significant differences for energy costs (M) between environments. When compared to the estimated M...KB, Givoni B, & Goldman RF. Predicting energy expenditure with loads while standing or walking very slowly. J Appl Physiol 43(4): 577-581, 1977...No. 0704-0188 The public reporting burden for this collection of information is estimated to average 1 hour per response, including the time for

An enhanced computational method for age-at-death estimation based on the pubic symphysis using 3D laser scans and thin plate splines.

PubMed

Stoyanova, Detelina; Algee-Hewitt, Bridget F B; Slice, Dennis E

2015-11-01

The pubic symphysis is frequently used to estimate age-at-death from the adult skeleton. Assessment methods require the visual comparison of the bone morphology against age-informative characteristics that represent a series of phases. Age-at-death is then estimated from the age-range previously associated with the chosen phase. While easily executed, the "morphoscopic" process of feature-scoring and bone-to-phase-matching is known to be subjective. Studies of method and practitioner error demonstrate a need for alternative tools to quantify age-progressive change in the pubic symphysis. This article proposes a more objective, quantitative method that analyzes three-dimensional (3D) surface scans of the pubic symphysis using a thin plate spline algorithm (TPS). This algorithm models the bending of a flat plane to approximately match the surface of the bone and minimizes the bending energy required for this transformation. Known age-at-death and bending energy were used to construct a linear model to predict age from observed bending energy. This approach is tested with scans from 44 documented white male skeletons and 12 casts. The results of the surface analysis show a significant association (regression p-value = 0.0002 and coefficient of determination = 0.2270) between the minimum bending energy and age-at-death, with a root mean square error of ≈19 years. This TPS method yields estimates comparable to established methods but offers a fully integrated, objective and quantitative framework of analysis and has potential for use in archaeological and forensic casework. © 2015 Wiley Periodicals, Inc.

Characterizing the Diurnal Cycle of Land Surface Temperature and Evapotranspiration at High Spatial Resolution Using Thermal Observations from sUAS.

NASA Astrophysics Data System (ADS)

Dutta, D.; Drewry, D.; Johnson, W. R.

2017-12-01

The surface temperature of plant canopies is an important indicator of the stomatal regulation of plant water use and the associated water flux from plants to atmosphere (evapotranspiration (ET)). Remotely sensed thermal observations using compact, low-cost, lightweight sensors from small unmanned aerial systems (sUAS) have the potential to provide surface temperature (ST) and ET estimates at unprecedented spatial and temporal resolutions, allowing us to characterize the intra-field diurnal variations in canopy ST and ET for a variety of vegetation systems. However, major challenges exist for obtaining accurate surface temperature estimates from low-cost uncooled microbolometer-type sensors. Here we describe the development of calibration methods using thermal chamber experiments, taking into account the ambient optics and sensor temperatures, and applying simple models of spatial non-uniformity correction to the sensor focal-plane-array. We present a framework that can be used to derive accurate surface temperatures using radiometric observations from low-cost sensors, and demonstrate this framework using a sUAS-mounted sensor across a diverse set of calibration and vegetation targets. Further, we demonstrate the use of the Surface Temperature Initiated Closure (STIC) model for computing spatially explicit, high spatial resolution ET estimates across several well-monitored agricultural systems, as driven by sUAS acquired surface temperatures. STIC provides a physically-based surface energy balance framework for the simultaneous retrieval of the surface and atmospheric vapor conductances and surface energy fluxes, by physically integrating radiometric surface temperature information into the Penman-Monteith equation. Results of our analysis over agricultural systems in Ames, IA and Davis, CA demonstrate the power of this approach for quantifying the intra-field spatial variability in the diurnal cycle of plant water use at sub-meter resolutions.

Observing and Modeling Earth's Energy Flows

NASA Astrophysics Data System (ADS)

Stevens, Bjorn; Schwartz, Stephen E.

2012-07-01

This article reviews, from the authors' perspective, progress in observing and modeling energy flows in Earth's climate system. Emphasis is placed on the state of understanding of Earth's energy flows and their susceptibility to perturbations, with particular emphasis on the roles of clouds and aerosols. More accurate measurements of the total solar irradiance and the rate of change of ocean enthalpy help constrain individual components of the energy budget at the top of the atmosphere to within ±2 W m-2. The measurements demonstrate that Earth reflects substantially less solar radiation and emits more terrestrial radiation than was believed even a decade ago. Active remote sensing is helping to constrain the surface energy budget, but new estimates of downwelling surface irradiance that benefit from such methods are proving difficult to reconcile with existing precipitation climatologies. Overall, the energy budget at the surface is much more uncertain than at the top of the atmosphere. A decade of high-precision measurements of the energy budget at the top of the atmosphere is providing new opportunities to track Earth's energy flows on timescales ranging from days to years, and at very high spatial resolution. The measurements show that the principal limitation in the estimate of secular trends now lies in the natural variability of the Earth system itself. The forcing-feedback-response framework, which has developed to understand how changes in Earth's energy flows affect surface temperature, is reviewed in light of recent work that shows fast responses (adjustments) of the system are central to the definition of the effective forcing that results from a change in atmospheric composition. In many cases, the adjustment, rather than the characterization of the compositional perturbation (associated, for instance, with changing greenhouse gas concentrations, or aerosol burdens), limits accurate determination of the radiative forcing. Changes in clouds contribute importantly to this adjustment and thus contribute both to uncertainty in estimates of radiative forcing and to uncertainty in the response. Models are indispensable to calculation of the adjustment of the system to a compositional change but are known to be flawed in their representation of clouds. Advances in tracking Earth's energy flows and compositional changes on daily through decadal timescales are shown to provide both a critical and constructive framework for advancing model development and evaluation.

Application of self-preservation in the diurnal evolution of the surface energy budget to determine daily evaporation

NASA Technical Reports Server (NTRS)

Brutsaert, Wilfried; Sugita, Michiaki

1992-01-01

Evaporation from natural land surfaces often exhibits a strong variation during the course of a day, mostly in response to the daily variation of radiative energy input at the surface. This makes it difficult to derive the total daily evaporation, when only one or a few instantaneous estimates of evaporation are available. It is often possible to resolve this difficulty by assuming self-preservation in the diurnal evolution of the surface energy budget. Thus if the relative partition of total incoming energy flux among the different components remains the same, the ratio of latent heat flux and any other flux component can be taken as constant through the day. This concept of constant flux ratios is tested by means of data obtained during the First ISLSCP Field Experiment; the instantaneous evaporation values were calculated by means of the atmospheric boundary layer bulk similarity approach with radiosonde profiles and radiative surface temperatures. Good results were obtained for evaporative flux ratios with available energy flux, with net radiation, and with incoming shortwave radiation.

A sensor-based energy balance method for the distributed estimation of evaporation over the North American Great Lakes

NASA Astrophysics Data System (ADS)

Fries, K. J.; Kerkez, B.; Gronewold, A.; Lenters, J. D.

2014-12-01

We introduce a novel energy balance method to estimate evaporation across large lakes using real-time data from moored buoys and mobile, satellite-tracked drifters. Our work is motivated by the need to improve our understanding of the water balance of the Laurentian Great Lakes basin, a complex hydrologic system that comprises 90% of the United States' and 20% of the world's fresh surface water. Recently, the lakes experienced record-setting water level drops despite above-average precipitation, and given that lake surface area comprises nearly one third of the entire basin, evaporation is suspected to be the primary driver behind the decrease in water levels. There has historically been a need to measure evaporation over the Great Lakes, and recent hydrological phenomena (including not only record low levels, but also extreme changes in ice cover and surface water temperatures) underscore the urgency of addressing that need. Our method tracks the energy fluxes of the lake system - namely net radiation, heat storage and advection, and Bowen ratio. By measuring each of these energy budget terms and combining the results with mass-transfer based estimates, we can calculate real-time evaporation rates on sub-hourly timescales. To mitigate the cost prohibitive nature of large-scale, distributed energy flux measurements, we present a novel approach in which we leverage existing investments in seasonal buoys (which, while providing intensive, high quality data, are costly and sparsely distributed across the surface of the Great Lakes) and then integrate data from less costly satellite-tracked drifter data. The result is an unprecedented, hierarchical sensor and modeling architecture that can be used to derive estimates of evaporation in real-time through cloud-based computing. We discuss recent deployments of sensor-equipped buoys and drifters, which are beginning to provide us with some of the first in situ measurements of overlake evaporation from Earth's largest lake system, opening up the potential for improved and integrated monitoring and modeling of the Great Lakes water budget.

A review of surface energy balance models for estimating actual evapotranspiration with remote sensing at high spatiotemporal resolution over large extents

Treesearch

Ryan R. McShane; Katelyn P. Driscoll; Roy Sando

2017-01-01

Many approaches have been developed for measuring or estimating actual evapotranspiration (ETa), and research over many years has led to the development of remote sensing methods that are reliably reproducible and effective in estimating ETa. Several remote sensing methods can be used to estimate ETa at the high spatial resolution of agricultural fields and the large...

A comparison of surface biophysical properties and remotely sensed variables from FIFE

NASA Technical Reports Server (NTRS)

Sellers, Piers; Heiser, Mark; Walthall, C. W.; Huemmrich, F.; Strebel, D. E.; Hall, F. G.

1990-01-01

A method for calculating surface energy balances is investigated which incorporates the vegetation index and/or other indicators of surface conductance at visible and near-IR channels. Data from the Konza Prairie are employed to confirm the hypothesized relationship between maximum canopy conductance and the observed simple-ratio vegetation index. The relationship is established, but more data regarding soil-surface contributions are required to estimate the total surface conductance to evapotranspiration.

A comparison of consumptive-use estimates derived from the simplified surface energy balance approach and indirect reporting methods

USGS Publications Warehouse

Maupin, Molly A.; Senay, Gabriel B.; Kenny, Joan F.; Savoca, Mark E.

2012-01-01

Recent advances in remote-sensing technology and Simplified Surface Energy Balance (SSEB) methods can provide accurate and repeatable estimates of evapotranspiration (ET) when used with satellite observations of irrigated lands. Estimates of ET are generally considered equivalent to consumptive use (CU) because they represent the part of applied irrigation water that is evaporated, transpired, or otherwise not available for immediate reuse. The U.S. Geological Survey compared ET estimates from SSEB methods to CU data collected for 1995 using indirect methods as part of the National Water Use Information Program (NWUIP). Ten-year (2000-2009) average ET estimates from SSEB methods were derived using Moderate Resolution Imaging Spectroradiometer (MODIS) 1-kilometer satellite land surface temperature and gridded weather datasets from the Global Data Assimilation System (GDAS). County-level CU estimates for 1995 were assembled and referenced to 1-kilometer grid cells to synchronize with the SSEB ET estimates. Both datasets were seasonally and spatially weighted to represent the irrigation season (June-September) and those lands that were identified in the county as irrigated. A strong relation (R2 greater than 0.7) was determined between NWUIP CU and SSEB ET data. Regionally, the relation is stronger in arid western states than in humid eastern states, and positive and negative biases are both present at state-level comparisons. SSEB ET estimates can play a major role in monitoring and updating county-based CU estimates by providing a quick and cost-effective method to detect major year-to-year changes at county levels, as well as providing a means to disaggregate county-based ET estimates to sub-county levels. More research is needed to identify the causes for differences in state-based relations.

The Effect of Solution Chemistry on Nucleation of Nesquehonite

NASA Astrophysics Data System (ADS)

Zhao, L.; Zhu, C.; Wang, Z.

2016-12-01

The interfaces between minerals and aqueous solutions are key to important Earth surface processes, including chemical weathering, mineral dissolution/precipitation, and pollutant absorption/release. Mineral surface properties, such as the surface structure and the surface energy, determine the outcomes of many geochemical reactions. Several factors could affect surface energy, but the effect of solution chemistry, particularly the solution stoichiometry, on the surface energy and nucleation process is poorly understood. The goal of this study is to understand the effect of solution chemistry on the nucleation of nesquehonite. Nesquehonite nucleation experiments were conducted in aqueous solutions having similar Mg2+/ CO32- activity ratios, but different saturation states and solution pH. The experimental results show that induction-time estimates from our precipitation experiments with similar Mg2+/CO32- activity ratios are consistent with classical nucleation theory (CNT), while the surface energy derived from CNT varies with Mg2+/CO32- activity ratios. Our observations can be explained by the different absorption behaviors of Mg2+ and CO32- and and/or reduced Gibbs free energies through better screening of the electric double layer. A surface energy model involving solution composition is developed that combines surface complexation with electrostatic models. The new model takes into account how surface charge may affect surface energy. It implies that the highest surface energy may occur around the point of zero charge (p.z.c), where the nucleation is fastest (or conversely, where the induction time is shortest) under low saturation states, but not under high saturation states. An accelerated attachment rate of monomers at the p.z.c. is consistent with high surface energy, since it represents higher reactivity of surface ions and less work needed to break the solvated water molecules. This study provides deeper insights into mechanisms of nesquehonite nucleation in nature, and guidelines for accelerating the precipitation rates of nesquehonite.

Significant Dissipation of Tidal Energy in the Deep Ocean Inferred from Satellite Altimeter Data

NASA Technical Reports Server (NTRS)

Egbert, G. D.; Ray, R. D.

2000-01-01

How and where the ocean tides dissipate their energy are longstanding questions that have consequences ranging from the history of the Moon to the mixing of the oceans. Historically, the principal sink of tidal energy has been thought to be bottom friction in shallow seas. There has long been suggestive however, that tidal dissipation also occurs in the open ocean through the scattering by ocean-bottom topography of surface tides into internal waves, but estimates of the magnitude of this possible sink have varied widely. Here we use satellite altimeter data from Topex/Poseidon to map empirically the tidal energy dissipation. We show that approximately 10(exp 12) watts-that is, 1 TW, representing 25-30% of the total dissipation-occurs in the deep ocean, generally near areas of rough topography. Of the estimated 2 TW of mixing energy required to maintain the large-scale thermohaline circulation of the ocean, one-half could therefore be provided by the tides, with the other half coming from action on the surface of the ocean.

Estimating Agricultural Water Use using the Operational Simplified Surface Energy Balance Evapotranspiration Estimation Method

NASA Astrophysics Data System (ADS)

Forbes, B. T.

2015-12-01

Due to the predominantly arid climate in Arizona, access to adequate water supply is vital to the economic development and livelihood of the State. Water supply has become increasingly important during periods of prolonged drought, which has strained reservoir water levels in the Desert Southwest over past years. Arizona's water use is dominated by agriculture, consuming about seventy-five percent of the total annual water demand. Tracking current agricultural water use is important for managers and policy makers so that current water demand can be assessed and current information can be used to forecast future demands. However, many croplands in Arizona are irrigated outside of areas where water use reporting is mandatory. To estimate irrigation withdrawals on these lands, we use a combination of field verification, evapotranspiration (ET) estimation, and irrigation system qualification. ET is typically estimated in Arizona using the Modified Blaney-Criddle method which uses meteorological data to estimate annual crop water requirements. The Modified Blaney-Criddle method assumes crops are irrigated to their full potential over the entire growing season, which may or may not be realistic. We now use the Operational Simplified Surface Energy Balance (SSEBop) ET data in a remote-sensing and energy-balance framework to estimate cropland ET. SSEBop data are of sufficient resolution (30m by 30m) for estimation of field-scale cropland water use. We evaluate our SSEBop-based estimates using ground-truth information and irrigation system qualification obtained in the field. Our approach gives the end user an estimate of crop consumptive use as well as inefficiencies in irrigation system performance—both of which are needed by water managers for tracking irrigated water use in Arizona.

How Well are Recent Climate Variability Signals Resolved by Satellite Radiative Flux Estimates?

NASA Technical Reports Server (NTRS)

Robertson, Franklin R.; Lu, H.-L.

2004-01-01

One notable aspect of Earth s climate is that although the planet appears to be very close to radiative balance at top-of-atmosphere (TOA), the atmosphere itself and underlying surface are not. Profound exchanges of energy between the atmosphere and oceans, land and cryosphere occur over a range of time scales. Recent evidence from broadband satellite measurements suggests that even these TOA fluxes contain some detectable variations. Our ability to measure and reconstruct radiative fluxes at the surface and at the top of atmosphere is improving rapidly. Understanding the character of radiative flux estimates and relating them to variations in other energy fluxes and climate state variables is key to improving our understanding of climate. In this work we will evaluate several recently released estimates of radiative fluxes, focusing primarily on surface estimates. The International Satellite Cloud Climatology Project FD radiative flux profiles are available from rnid-1983 to near present and have been constructed by driving the radiative transfer physics from the Goddard Institute for Space Studies (GISS) global model with ISCCP clouds and HlRS operational soundings profiles. Full and clear sky SW and LW fluxes are produced. A similar product from the NASA/GEWEX Surface Radiation Budget Project using different radiative flux codes and thermodynamics from the NASA/Goddard Earth Observing System assimilation model makes a similar calculation of surface fluxes. However this data set currently extends only through 1995. Several estimates of downward LW flux at the surface inferred from microwave data are also examined. Since these products have been evaluated with Baseline Surface Radiation Network data over land we focus over ocean regions and use the DOE/NOAA/NASA Shipboard Ocean Atmospheric Radiation (SOAR) surface flux measurements to characterize performance of these data sets under both clear and cloudy conditions. Some aspects of performance are stratified according to SST and vertical motion regimes. Comparisons to the TRMM/CERES SRB data in 1998 are also interpreted. These radiative fluxes are then analyzed to determine how surface (and TOA) radiative exchanges respond to interannual signals of ENS0 warm and cold events. Our analysis includes regional changes as well as integrated signals over land, ocean and various latitude bands. Changes in water vapor and cloud forcing signatures are prominent on interannual time scales. Prominent signals are also found in the SW fluxes for the Pinatubo volcanic event. These systematic changes in fluxes are related to changes in large-scale circulations and energy transport in the atmosphere and ocean. Some estimates of signal-to-noise and reliability are discussed to place our results in context.

What determines transitions between energy- and moisture-limited evaporative regimes?

NASA Astrophysics Data System (ADS)

Haghighi, E.; Gianotti, D.; Akbar, R.; Salvucci, G.; Entekhabi, D.

2017-12-01

The relationship between evaporative fraction (EF) and soil moisture (SM) has traditionally been used in atmospheric and land-surface modeling communities to determine the strength of land-atmosphere coupling in the context of the dominant evaporative regime (energy- or moisture-limited). However, recent field observations reveal that EF-SM relationship is not unique and could vary substantially with surface and/or meteorological conditions. This implies that conventional EF-SM relationships (exclusive of surface and meteorological conditions) are embedded in more complex dependencies and that in fact it is a multi-dimensional function. To fill the fundamental knowledge gaps on the important role of varying surface and meteorological conditions not accounted for by the traditional evaporative regime conceptualization, we propose a generalized EF framework using a mechanistic pore-scale model for evaporation and energy partitioning over drying soil surfaces. Nonlinear interactions among the components of the surface energy balance are reflected in a critical SM that marks the onset of transition between energy- and moisture-limited evaporative regimes. The new generalized EF framework enables physically based estimates of the critical SM, and provides new insights into the origin of land surface EF partitioning linked to meteorological input data and the evolution of land surface temperature during surface drying that affect the relative efficiency of surface energy balance components. Our results offer new opportunities to advance predictive capabilities quantifying land-atmosphere coupling for a wide range of present and projected meteorological input data.

Estimating decades-long trends in petroleum field energy return on investment (EROI) with an engineering-based model.

PubMed

Tripathi, Vinay S; Brandt, Adam R

2017-01-01

This paper estimates changes in the energy return on investment (EROI) for five large petroleum fields over time using the Oil Production Greenhouse Gas Emissions Estimator (OPGEE). The modeled fields include Cantarell (Mexico), Forties (U.K.), Midway-Sunset (U.S.), Prudhoe Bay (U.S.), and Wilmington (U.S.). Data on field properties and production/processing parameters were obtained from a combination of government and technical literature sources. Key areas of uncertainty include details of the oil and gas surface processing schemes. We aim to explore how long-term trends in depletion at major petroleum fields change the effective energetic productivity of petroleum extraction. Four EROI ratios are estimated for each field as follows: The net energy ratio (NER) and external energy ratio (EER) are calculated, each using two measures of energy outputs, (1) oil-only and (2) all energy outputs. In all cases, engineering estimates of inputs are used rather than expenditure-based estimates (including off-site indirect energy use and embodied energy). All fields display significant declines in NER over the modeling period driven by a combination of (1) reduced petroleum production and (2) increased energy expenditures on recovery methods such as the injection of water, steam, or gas. The fields studied had NER reductions ranging from 46% to 88% over the modeling periods (accounting for all energy outputs). The reasons for declines in EROI differ by field. Midway-Sunset experienced a 5-fold increase in steam injected per barrel of oil produced. In contrast, Prudhoe Bay has experienced nearly a 30-fold increase in amount of gas processed and reinjected per unit of oil produced. In contrast, EER estimates are subject to greater variability and uncertainty due to the relatively small magnitude of external energy investments in most cases.

Estimating decades-long trends in petroleum field energy return on investment (EROI) with an engineering-based model

PubMed Central

Tripathi, Vinay S.

2017-01-01

This paper estimates changes in the energy return on investment (EROI) for five large petroleum fields over time using the Oil Production Greenhouse Gas Emissions Estimator (OPGEE). The modeled fields include Cantarell (Mexico), Forties (U.K.), Midway-Sunset (U.S.), Prudhoe Bay (U.S.), and Wilmington (U.S.). Data on field properties and production/processing parameters were obtained from a combination of government and technical literature sources. Key areas of uncertainty include details of the oil and gas surface processing schemes. We aim to explore how long-term trends in depletion at major petroleum fields change the effective energetic productivity of petroleum extraction. Four EROI ratios are estimated for each field as follows: The net energy ratio (NER) and external energy ratio (EER) are calculated, each using two measures of energy outputs, (1) oil-only and (2) all energy outputs. In all cases, engineering estimates of inputs are used rather than expenditure-based estimates (including off-site indirect energy use and embodied energy). All fields display significant declines in NER over the modeling period driven by a combination of (1) reduced petroleum production and (2) increased energy expenditures on recovery methods such as the injection of water, steam, or gas. The fields studied had NER reductions ranging from 46% to 88% over the modeling periods (accounting for all energy outputs). The reasons for declines in EROI differ by field. Midway-Sunset experienced a 5-fold increase in steam injected per barrel of oil produced. In contrast, Prudhoe Bay has experienced nearly a 30-fold increase in amount of gas processed and reinjected per unit of oil produced. In contrast, EER estimates are subject to greater variability and uncertainty due to the relatively small magnitude of external energy investments in most cases. PMID:28178318

Extending the Diffuse Layer Model of Surface Acidity Behavior: III. Estimating Bound Site Activity Coefficients

EPA Science Inventory

Although detailed thermodynamic analyses of the 2-pK diffuse layer surface complexation model generally specify bound site activity coefficients for the purpose of accounting for those non-ideal excess free energies contributing to bound site electrochemical potentials, in applic...

Evapotranspiration and remote sensing

NASA Technical Reports Server (NTRS)

Schmugge, T. J.; Gurney, R.

1982-01-01

There are three things required for evapotranspiration to occur: (1) energy (580 cal/gm) for the change of phase of the water; (2) a source of the water, i.e., adequate soil moisture in the surface layer or in the root zone of the plant; and (3) a sink for the water, i.e., a moisture deficit in the air above the ground. Remote sensing can contribute information to the first two of these conditions by providing estimates of solar insolation, surface albedo, surface temperature, vegetation cover, and soil moisture content. In addition there have been attempts to estimate precipitation and shelter air temperature from remotely sensed data. The problem remains to develop methods for effectively using these sources of information to make large area estimates of evapotranspiration.

Estimation of soil hydraulic properties with microwave techniques

NASA Technical Reports Server (NTRS)

Oneill, P. E.; Gurney, R. J.; Camillo, P. J.

1985-01-01

Useful quantitative information about soil properties may be obtained by calibrating energy and moisture balance models with remotely sensed data. A soil physics model solves heat and moisture flux equations in the soil profile and is driven by the surface energy balance. Model generated surface temperature and soil moisture and temperature profiles are then used in a microwave emission model to predict the soil brightness temperature. The model hydraulic parameters are varied until the predicted temperatures agree with the remotely sensed values. This method is used to estimate values for saturated hydraulic conductivity, saturated matrix potential, and a soil texture parameter. The conductivity agreed well with a value measured with an infiltration ring and the other parameters agreed with values in the literature.

Comparison of prognostic and diagnostic surface flux modeling approaches over the Nile River Basin

USDA-ARS?s Scientific Manuscript database

Regional evapotranspiration (ET) can be estimated using diagnostic remote sensing models, generally based on principles of energy balance, or with spatially distributed prognostic models that simultaneously balance both the energy and water budgets over landscapes using predictive equations for land...

Application of an energy balance method for estimating evapotranspiration in cropping systems

USDA-ARS?s Scientific Manuscript database

Accurate quantification of evapotranspiration (ET, consumptive water use) from planting through harvest is critical for managing the limited water resources for crop irrigation. Our objective was to develop and apply an improved land-crop surface residual energy balance (EB) method for quantifying E...

Recent advances in electronic structure theory and their influence on the accuracy of ab initio potential energy surfaces

NASA Technical Reports Server (NTRS)

Bauschlicher, Charles W., Jr.; Langhoff, Stephen R.; Taylor, Peter R.

1989-01-01

Recent advances in electronic structure theory and the availability of high speed vector processors have substantially increased the accuracy of ab initio potential energy surfaces. The recently developed atomic natural orbital approach for basis set contraction has reduced both the basis set incompleteness and superposition errors in molecular calculations. Furthermore, full CI calculations can often be used to calibrate a CASSCF/MRCI approach that quantitatively accounts for the valence correlation energy. These computational advances also provide a vehicle for systematically improving the calculations and for estimating the residual error in the calculations. Calculations on selected diatomic and triatomic systems will be used to illustrate the accuracy that currently can be achieved for molecular systems. In particular, the F + H2 yields HF + H potential energy hypersurface is used to illustrate the impact of these computational advances on the calculation of potential energy surfaces.

Recent advances in electronic structure theory and their influence on the accuracy of ab initio potential energy surfaces

NASA Technical Reports Server (NTRS)

Bauschlicher, Charles W., Jr.; Langhoff, Stephen R.; Taylor, Peter R.

1988-01-01

Recent advances in electronic structure theory and the availability of high speed vector processors have substantially increased the accuracy of ab initio potential energy surfaces. The recently developed atomic natural orbital approach for basis set contraction has reduced both the basis set incompleteness and superposition errors in molecular calculations. Furthermore, full CI calculations can often be used to calibrate a CASSCF/MRCI approach that quantitatively accounts for the valence correlation energy. These computational advances also provide a vehicle for systematically improving the calculations and for estimating the residual error in the calculations. Calculations on selected diatomic and triatomic systems will be used to illustrate the accuracy that currently can be achieved for molecular systems. In particular, the F+H2 yields HF+H potential energy hypersurface is used to illustrate the impact of these computational advances on the calculation of potential energy surfaces.

Coordinated field study for CaPE: Analysis of energy and water budgets

NASA Technical Reports Server (NTRS)

Goodman, Steven J.; Duchon, Claude; Kanemasu, Edward T.; Smith, Eric A.; Crosson, William; Laymon, Chip; Luvall, Jeff

1993-01-01

The objectives of this hydrologic cycle study are to understand and model (1) surface energy and land-atmosphere water transfer processes, and (2) interactions between convective storms and surface energy fluxes. A surface energy budget measurement campaign was carried out by an interdisciplinary science team during the period July 8 - August 19, 1991 as part of the Convection and Precipitation/Electrification Experiment (CaPE) in the vicinity of Cape Canaveral, FL. Among the research themes associated with CaPE is the remote estimation of rainfall. Thus, in addition to surface radiation and energy budget measurements, surface mesonet, special radiosonde, precipitation, high-resolution satellite (SPOT) data, geosynchronous (GOES) and polar orbiting (DMSP SSM/I, OLS; NOAA AVHRR) satellite data, and high altitude airplane data (AMPR, MAMS, HIS) were collected. Initial quality control of the seven surface flux station data sets has begun. Ancillary data sets are being collected and assembled for analysis. Browsing of GOES and radar data has begun to classify days as disturbed/undisturbed to identify the larger scale forcing of the pre-convective environment, convection storms and precipitation. The science analysis plan has been finalized and tasks assigned to various investigators.

Cohesion and coordination effects on transition metal surface energies

NASA Astrophysics Data System (ADS)

Ruvireta, Judit; Vega, Lorena; Viñes, Francesc

2017-10-01

Here we explore the accuracy of Stefan equation and broken-bond model semiempirical approaches to obtain surface energies on transition metals. Cohesive factors are accounted for either via the vaporization enthalpies, as proposed in Stefan equation, or via cohesive energies, as employed in the broken-bond model. Coordination effects are considered including the saturation degree, as suggested in Stefan equation, employing Coordination Numbers (CN), or as the ratio of broken bonds, according to the bond-cutting model, considering as well the square root dependency of the bond strength on CN. Further, generalized coordination numbers CN bar are contemplated as well, exploring a total number of 12 semiempirical formulations on the three most densely packed surfaces of 3d, 4d, and 5d Transition Metals (TMs) displaying face-centered cubic (fcc), body-centered cubic (bcc), or hexagonal close-packed (hcp) crystallographic structures. Estimates are compared to available experimental surface energies obtained extrapolated to zero temperature. Results reveal that Stefan formula cohesive and coordination dependencies are only qualitative suited, but unadvised for quantitative discussion, as surface energies are highly overestimated, favoring in addition the stability of under-coordinated surfaces. Broken-bond cohesion and coordination dependencies are a suited basis for quantitative comparison, where square-root dependencies on CN to account for bond weakening are sensibly worse. An analysis using Wulff shaped averaged surface energies suggests the employment of broken-bond model using CN to gain surface energies for TMs, likely applicable to other metals.

On estimating total daily evapotranspiration from remote surface temperature measurements

NASA Technical Reports Server (NTRS)

Carlson, Toby N.; Buffum, Martha J.

1989-01-01

A method for calculating daily evapotranspiration from the daily surface energy budget using remotely sensed surface temperature and several meteorological variables is presented. Vaules of the coefficients are determined from simulations with a one-dimensional boundary layer model with vegetation cover. Model constants are obtained for vegetation and bare soil at two air temperature and wind speed levels over a range of surface roughness and wind speeds. A different means of estimating the daily evapotranspiration based on the time rate of increase of surface temperature during the morning is also considered. Both the equations using our model-derived constants and field measurements are evaluated, and a discussion of sources of error in the use of the formulation is given.

Reactions of Atmospheric Species with Clean and H, C, and O Implanted Species

DTIC Science & Technology

1989-07-27

energy shifts of the XFS core level spectra. Atomic concentration measurements were used to estimate the surface compositions. These results are...of the target surface, desorption of adsorbate atoms by hyperthermal physical/chemical interaction, and accumulation of a high surface concentration ...8217chemrical interactiosn, and accumulation of a high surface concentration of the pruijettile spCies. Vi1 film depsistion t-hcse studies investigate the

An overview of surface radiance and biology studies in FIFE

NASA Astrophysics Data System (ADS)

Blad, B. L.; Schimel, D. S.

1992-11-01

The use of satellite data to study and to understand energy and mass exchanges between the land surface and the atmosphere requires information about various biological processes and how various reflected or emitted spectral radiances are influenced by or manifested in these processes. To obtain such information, studies were conducted by the First ISLSCP Field Experiment (FIFE) surface radiances and biology (SRB) group using surface, near-surface, helicopter, and aircraft measurements. The two primary objectives of this group were to relate radiative fluxes to biophysical parameters and physiological processes and to assess how various management treatments affect important biological processes. This overview paper summarizes the results obtained by various SRB teams working in nine different areas: (1) measurement of bidirectional reflectance and estimation of hemispherical albedo; (2) evaluation of spatial and seasonal variability of spectral reflectance and vegetation indices; (3) determination of surface and radiational factors and their effects on vegetation indices and PAR relationships; (4) use of surface temperatures to estimate sensible heat flux; (5) controls over photosynthesis and respiration at small scales; (6) soil surface CO2 fluxes and grassland carbon budget; (7) landscape variations in controls over gas exchange and energy partitioning; (8) radiometric response of prairie to management and topography; and (9) determination of nitrogen gas exchanges in a tallgrass prairie.

Thermal Properties and Energy Fluxes in Pre-monsoon Season of 2016 at the Ponkar Debris-Covered Glacier, Manang, Nepal Himalaya

NASA Astrophysics Data System (ADS)

Chand, M. B.; Kayastha, R. B.; Armstrong, R. L.

2016-12-01

Himalayan glaciers are characterized by the presence of extensive debris cover in ablation areas. It is essential to understand the thermal properties and assess the effect of debris in glacier ice melt rate in debris-covered glaciers. Meteorological conditions are recorded on the lower ablation zone of the debris-covered Ponkar Glacier, Bhimthang, Manang, Nepal during pre-monsoon season of 2016. Debris temperature at different depths is monitored for winter and pre-monsoon season to estimate the effective heat conduction. Similarly, melt under the debris is also measured for pre-monsoon season. The incoming and outgoing shortwave radiations are measured at 2 m above the surface and other variables including air temperature, humidity, wind speed, and precipitation are used to estimate surface energy balance. Energy flux is dominated by net shortwave radiation as the foremost source of melting, where contribution of net longwave radiation, sensible, latent, and conductive heat flux is low. The daily average temperature gradients of the debris layer from surface to 30 cm below for winter and pre-monsoon seasons are 0.04 oC cm-1 and 0.23 oC cm-1, respectively. Debris thermal conductivities are 0.30 W m-1 K-1 and 1.69 W m-1 K-1 for the winter and pre-monsoon season, respectively. The higher value of conductivity during pre-monsoon season is due to the higher air temperature and increased precipitation compared to the winter months. The daily mean measured ice melt under a debris layer of 11-20 cm ranges from 0.6 to 1.1 cm. Estimation of melt at a few points can be used to estimate the general melting pattern for the glacier surface, which can be improved by using the spatial distribution of debris thickness and surface temperature.

Enhancing the Simplified Surface Energy Balance (SSEB) Approach for Estimating Landscape ET: Validation with the METRIC model

USGS Publications Warehouse

Senay, Gabriel B.; Budde, Michael E.; Verdin, James P.

2011-01-01

Evapotranspiration (ET) can be derived from satellite data using surface energy balance principles. METRIC (Mapping EvapoTranspiration at high Resolution with Internalized Calibration) is one of the most widely used models available in the literature to estimate ET from satellite imagery. The Simplified Surface Energy Balance (SSEB) model is much easier and less expensive to implement. The main purpose of this research was to present an enhanced version of the Simplified Surface Energy Balance (SSEB) model and to evaluate its performance using the established METRIC model. In this study, SSEB and METRIC ET fractions were compared using 7 Landsat images acquired for south central Idaho during the 2003 growing season. The enhanced SSEB model compared well with the METRIC model output exhibiting an r2 improvement from 0.83 to 0.90 in less complex topography (elevation less than 2000 m) and with an improvement of r2 from 0.27 to 0.38 in more complex (mountain) areas with elevation greater than 2000 m. Independent evaluation showed that both models exhibited higher variation in complex topographic regions, although more with SSEB than with METRIC. The higher ET fraction variation in the complex mountainous regions highlighted the difficulty of capturing the radiation and heat transfer physics on steep slopes having variable aspect with the simple index model, and the need to conduct more research. However, the temporal consistency of the results suggests that the SSEB model can be used on a wide range of elevation (more successfully up 2000 m) to detect anomalies in space and time for water resources management and monitoring such as for drought early warning systems in data scarce regions. SSEB has a potential for operational agro-hydrologic applications to estimate ET with inputs of surface temperature, NDVI, DEM and reference ET.

Enhancing the Simplified Surface Energy Balance (SSEB) approach for estimating landscape ET: Validation with the METRIC model

USGS Publications Warehouse

Senay, G.B.; Budde, M.E.; Verdin, J.P.

2011-01-01

Evapotranspiration (ET) can be derived from satellite data using surface energy balance principles. METRIC (Mapping EvapoTranspiration at high Resolution with Internalized Calibration) is one of the most widely used models available in the literature to estimate ET from satellite imagery. The Simplified Surface Energy Balance (SSEB) model is much easier and less expensive to implement. The main purpose of this research was to present an enhanced version of the Simplified Surface Energy Balance (SSEB) model and to evaluate its performance using the established METRIC model. In this study, SSEB and METRIC ET fractions were compared using 7 Landsat images acquired for south central Idaho during the 2003 growing season. The enhanced SSEB model compared well with the METRIC model output exhibiting an r2 improvement from 0.83 to 0.90 in less complex topography (elevation less than 2000m) and with an improvement of r2 from 0.27 to 0.38 in more complex (mountain) areas with elevation greater than 2000m. Independent evaluation showed that both models exhibited higher variation in complex topographic regions, although more with SSEB than with METRIC. The higher ET fraction variation in the complex mountainous regions highlighted the difficulty of capturing the radiation and heat transfer physics on steep slopes having variable aspect with the simple index model, and the need to conduct more research. However, the temporal consistency of the results suggests that the SSEB model can be used on a wide range of elevation (more successfully up 2000m) to detect anomalies in space and time for water resources management and monitoring such as for drought early warning systems in data scarce regions. SSEB has a potential for operational agro-hydrologic applications to estimate ET with inputs of surface temperature, NDVI, DEM and reference ET. ?? 2010.

Estimation of water and energy fluxes over complex landscapes. Two Source Energy Balance modelling using very high resolution thermal and optical imagery in vineyards and wooded rangelands

USDA-ARS?s Scientific Manuscript database

Modelling the water and energy balance at the land surface is a crucial task for many applications related to crop production, water resources management, climate change studies, weather forecasting, and natural hazards assessment. To improve the modelling of evapotranspiration (ET) over structurall...

Measuring surface energy and evapotranspiration across Caribbean mangrove forests

NASA Astrophysics Data System (ADS)

Lagomasino, D.; Fatoyinbo, T. E.; Price, R.

2014-12-01

Coastal mangroves lose large amounts of water through evapotranspiration (ET) that can be equivalent to the amount of annual rainfall in certain years. Satellite remote sensing has been used to estimate surface energy and ET variability in many forested ecosystems, yet has been widely overlooked in mangrove forests. Using a combination of long-term datasets (30-year) acquired from the NASA Landsat 5 and 7 satellite databases, the present study investigated ET and surface energy balance variability between two mangrove forest sites in the Caribbean: 1) Everglades National Park (ENP; Florida, USA) and 2) Sian Ka'an Biosphere Reserve (SKBR; Quintana Roo, Mexico). A satellite-derived surface energy balance model was used to estimate ET in tall and scrub mangroves environments at ENP and SKBR. Results identified significant differences in soil heat flux measurements and ET between the tall and scrub mangrove environments. Scrub mangroves exhibited the highest soil heat flux coincident with the lowest biophysical indices (i.e., Fractional Vegetation Cover, Normalized Difference Vegetation Index, and Soil-Adjusted Vegetation Index) and ET rates. Mangrove damage and mortality was observed on the satellite images following strong tropical storms and associated with anthropogenic modifications and resulted in low values in spectral vegetation indices, higher soil heat flux, and higher ET. Recovery of the spectral characteristics, soil heat flux and ET was within 1-2 years following hurricane disturbance while, degradation caused by human disturbance persisted for many years. Remotely sensed ET of mangrove forests can provide estimates over a few decades and provide us with some understanding of how these environments respond to disturbances to the landscape in periods where no ground data exists or in locations that are difficult to access. Moreover, relationships between energy and water balance components developed for the coastal mangroves of Florida and Mexico could be extrapolated to other mangroves systems in the Caribbean to measure changes caused by natural events and human modifications.

METRIC model for the estimation and mapping of evapotranspiration in a super intensive olive orchard in Southern Portugal

NASA Astrophysics Data System (ADS)

Pôças, Isabel; Nogueira, António; Paço, Teresa A.; Sousa, Adélia; Valente, Fernanda; Silvestre, José; Andrade, José A.; Santos, Francisco L.; Pereira, Luís S.; Allen, Richard G.

2013-04-01

Satellite-based surface energy balance models have been successfully applied to estimate and map evapotranspiration (ET). The METRICtm model, Mapping EvapoTranspiration at high Resolution using Internalized Calibration, is one of such models. METRIC has been widely used over an extensive range of vegetation types and applications, mostly focusing annual crops. In the current study, the single-layer-blended METRIC model was applied to Landsat5 TM and Landsat7 ETM+ images to produce estimates of evapotranspiration (ET) in a super intensive olive orchard in Southern Portugal. In sparse woody canopies as in olive orchards, some adjustments in METRIC application related to the estimation of vegetation temperature and of momentum roughness length and sensible heat flux (H) for tall vegetation must be considered. To minimize biases in H estimates due to uncertainties in the definition of momentum roughness length, the Perrier function based on leaf area index and tree canopy architecture, associated with an adjusted estimation of crop height, was used to obtain momentum roughness length estimates. Additionally, to minimize the biases in surface temperature simulations, due to soil and shadow effects, the computation of radiometric temperature considered a three-source condition, where Ts=fcTc+fshadowTshadow+fsunlitTsunlit. As such, the surface temperature (Ts), derived from the thermal band of the Landsat images, integrates the temperature of the canopy (Tc), the temperature of the shaded ground surface (Tshadow), and the temperature of the sunlit ground surface (Tsunlit), according to the relative fraction of vegetation (fc), shadow (fshadow) and sunlit (fsunlit) ground surface, respectively. As the sunlit canopies are the primary source of energy exchange, the effective temperature for the canopy was estimated by solving the three-source condition equation for Tc. To evaluate METRIC performance to estimate ET over the olive grove, several parameters derived from the algorithm were tested against data collected in the field, including eddy covariance ET, surface temperature over the canopy and soil temperature in shaded and sunlit conditions. Additionally, the results were also compared with results published in the literature. The information obtained so far revealed very interesting perspectives for the use of METRIC in the estimation and mapping of ET in super intensive olive orchards. Thereby, this approach might constitute a useful tool towards the improvement of the efficiency of irrigation water management in this crop. The study described is still under way, and thus further applications of METRIC algorithm to a larger number of images and to olive groves with different tree density are planned.

Rayleigh-wave dispersive energy imaging and mode separating by high-resolution linear Radon transform

USGS Publications Warehouse

Luo, Y.; Xu, Y.; Liu, Q.; Xia, J.

2008-01-01

In recent years, multichannel analysis of surface waves (MASW) has been increasingly used for obtaining vertical shear-wave velocity profiles within near-surface materials. MASW uses a multichannel recording approach to capture the time-variant, full-seismic wavefield where dispersive surface waves can be used to estimate near-surface S-wave velocity. The technique consists of (1) acquisition of broadband, high-frequency ground roll using a multichannel recording system; (2) efficient and accurate algorithms that allow the extraction and analysis of 1D Rayleigh-wave dispersion curves; (3) stable and efficient inversion algorithms for estimating S-wave velocity profiles; and (4) construction of the 2D S-wave velocity field map.

Global Surface Net-Radiation at 5 km from MODIS Terra

DOE Office of Scientific and Technical Information (OSTI.GOV)

Verma, Manish; Fisher, Joshua; Mallick, Kaniska

Reliable and fine resolution estimates of surface net-radiation are required for estimating latent and sensible heat fluxes between the land surface and the atmosphere. However, currently, fine resolution estimates of net-radiation are not available and consequently it is challenging to develop multi-year estimates of evapotranspiration at scales that can capture land surface heterogeneity and are relevant for policy and decision-making. We developed and evaluated a global net-radiation product at 5 km and 8-day resolution by combining mutually consistent atmosphere and land data from the Moderate Resolution Imaging Spectroradiometer (MODIS) on board Terra. Comparison with net-radiation measurements from 154 globally distributedmore » sites (414 site-years) from the FLUXNET and Surface Radiation budget network (SURFRAD) showed that the net-radiation product agreed well with measurements across seasons and climate types in the extratropics (Wilmott's index ranged from 0.74 for boreal to 0.63 for Mediterranean sites). Mean absolute deviation between the MODIS and measured net-radiation ranged from 38.0 ± 1.8 W.m -2 in boreal to 72.0 ± 4.1 W.m -2 in the tropical climates. The mean bias was small and constituted only 11%, 0.7%, 8.4%, 4.2%, 13.3%, and 5.4% of the mean absolute error in daytime net-radiation in boreal, Mediterranean, temperate-continental, temperate, semi-arid, and tropical climate, respectively. To assess the accuracy of the broader spatiotemporal patterns, we upscaled error-quantified MODIS net-radiation and compared it with the net-radiation estimates from the coarse spatial (1° x 1°) but high temporal resolution gridded net-radiation product from the Clouds and Earth's Radiant Energy System (CERES). Our estimates agreed closely with the net-radiation estimates from the CERES. Difference between the two was less than 10W.m -2 in 94% of the total land area. MODIS net-radiation product will be a valuable resource for the science community studying turbulent fluxes and energy budget at the Earth's surface.« less

Global Surface Net-Radiation at 5 km from MODIS Terra

DOE PAGES

Verma, Manish; Fisher, Joshua; Mallick, Kaniska; ...

2016-09-06

Reliable and fine resolution estimates of surface net-radiation are required for estimating latent and sensible heat fluxes between the land surface and the atmosphere. However, currently, fine resolution estimates of net-radiation are not available and consequently it is challenging to develop multi-year estimates of evapotranspiration at scales that can capture land surface heterogeneity and are relevant for policy and decision-making. We developed and evaluated a global net-radiation product at 5 km and 8-day resolution by combining mutually consistent atmosphere and land data from the Moderate Resolution Imaging Spectroradiometer (MODIS) on board Terra. Comparison with net-radiation measurements from 154 globally distributedmore » sites (414 site-years) from the FLUXNET and Surface Radiation budget network (SURFRAD) showed that the net-radiation product agreed well with measurements across seasons and climate types in the extratropics (Wilmott's index ranged from 0.74 for boreal to 0.63 for Mediterranean sites). Mean absolute deviation between the MODIS and measured net-radiation ranged from 38.0 ± 1.8 W.m -2 in boreal to 72.0 ± 4.1 W.m -2 in the tropical climates. The mean bias was small and constituted only 11%, 0.7%, 8.4%, 4.2%, 13.3%, and 5.4% of the mean absolute error in daytime net-radiation in boreal, Mediterranean, temperate-continental, temperate, semi-arid, and tropical climate, respectively. To assess the accuracy of the broader spatiotemporal patterns, we upscaled error-quantified MODIS net-radiation and compared it with the net-radiation estimates from the coarse spatial (1° x 1°) but high temporal resolution gridded net-radiation product from the Clouds and Earth's Radiant Energy System (CERES). Our estimates agreed closely with the net-radiation estimates from the CERES. Difference between the two was less than 10W.m -2 in 94% of the total land area. MODIS net-radiation product will be a valuable resource for the science community studying turbulent fluxes and energy budget at the Earth's surface.« less

A potential-energy surface study of the 2A1 and low-lying dissociative states of the methoxy radical

NASA Technical Reports Server (NTRS)

Jackels, C. F.

1985-01-01

Accurate, ab initio quantum chemical techniques are applied in the present study of low lying bound and dissociative states of the methoxy radical at C3nu conformations, using a double zeta quality basis set that is augmented with polarization and diffuse functions. Excitation energy estimates are obtained for vertical excitation, vertical deexcitation, and system origin. The rate of methoxy photolysis is estimated to be too small to warrant its inclusion in atmospheric models.

Thermocouple frequency response compensation leads to convergence of the surface renewal alpha calibration

USDA-ARS?s Scientific Manuscript database

Sensible heat flux measurements are used in conjunction with net radiation and ground heat flux measurements to determine the latent heat flux as the energy balance residual. Surface renewal is a relatively inexpensive technique for sensible heat flux estimation because it requires only a fast-resp...

Water, Energy, and Carbon with Artificial Neural Networks (WECANN): A statistically-based estimate of global surface turbulent fluxes and gross primary productivity using solar-induced fluorescence.

PubMed

Alemohammad, Seyed Hamed; Fang, Bin; Konings, Alexandra G; Aires, Filipe; Green, Julia K; Kolassa, Jana; Miralles, Diego; Prigent, Catherine; Gentine, Pierre

2017-01-01

A new global estimate of surface turbulent fluxes, latent heat flux (LE) and sensible heat flux (H), and gross primary production (GPP) is developed using a machine learning approach informed by novel remotely sensed Solar-Induced Fluorescence (SIF) and other radiative and meteorological variables. This is the first study to jointly retrieve LE, H and GPP using SIF observations. The approach uses an artificial neural network (ANN) with a target dataset generated from three independent data sources, weighted based on triple collocation (TC) algorithm. The new retrieval, named Water, Energy, and Carbon with Artificial Neural Networks (WECANN), provides estimates of LE, H and GPP from 2007 to 2015 at 1° × 1° spatial resolution and on monthly time resolution. The quality of ANN training is assessed using the target data, and the WECANN retrievals are evaluated using eddy covariance tower estimates from FLUXNET network across various climates and conditions. When compared to eddy covariance estimates, WECANN typically outperforms other products, particularly for sensible and latent heat fluxes. Analysing WECANN retrievals across three extreme drought and heatwave events demonstrates the capability of the retrievals in capturing the extent of these events. Uncertainty estimates of the retrievals are analysed and the inter-annual variability in average global and regional fluxes show the impact of distinct climatic events - such as the 2015 El Niño - on surface turbulent fluxes and GPP.

Water, Energy, and Carbon with Artificial Neural Networks (WECANN): a statistically based estimate of global surface turbulent fluxes and gross primary productivity using solar-induced fluorescence

NASA Astrophysics Data System (ADS)

Hamed Alemohammad, Seyed; Fang, Bin; Konings, Alexandra G.; Aires, Filipe; Green, Julia K.; Kolassa, Jana; Miralles, Diego; Prigent, Catherine; Gentine, Pierre

2017-09-01

A new global estimate of surface turbulent fluxes, latent heat flux (LE) and sensible heat flux (H), and gross primary production (GPP) is developed using a machine learning approach informed by novel remotely sensed solar-induced fluorescence (SIF) and other radiative and meteorological variables. This is the first study to jointly retrieve LE, H, and GPP using SIF observations. The approach uses an artificial neural network (ANN) with a target dataset generated from three independent data sources, weighted based on a triple collocation (TC) algorithm. The new retrieval, named Water, Energy, and Carbon with Artificial Neural Networks (WECANN), provides estimates of LE, H, and GPP from 2007 to 2015 at 1° × 1° spatial resolution and at monthly time resolution. The quality of ANN training is assessed using the target data, and the WECANN retrievals are evaluated using eddy covariance tower estimates from the FLUXNET network across various climates and conditions. When compared to eddy covariance estimates, WECANN typically outperforms other products, particularly for sensible and latent heat fluxes. Analyzing WECANN retrievals across three extreme drought and heat wave events demonstrates the capability of the retrievals to capture the extent of these events. Uncertainty estimates of the retrievals are analyzed and the interannual variability in average global and regional fluxes shows the impact of distinct climatic events - such as the 2015 El Niño - on surface turbulent fluxes and GPP.

An Analysis of Inter-annual Variability and Uncertainty of Continental Surface Heat Fluxes

NASA Astrophysics Data System (ADS)

Huang, S. Y.; Deng, Y.; Wang, J.

2016-12-01

The inter-annual variability and the corresponding uncertainty of land surface heat fluxes during the first decade of the 21st century are re-evaluated at continental scale based on the heat fluxes estimated by the maximum entropy production (MEP) model. The MEP model predicted heat fluxes are constrained by surface radiation fluxes, automatically satisfy surface energy balance, and are independent of temperature/moisture gradient, wind speed, and roughness lengths. The surface radiation fluxes and temperature data from Clouds and the Earth's Radiant Energy System and the surface specific humidity data from Modern-Era Retrospective analysis for Research and Applications were used to reproduce the global surface heat fluxes with land-cover data from the NASA Energy and Water cycle Study (NEWS). Our analysis shows that the annual means of continental latent heat fluxes have increasing trends associated with increasing trends in surface net radiative fluxes. The sensible heat fluxes also have increasing trends over most continents except for South America. Ground heat fluxes have little trends. The continental-scale analysis of the MEP fluxes are compared with other existing global surface fluxes data products and the implications of the results for inter-annual to decadal variability of regional surface energy budget are discussed.

Infrasound Observation of the Apparent North Korean Nuclear Test of 25 May 2009

NASA Astrophysics Data System (ADS)

Jeon, J.; Che, I.; Kim, T.; Lee, H.

2009-12-01

On 25 May 2009, a seismic event (mb 4.6) was recorded from a source in northeastern North Korea, close to the location of a previous seismic event on 9 October 2006. Both events have been declared to be nuclear tests. Five seismo-acoustic arrays in South Korea recorded epicentral infrasonic signals for the more recent test following the strong seismic waves from the explosion. This study describes the characteristics of the nuclear test-generated infrasound signals observed at infrasound arrays located from 304 to 528 km from the source. The signals were characterized by stratospheric returns with amplitudes from 0.16 to 0.35 microbar and dominant frequencies between 1.0 and 4.3 Hz. Celerities determined for the arrivals suggest that most of the infrasonic energy travelled as a stratospheric phase. The inferred infrasonic location was offset about 15.7 km from the reference seismic location. On the basis of observed amplitudes of the stratospheric phases and corrections based on prevailing winds, the epicentral infrasonic energy was estimated to be equivalent to that expected from about 2.2 ton surface detonation of conventional explosives. We conclude that this small energy estimate is related to the partitioning of the contained explosive energy resulting from the interaction of strong ground motion at the surface with the atmosphere rather than the direct transfer of explosion energy to the air. This relatively small energy ratio between the infrasonic energy and the seismic energy could be used to distinguish the event from a common surface explosion.

Distributions of phytoplankton carbohydrate, protein and lipid in the world oceans from satellite ocean colour.

PubMed

Roy, Shovonlal

2018-06-01

Energy value of phytoplankton regulates the growth of higher trophic species, affecting the tropic balance and sustainability of marine food webs. Therefore, developing our capability to estimate and monitor, on a global scale, the concentrations of macromolecules that determine phytoplankton energy value, would be invaluable. Reported here are the first estimates of carbohydrate, protein, lipid, and overall energy value of phytoplankton in the world oceans, using ocean-colour data from satellites. The estimates are based on a novel bio-optical method that utilises satellite-derived bio-optical fingerprints of living phytoplankton combined with allometric relationships between phytoplankton cells and cellular macromolecular contents. The annually averaged phytoplankton energy value, per cubic metre of sub-surface ocean, varied from less than 0.1 kJ in subtropical gyres, to 0.5-1.0 kJ in parts of the equatorial, northern and southern latitudes, and rising to >10 kJ in certain coastal and optically complex waters. The annually averaged global stocks of carbohydrate, protein and lipid were 0.044, 0.17 and 0.108 gigatonnes, respectively, with monthly stocks highest in September and lowest in June, over 1997-2013. The fractional contributions of phytoplankton size classes e.g., picoplankton, nanoplankton and microplankton to surface concentrations and global stocks of macromolecules varied considerably across marine biomes classified as Longhurst provinces. Among these provinces, the highest annually averaged surface concentrations of carbohydrate, protein, and lipid were in North-East Atlantic Coastal Shelves, whereas, the lowest concentration of carbohydrate or lipid were in North Atlantic Tropical Gyral, and that of protein was in North Pacific Subtropical Gyre West. The regional accuracy of the estimates and their sensitivity to satellite inputs are quantified from the bio-optical model, which show promise for possible operational monitoring of phytoplankton energy value from satellite ocean colour. Adequate in situ measurements of macromolecules and improved retrievals of inherent optical properties from high-resolution satellite images, would be required to validate these estimates at local sites, and to further improve their accuracy in the world oceans.

Estimating raindrop kinetic energy: evaluation of a low-cost method

USDA-ARS?s Scientific Manuscript database

The Loess Plateau of China is regarded as the most intensively eroded region in the world and soil erosion caused by raindrop action is a common occurrence on agricultural land within this region. Therefore, understanding the influence of rainfall energy on the soil surface is needed for modeling pu...

Comparison and Analysis of Energy Performance of Baseline and Enhanced Temporary Army Shelters

DTIC Science & Technology

2015-09-01

modeling .................................................................................................... 37 4.4 Predicted vs. field- measured data...with remote access capability ......................... 35 4-2 Direct normal solar radiation measured at weather station and estimated with the... Measured global horizontal radiation and EnergyPlus calculated incident solar radiation on a horizontal surface

Assessing the Regional/Diurnal Bias between Satellite Retrievals and GEOS-5/MERRA Model Estimates of Land Surface Temperature

NASA Astrophysics Data System (ADS)

Scarino, B. R.; Smith, W. L., Jr.; Minnis, P.; Bedka, K. M.

2017-12-01

Atmospheric models rely on high-accuracy, high-resolution initial radiometric and surface conditions for better short-term meteorological forecasts, as well as improved evaluation of global climate models. Continuous remote sensing of the Earth's energy budget, as conducted by the Clouds and Earth's Radiant Energy System (CERES) project, allows for near-realtime evaluation of cloud and surface radiation properties. It is unfortunately common for there to be bias between atmospheric/surface radiation models and Earth-observations. For example, satellite-observed surface skin temperature (Ts), an important parameter for characterizing the energy exchange at the ground/water-atmosphere interface, can be biased due to atmospheric adjustment assumptions and anisotropy effects. Similarly, models are potentially biased by errors in initial conditions and regional forcing assumptions, which can be mitigated through assimilation with true measurements. As such, when frequent, broad-coverage, and accurate retrievals of satellite Ts are available, important insights into model estimates of Ts can be gained. The Satellite ClOud and Radiation Property retrieval System (SatCORPS) employs a single-channel thermal-infrared method to produce anisotropy-corrected Ts over clear-sky land and ocean surfaces from data taken by geostationary Earth orbit (GEO) satellite imagers. Regional and diurnal changes in model land surface temperature (LST) performance can be assessed owing to the somewhat continuous measurements of the LST offered by GEO satellites - measurements which are accurate to within 0.2 K. A seasonal, hourly comparison of satellite-observed LST with the NASA Goddard Earth Observing System Version 5 (GEOS-5) and the Modern-Era Retrospective Analysis for Research and Applications (MERRA) LST estimates is conducted to reveal regional and diurnal biases. This assessment is an important first step for evaluating the effectiveness of Ts assimilation, as well for determining the impact anisotropy correction has on observation - model bias, and is of critical importance for CERES.

Estimation of Regional Net CO2 Exchange over the Southern Great Plains

NASA Astrophysics Data System (ADS)

Biraud, S. C.; Riley, W. J.; Fischer, M. L.; Torn, M. S.; Cooley, H. S.

2004-12-01

Estimating spatially distributed ecosystem CO2 exchange is an important component of the North American Carbon Program. We describe here a methodology to estimate Net Ecosystem Exchange (NEE) over the Southern Great Plains, using: (1) data from the Department Of Energy's Atmospheric Radiation Measurement (ARM) sites in Oklahoma and Kansas; (2) meteorological forcing data from the Mesonet facilities; (3) soil and vegetation types from 1 km resolution USGS databases; (4) vegetation status (e.g., LAI) from 1 km satellite measurements of surface reflectance (MODIS); (5) a tested land-surface model; and (6) a coupled land-surface and meteorological model (MM5/ISOLSM). This framework allows us to simulate regional surface fluxes in addition to ABL and free troposphere concentrations of CO2 at a continental scale with fine-scale nested grids centered on the ARM central facility. We use the offline land-surface and coupled models to estimate regional NEE, and compare predictions to measurements from the 9 Extended Facility sites with eddy correlation measurements. Site level comparisons to portable ECOR measurements in several crop types are also presented. Our approach also allows us to extend bottom-up estimates to periods and areas where meteorological forcing data are unavailable.

An investigation of current and future satellite and in-situ data for the remote sensing of the land surface energy balance

NASA Technical Reports Server (NTRS)

Diak, George R.

1994-01-01

This final report from the University of Wisconsin-Madison Cooperative Institute for Meteorological Satellite Studies (CIMSS) summarizes a research program designed to improve our knowledge of the water and energy balance of the land surface through the application of remote sensing and in-situ data sources. The remote sensing data source investigations to be detailed involve surface radiometric ('skin') temperatures and also high-spectral-resolution infrared radiance data from atmospheric sounding instruments projected to be available at the end of the decade, which have shown promising results for evaluating the land-surface water and energy budget. The in-situ data types to be discussed are measurements of the temporal changes of the height of the planetary boundary layer and measurements of air temperature within the planetary boundary layer. Physical models of the land surface, planetary boundary layer and free atmosphere have been used as important tools to interpret the in-situ and remote sensing signals of the surface energy balance. A prototype 'optimal' system for combining multiple data sources into a three-dimensional estimate of the surface energy balance was developed and first results from this system will be detailed. Potential new sources of data for this system and suggested continuation research will also be discussed.

Thermodynamics of surface defects at the aspirin/water interface

NASA Astrophysics Data System (ADS)

Schneider, Julian; Zheng, Chen; Reuter, Karsten

2014-09-01

We present a simulation scheme to calculate defect formation free energies at a molecular crystal/water interface based on force-field molecular dynamics simulations. To this end, we adopt and modify existing approaches to calculate binding free energies of biological ligand/receptor complexes to be applicable to common surface defects, such as step edges and kink sites. We obtain statistically accurate and reliable free energy values for the aspirin/water interface, which can be applied to estimate the distribution of defects using well-established thermodynamic relations. As a show case we calculate the free energy upon dissolving molecules from kink sites at the interface. This free energy can be related to the solubility concentration and we obtain solubility values in excellent agreement with experimental results.

Hierarchical Protein Free Energy Landscapes from Variationally Enhanced Sampling.

PubMed

Shaffer, Patrick; Valsson, Omar; Parrinello, Michele

2016-12-13

In recent work, we demonstrated that it is possible to obtain approximate representations of high-dimensional free energy surfaces with variationally enhanced sampling ( Shaffer, P.; Valsson, O.; Parrinello, M. Proc. Natl. Acad. Sci. , 2016 , 113 , 17 ). The high-dimensional spaces considered in that work were the set of backbone dihedral angles of a small peptide, Chignolin, and the high-dimensional free energy surface was approximated as the sum of many two-dimensional terms plus an additional term which represents an initial estimate. In this paper, we build on that work and demonstrate that we can calculate high-dimensional free energy surfaces of very high accuracy by incorporating additional terms. The additional terms apply to a set of collective variables which are more coarse than the base set of collective variables. In this way, it is possible to build hierarchical free energy surfaces, which are composed of terms that act on different length scales. We test the accuracy of these free energy landscapes for the proteins Chignolin and Trp-cage by constructing simple coarse-grained models and comparing results from the coarse-grained model to results from atomistic simulations. The approach described in this paper is ideally suited for problems in which the free energy surface has important features on different length scales or in which there is some natural hierarchy.

Estimation of Surface Air Temperature from MODIS 1km Resolution Land Surface Temperature Over Northern China

NASA Technical Reports Server (NTRS)

Shen, Suhung; Leptoukh, Gregory G.; Gerasimov, Irina

2010-01-01

Surface air temperature is a critical variable to describe the energy and water cycle of the Earth-atmosphere system and is a key input element for hydrology and land surface models. It is a very important variable in agricultural applications and climate change studies. This is a preliminary study to examine statistical relationships between ground meteorological station measured surface daily maximum/minimum air temperature and satellite remotely sensed land surface temperature from MODIS over the dry and semiarid regions of northern China. Studies were conducted for both MODIS-Terra and MODIS-Aqua by using year 2009 data. Results indicate that the relationships between surface air temperature and remotely sensed land surface temperature are statistically significant. The relationships between the maximum air temperature and daytime land surface temperature depends significantly on land surface types and vegetation index, but the minimum air temperature and nighttime land surface temperature has little dependence on the surface conditions. Based on linear regression relationship between surface air temperature and MODIS land surface temperature, surface maximum and minimum air temperatures are estimated from 1km MODIS land surface temperature under clear sky conditions. The statistical errors (sigma) of the estimated daily maximum (minimum) air temperature is about 3.8 C(3.7 C).

Improving winter leaf area index estimation in coniferous forests and its significance in estimating the land surface albedo

NASA Astrophysics Data System (ADS)

Wang, Rong; Chen, Jing M.; Pavlic, Goran; Arain, Altaf

2016-09-01

Winter leaf area index (LAI) of evergreen coniferous forests exerts strong control on the interception of snow, snowmelt and energy balance. Simulation of winter LAI and associated winter processes in land surface models is challenging. Retrieving winter LAI from remote sensing data is difficult due to cloud contamination, poor illumination, lower solar elevation and higher radiation reflection by snow background. Underestimated winter LAI in evergreen coniferous forests is one of the major issues limiting the application of current remote sensing LAI products. It has not been fully addressed in past studies in the literature. In this study, we used needle lifespan to correct winter LAI in a remote sensing product developed by the University of Toronto. For the validation purpose, the corrected winter LAI was then used to calculate land surface albedo at five FLUXNET coniferous forests in Canada. The RMSE and bias values for estimated albedo were 0.05 and 0.011, respectively, for all sites. The albedo map over coniferous forests across Canada produced with corrected winter LAI showed much better agreement with the GLASS (Global LAnd Surface Satellites) albedo product than the one produced with uncorrected winter LAI. The results revealed that the corrected winter LAI yielded much greater accuracy in simulating land surface albedo, making the new LAI product an improvement over the original one. Our study will help to increase the usability of remote sensing LAI products in land surface energy budget modeling.

A New Maximum Likelihood Approach for Free Energy Profile Construction from Molecular Simulations

PubMed Central

Lee, Tai-Sung; Radak, Brian K.; Pabis, Anna; York, Darrin M.

2013-01-01

A novel variational method for construction of free energy profiles from molecular simulation data is presented. The variational free energy profile (VFEP) method uses the maximum likelihood principle applied to the global free energy profile based on the entire set of simulation data (e.g from multiple biased simulations) that spans the free energy surface. The new method addresses common obstacles in two major problems usually observed in traditional methods for estimating free energy surfaces: the need for overlap in the re-weighting procedure and the problem of data representation. Test cases demonstrate that VFEP outperforms other methods in terms of the amount and sparsity of the data needed to construct the overall free energy profiles. For typical chemical reactions, only ~5 windows and ~20-35 independent data points per window are sufficient to obtain an overall qualitatively correct free energy profile with sampling errors an order of magnitude smaller than the free energy barrier. The proposed approach thus provides a feasible mechanism to quickly construct the global free energy profile and identify free energy barriers and basins in free energy simulations via a robust, variational procedure that determines an analytic representation of the free energy profile without the requirement of numerically unstable histograms or binning procedures. It can serve as a new framework for biased simulations and is suitable to be used together with other methods to tackle with the free energy estimation problem. PMID:23457427

Solar Radiation Estimated Through Mesoscale Atmospheric Modeling over Northeast Brazil

NASA Astrophysics Data System (ADS)

de Menezes Neto, Otacilio Leandro; Costa, Alexandre Araújo; Ramalho, Fernando Pinto; de Maria, Paulo Henrique Santiago

2009-03-01

The use of renewable energy sources, like solar, wind and biomass is rapidly increasing in recent years, with solar radiation as a particularly abundant energy source over Northeast Brazil. A proper quantitative knowledge of the incoming solar radiation is of great importance for energy planning in Brazil, serving as basis for developing future projects of photovoltaic power plants and solar energy exploitation. This work presents a methodology for mapping the incoming solar radiation at ground level for Northeast Brazil, using a mesoscale atmospheric model (Regional Atmospheric Modeling System—RAMS), calibrated and validated using data from the network of automatic surface stations from the State Foundation for Meteorology and Water Resources from Ceará (Fundação Cearense de Meteorologia e Recursos Hídricos- FUNCEME). The results showed that the model exhibits systematic errors, overestimating surface radiation, but that, after the proper statistical corrections, using a relationship between the model-predicted cloud fraction, the ground-level observed solar radiation and the incoming solar radiation estimated at the top of the atmosphere, a correlation of 0.92 with a confidence interval of 13.5 W/m2 is found for monthly data. Using this methodology, we found an estimate for annual average incoming solar radiation over Ceará of 215 W/m2 (maximum in October: 260 W/m2).

Energy functions for regularization algorithms

NASA Technical Reports Server (NTRS)

Delingette, H.; Hebert, M.; Ikeuchi, K.

1991-01-01

Regularization techniques are widely used for inverse problem solving in computer vision such as surface reconstruction, edge detection, or optical flow estimation. Energy functions used for regularization algorithms measure how smooth a curve or surface is, and to render acceptable solutions these energies must verify certain properties such as invariance with Euclidean transformations or invariance with parameterization. The notion of smoothness energy is extended here to the notion of a differential stabilizer, and it is shown that to void the systematic underestimation of undercurvature for planar curve fitting, it is necessary that circles be the curves of maximum smoothness. A set of stabilizers is proposed that meet this condition as well as invariance with rotation and parameterization.

Evaluation of SEBS, SEBAL, and METRIC models in estimation of the evaporation from the freshwater lakes (Case study: Amirkabir dam, Iran)

NASA Astrophysics Data System (ADS)

Zamani Losgedaragh, Saeideh; Rahimzadegan, Majid

2018-06-01

Evapotranspiration (ET) estimation is of great importance due to its key role in water resource management. Surface energy modeling tools such as Surface Energy Balance Algorithm for Land (SEBAL), Mapping Evapotranspiration with Internalized Calibration (METRIC), and the Surface Energy Balance System (SEBS) can estimate the amount of evapotranspiration for every pixel of the satellite images. The main objective of this research is evaporation investigation from the freshwater bodies using SEBAL, METRIC, and SEBS. For this purpose, the Amirkabir dam reservoir and its nearby agricultural lands in a semi-arid climate were selected and studied from 2011 to 2017 as the study area. The implementations of this study were accomplished on 16 satellite images of Landsat TM5 and OLI. Then, SEBAL, METRIC, and SEBS were implemented on the selected images. Moreover, the corresponding pan evaporate measurements on the reservoir bank were considered as the ground truth data. Regarding to the results, SEBAL is not a reliable method to evaluate freshwater evaporation with the coefficient of determination (R2) of 0.36 and the Root Mean Square Error (RMSE) of 5.1 mm. On the other hand, METRIC with RMSE and R2 of 0.57 and 2.02 mm and SEBS with RMSE and R2 of 0.93 and 0.62 demonstrated a relatively good performance.

Cloud Effects on Meridional Atmospheric Energy Budget Estimated from Clouds and the Earth's Radiant Energy System (CERES) Data

NASA Technical Reports Server (NTRS)

Kato, Seiji; Rose, Fred G.; Rutan, David A.; Charlock, Thomas P.

2008-01-01

The zonal mean atmospheric cloud radiative effect, defined as the difference of the top-of-atmosphere (TOA) and surface cloud radiative effects, is estimated from three years of Clouds and the Earth's Radiant Energy System (CERES) data. The zonal mean shortwave effect is small, though it tends to be positive (warming). This indicates that clouds increase shortwave absorption in the atmosphere, especially in midlatitudes. The zonal mean atmospheric cloud radiative effect is, however, dominated by the longwave effect. The zonal mean longwave effect is positive in the tropics and decreases with latitude to negative values (cooling) in polar regions. The meridional gradient of cloud effect between midlatitude and polar regions exists even when uncertainties in the cloud effect on the surface enthalpy flux and in the modeled irradiances are taken into account. This indicates that clouds increase the rate of generation of mean zonal available potential energy. Because the atmospheric cooling effect in polar regions is predominately caused by low level clouds, which tend to be stationary, we postulate that the meridional and vertical gradients of cloud effect increase the rate of meridional energy transport by dynamics in the atmosphere from midlatitude to polar region, especially in fall and winter. Clouds then warm the surface in polar regions except in the Arctic in summer. Clouds, therefore, contribute in increasing the rate of meridional energy transport from midlatitude to polar regions through the atmosphere.

Mechanistic insights into heterogeneous methane activation

DOE PAGES

Latimer, Allegra A.; Aljama, Hassan; Kakekhani, Arvin; ...

2017-01-11

While natural gas is an abundant chemical fuel, its low volumetric energy density has prompted a search for catalysts able to transform methane into more useful chemicals. This search has often been aided through the use of transition state (TS) scaling relationships, which estimate methane activation TS energies as a linear function of a more easily calculated descriptor, such as final state energy, thus avoiding tedious TS energy calculations. It has been shown that methane can be activated via a radical or surface-stabilized pathway, both of which possess a unique TS scaling relationship. Herein, we present a simple model tomore » aid in the prediction of methane activation barriers on heterogeneous catalysts. Analogous to the universal radical TS scaling relationship introduced in a previous publication, we show that a universal TS scaling relationship that transcends catalysts classes also seems to exist for surface-stabilized methane activation if the relevant final state energy is used. We demonstrate that this scaling relationship holds for several reducible and irreducible oxides, promoted metals, and sulfides. By combining the universal scaling relationships for both radical and surface-stabilized methane activation pathways, we show that catalyst reactivity must be considered in addition to catalyst geometry to obtain an accurate estimation for the TS energy. Here, this model can yield fast and accurate predictions of methane activation barriers on a wide range of catalysts, thus accelerating the discovery of more active catalysts for methane conversion.« less

Mechanistic insights into heterogeneous methane activation

DOE Office of Scientific and Technical Information (OSTI.GOV)

Latimer, Allegra A.; Aljama, Hassan; Kakekhani, Arvin

While natural gas is an abundant chemical fuel, its low volumetric energy density has prompted a search for catalysts able to transform methane into more useful chemicals. This search has often been aided through the use of transition state (TS) scaling relationships, which estimate methane activation TS energies as a linear function of a more easily calculated descriptor, such as final state energy, thus avoiding tedious TS energy calculations. It has been shown that methane can be activated via a radical or surface-stabilized pathway, both of which possess a unique TS scaling relationship. Herein, we present a simple model tomore » aid in the prediction of methane activation barriers on heterogeneous catalysts. Analogous to the universal radical TS scaling relationship introduced in a previous publication, we show that a universal TS scaling relationship that transcends catalysts classes also seems to exist for surface-stabilized methane activation if the relevant final state energy is used. We demonstrate that this scaling relationship holds for several reducible and irreducible oxides, promoted metals, and sulfides. By combining the universal scaling relationships for both radical and surface-stabilized methane activation pathways, we show that catalyst reactivity must be considered in addition to catalyst geometry to obtain an accurate estimation for the TS energy. Here, this model can yield fast and accurate predictions of methane activation barriers on a wide range of catalysts, thus accelerating the discovery of more active catalysts for methane conversion.« less

First-principle modelling of forsterite surface properties: Accuracy of methods and basis sets.

PubMed

Demichelis, Raffaella; Bruno, Marco; Massaro, Francesco R; Prencipe, Mauro; De La Pierre, Marco; Nestola, Fabrizio

2015-07-15

The seven main crystal surfaces of forsterite (Mg2 SiO4 ) were modeled using various Gaussian-type basis sets, and several formulations for the exchange-correlation functional within the density functional theory (DFT). The recently developed pob-TZVP basis set provides the best results for all properties that are strongly dependent on the accuracy of the wavefunction. Convergence on the structure and on the basis set superposition error-corrected surface energy can be reached also with poorer basis sets. The effect of adopting different DFT functionals was assessed. All functionals give the same stability order for the various surfaces. Surfaces do not exhibit any major structural differences when optimized with different functionals, except for higher energy orientations where major rearrangements occur around the Mg sites at the surface or subsurface. When dispersions are not accounted for, all functionals provide similar surface energies. The inclusion of empirical dispersions raises the energy of all surfaces by a nearly systematic value proportional to the scaling factor s of the dispersion formulation. An estimation for the surface energy is provided through adopting C6 coefficients that are more suitable than the standard ones to describe O-O interactions in minerals. A 2 × 2 supercell of the most stable surface (010) was optimized. No surface reconstruction was observed. The resulting structure and surface energy show no difference with respect to those obtained when using the primitive cell. This result validates the (010) surface model here adopted, that will serve as a reference for future studies on adsorption and reactivity of water and carbon dioxide at this interface. © 2015 Wiley Periodicals, Inc.

Solar energy estimated from geostationary satellites and its application on the energy management system

NASA Astrophysics Data System (ADS)

Nakajima, T. Y.; Takamatsu, T.; Funayama, T.; Yamamoto, Y.; Takenaka, H.; Nakajima, T.; Irie, H.; Higuchi, A.

2017-12-01

Recently, estimating and forecasting the solar radiation in terms of the electric power generation by photovoltaic (PV) systems is needed for the energy management system (EMS). The estimation technique depends on the latest atmospheric sciences. For instance, when one like to estimate solar radiation reached to ground surface, one will focus on the existence of clouds and their properties, because clouds exert an important influence to the radiative transfer. Visible-to-infared imaging radiometer aboard the geostationary satellites, Himawari, GOES, and Meteosat are useful for such objective, since they observe clouds for full disk of the Earth with high temporal frequency and moderately spatial resolution. Estimation of solar radiation at the ground surface from satellite imagery consists of two steps. The first step is retrieval of cloud optical and microphysical properties by use of the multispectral imaging data. Indeed, we retrieve cloud optical thickness, cloud particle sizes, and cloud top height from visible, near-infrared, and thermal infrared wavelength of the satellite imageries, respectively. The second step is the radiative transfer calculation. We will obtain solar radiation reached to the ground surface, using cloud properties retrieved from the first step, and radiative transfer calculations. We have built a system for near-real time estimation of solar radiation for global scale, named the AMATERASS system, under the support of JST (Japan Science and Technology Agency), CREST/EMS (Energy Management System). The AMATERASS dataset has been used for several researches. For example, Waseda University group applied the AMATERASS data in the electric power system, considering accidental blackout in the electric system for local scale. They made it clear that when AMATERASS data exists the chance of electric voltage deviancy is mitigated when the blackout is over. We have supported a solar car race in Australia, named World Solar Challenge (WSC) 2013, 2015, and 2017, by suppling the AMATERASS solar radiation and some meteorological data along the race track, dynamically following the location of the solar car. This experience is important because the era of electric vehicles equippe with PV panels will come soon.

Assessment of land surface temperature and heat fluxes over Delhi using remote sensing data.

PubMed

Chakraborty, Surya Deb; Kant, Yogesh; Mitra, Debashis

2015-01-15

Surface energy processes has an essential role in urban weather, climate and hydrosphere cycles, as well in urban heat redistribution. The research was undertaken to analyze the potential of Landsat and MODIS data in retrieving biophysical parameters in estimating land surface temperature & heat fluxes diurnally in summer and winter seasons of years 2000 and 2010 and understanding its effect on anthropogenic heat disturbance over Delhi and surrounding region. Results show that during years 2000-2010, settlement and industrial area increased from 5.66 to 11.74% and 4.92 to 11.87% respectively which in turn has direct effect on land surface temperature (LST) and heat fluxes including anthropogenic heat flux. Based on the energy balance model for land surface, a method to estimate the increase in anthropogenic heat flux (Has) has been proposed. The settlement and industrial areas has higher amounts of energy consumed and has high values of Has in all seasons. The comparison of satellite derived LST with that of field measured values show that Landsat estimated values are in close agreement within error of ±2 °C than MODIS with an error of ±3 °C. It was observed that, during 2000 and 2010, the average change in surface temperature using Landsat over settlement & industrial areas of both seasons is 1.4 °C & for MODIS data is 3.7 °C. The seasonal average change in anthropogenic heat flux (Has) estimated using Landsat & MODIS is up by around 38 W/m(2) and 62 W/m(2) respectively while higher change is observed over settlement and concrete structures. The study reveals that the dynamic range of Has values has increased in the 10 year period due to the strong anthropogenic influence over the area. The study showed that anthropogenic heat flux is an indicator of the strength of urban heat island effect, and can be used to quantify the magnitude of the urban heat island effect. Copyright © 2013 Elsevier Ltd. All rights reserved.

Solar power potential of North-east India - A case study for Silchar

NASA Astrophysics Data System (ADS)

Maisanam, Anil; Biswas, Agnimitra; Sharma, Kaushal Kumar

2018-04-01

High energy demand has necessitated search for all possible sources of energy. Conventional energy source is having negative impact on our environment, therefore our attention is focused on renewable energy sources, such as solar, wind, hydro, which are considered to be clean and sustainable energy sources. India has set an ambitious target of producing 175 GW of energy using solar energy. Therefore, it is necessary to estimate the solar potential to observe the feasibility of such project. North-east India is an underdeveloped region of India and due to its geographical location and difficult terrain, many regions are still not electrified. Such regions can be electrified by installing renewable energy based power plants, which can also generate number of jobs hence improving the quality of life and economic condition of the region. The objective of this paper is to estimate the solar power potential of Silchar (Assam, India) and perform a feasibility study for installation of solar-based power plant in the region. In this paper, solar radiation on tilted surface is estimated by using an anisotropic sky model. This radiation data has been used to estimate the PV power output. Finally, feasibility of the PV plant has been verified by mapping with a practical load demand.

Using machine learning to produce near surface soil moisture estimates from deeper in situ records at U.S. Climate Reference Network (USCRN) locations: Analysis and applications to AMSR-E satellite validation

USDA-ARS?s Scientific Manuscript database

Surface soil moisture is critical parameter for understanding the energy flux at the land atmosphere boundary. Weather modeling, climate prediction, and remote sensing validation are some of the applications for surface soil moisture information. The most common in situ measurement for these purpo...

Optimal reconstruction of the folding landscape using differential energy surface analysis

NASA Astrophysics Data System (ADS)

La Porta, Arthur; Denesyuk, Natalia A.; de Messieres, Michel

2013-03-01

In experiments and in simulations, the free energy of a state of a system can be determined from the probability that the state is occupied. However, it is often necessary to impose a biasing potential on the system so that high energy states are sampled with sufficient frequency. The unbiased energy is typically obtained from the data using the weighted histogram analysis method (WHAM). Here we present differential energy surface analysis (DESA), in which the gradient of the energy surface, dE/dx, is extracted from data taken with a series of harmonic biasing potentials. It is shown that DESA produces a maximum likelihood estimate of the folding landscape gradient. DESA is demonstrated by analyzing data from a simulated system as well as data from a single-molecule unfolding experiment in which the end-to-end distance of a DNA hairpin is measured. It is shown that the energy surface obtained from DESA is indistinguishable from the energy surface obtained when WHAM is applied to the same data. Two criteria are defined which indicate whether the DESA results are self-consistent. It is found that these criteria can detect a situation where the energy is not a single-valued function of the measured reaction coordinate. The criteria were found to be satisfied for the experimental data analyzed, confirming that end-to-end distance is a good reaction coordinate for the experimental system. The combination of DESA and the optical trap assay in which a structure is disrupted under harmonic constraint facilitates an extremely accurate measurement of the folding energy surface.

The effect of the geomagnetic field on cosmic ray energy estimates and large scale anisotropy searches on data from the Pierre Auger Observatory

DOE Office of Scientific and Technical Information (OSTI.GOV)

Abreu, P.; /Lisbon, IST; Aglietta, M.

2011-11-01

We present a comprehensive study of the influence of the geomagnetic field on the energy estimation of extensive air showers with a zenith angle smaller than 60{sup o}, detected at the Pierre Auger Observatory. The geomagnetic field induces an azimuthal modulation of the estimated energy of cosmic rays up to the {approx} 2% level at large zenith angles. We present a method to account for this modulation of the reconstructed energy. We analyse the effect of the modulation on large scale anisotropy searches in the arrival direction distributions of cosmic rays. At a given energy, the geomagnetic effect is shownmore » to induce a pseudo-dipolar pattern at the percent level in the declination distribution that needs to be accounted for. In this work, we have identified and quantified a systematic uncertainty affecting the energy determination of cosmic rays detected by the surface detector array of the Pierre Auger Observatory. This systematic uncertainty, induced by the influence of the geomagnetic field on the shower development, has a strength which depends on both the zenith and the azimuthal angles. Consequently, we have shown that it induces distortions of the estimated cosmic ray event rate at a given energy at the percent level in both the azimuthal and the declination distributions, the latter of which mimics an almost dipolar pattern. We have also shown that the induced distortions are already at the level of the statistical uncertainties for a number of events N {approx_equal} 32 000 (we note that the full Auger surface detector array collects about 6500 events per year with energies above 3 EeV). Accounting for these effects is thus essential with regard to the correct interpretation of large scale anisotropy measurements taking explicitly profit from the declination distribution.« less

Application of Data Assimilation with the Root Zone Water Quality Model for Soil Moisture Profile Estimation

USDA-ARS?s Scientific Manuscript database

Estimation of soil moisture has received considerable attention in the areas of hydrology, agriculture, meteorology and environmental studies because of its role in the partitioning water and energy at the land surface. In this study, the Ensemble Kalman Filter (EnKF), a popular data assimilation te...

Calibration of the Root Zone Water Quality Model and Application of Data Assimilation Techniques to Estimate Profile Soil Moisture

USDA-ARS?s Scientific Manuscript database

Estimation of soil moisture has received considerable attention in the areas of hydrology, agriculture, meteorology and environmental studies because of its role in the partitioning water and energy at the land surface. In this study, the USDA, Agricultural Research Service, Root Zone Water Quality ...

Estimation of water flux in urban area using eddy covariance measurements in Riverside, Southern California

USDA-ARS?s Scientific Manuscript database

Micrometeorological methods can direct measure the sensible and latent heat flux in specific sites and provide robust estimates of the evaporative fraction (EF), which is the fraction of available surface energy contained in latent heat. Across a vegetation coverage gradient in urban area, an empir...

Machine Learning Estimates of Natural Product Conformational Energies

PubMed Central

Rupp, Matthias; Bauer, Matthias R.; Wilcken, Rainer; Lange, Andreas; Reutlinger, Michael; Boeckler, Frank M.; Schneider, Gisbert

2014-01-01

Machine learning has been used for estimation of potential energy surfaces to speed up molecular dynamics simulations of small systems. We demonstrate that this approach is feasible for significantly larger, structurally complex molecules, taking the natural product Archazolid A, a potent inhibitor of vacuolar-type ATPase, from the myxobacterium Archangium gephyra as an example. Our model estimates energies of new conformations by exploiting information from previous calculations via Gaussian process regression. Predictive variance is used to assess whether a conformation is in the interpolation region, allowing a controlled trade-off between prediction accuracy and computational speed-up. For energies of relaxed conformations at the density functional level of theory (implicit solvent, DFT/BLYP-disp3/def2-TZVP), mean absolute errors of less than 1 kcal/mol were achieved. The study demonstrates that predictive machine learning models can be developed for structurally complex, pharmaceutically relevant compounds, potentially enabling considerable speed-ups in simulations of larger molecular structures. PMID:24453952

A rapid solvent accessible surface area estimator for coarse grained molecular simulations.

PubMed

Wei, Shuai; Brooks, Charles L; Frank, Aaron T

2017-06-05

The rapid and accurate calculation of solvent accessible surface area (SASA) is extremely useful in the energetic analysis of biomolecules. For example, SASA models can be used to estimate the transfer free energy associated with biophysical processes, and when combined with coarse-grained simulations, can be particularly useful for accounting for solvation effects within the framework of implicit solvent models. In such cases, a fast and accurate, residue-wise SASA predictor is highly desirable. Here, we develop a predictive model that estimates SASAs based on Cα-only protein structures. Through an extensive comparison between this method and a comparable method, POPS-R, we demonstrate that our new method, Protein-C α Solvent Accessibilities or PCASA, shows better performance, especially for unfolded conformations of proteins. We anticipate that this model will be quite useful in the efficient inclusion of SASA-based solvent free energy estimations in coarse-grained protein folding simulations. PCASA is made freely available to the academic community at https://github.com/atfrank/PCASA. © 2017 Wiley Periodicals, Inc. © 2017 Wiley Periodicals, Inc.

A one- and two-layer model for estimating evapotranspiration with remotely sensed surface temperature and ground-based meteorological data over partial canopy cover

NASA Technical Reports Server (NTRS)

Kustas, William P.; Choudhury, Bhaskar J.; Kunkel, Kenneth E.

1989-01-01

Surface-air temperature differences are commonly used in a bulk resistance equation for estimating sensible heat flux (H), which is inserted in the one-dimensional energy balance equation to solve for the latent heat flux (LE) as a residual. Serious discrepancies between estimated and measured LE have been observed for partial-canopy-cover conditions, which are mainly attributed to inappropriate estimates of H. To improve the estimates of H over sparse canopies, one- and two-layer resistance models that account for some of the factors causing poor agreement are developed. The utility of the two models is tested with remotely sensed and micrometeorological data for a furrowed cotton field with 20 percent cover and a dry soil surface. It is found that the one-layer model performs better than the two-layer model when a theoretical bluff-body correction for heat transfer is used instead of an empirical adjustment; otherwise, the two-layer model is better.

Surface-plasmon--ion interaction in laser ablation of ions from a surface

DOE Office of Scientific and Technical Information (OSTI.GOV)

Ritchie, R.H.; Manson, J.R.; Echenique, P.M.

1994-01-15

Experimental work by Shea and Compton suggests that Ag[sup +] ions emitted from a roughened Ag surface irradiated by a nanosecond or picosecond laser beam may absorb the full energy of the Ag surface plasmon (SP). We have modeled this process as an inverse bremsstrahlung-type absorption of the SP quantum by an Ag[sup +] ion which undergoes a collision with the surface. We estimate the absorption probability and find it to be consistent with the Shea-Compton results.

Evaluation of the energy budget method of determining evaporation at Williams Lake, Minnesota, using alternative instrumentation and study approaches

USGS Publications Warehouse

Rosenberry, D.O.; Sturrock, A.M.; Winter, T.C.

1993-01-01

Best estimates of evaporation at Williams Lake, north central Minnesota, were determined by the energy budget method using optimum sensors and optimum placement of sensors. These best estimates are compared with estimates derived from using substitute data to determine the effect of using less accurate sensors, simpler methods, or remotely measured data. Calculations were made for approximately biweekly periods during five open water seasons. For most of the data substitutions that affected the Bowen ratio, new values of evaporation differed little from best estimates. The three data substitution methods that caused the largest deviations from the best evaporation estimates were (1) using changes in the daily average surface water temperature as an indicator of the lake heat storage term, (2) using shortwave radiation, air temperature, and atmospheric vapor pressure data from a site 110 km away, and (3) using an analog surface water temperature probe. Recalculations based on these data substitutions resulted in differences from the best estimates as much as 89%, 21%, and 10%, respectively. The data substitution method that provided evaporation values that most closely matched the best estimates was measurement of the lake heat storage term at one location in the lake, rather than at 16 locations. Evaporation values resulting from this substitution method usually were within 2% of the best estimates.

Growth of AlGaN under the conditions of significant gallium evaporation: Phase separation and enhanced lateral growth

NASA Astrophysics Data System (ADS)

Mayboroda, I. O.; Knizhnik, A. A.; Grishchenko, Yu. V.; Ezubchenko, I. S.; Zanaveskin, Maxim L.; Kondratev, O. A.; Presniakov, M. Yu.; Potapkin, B. V.; Ilyin, V. A.

2017-09-01

The growth kinetics of AlGaN in NH3 MBE under significant Ga desorption was studied. It was found that the addition of gallium stimulates 2D growth and provides better morphology of films compared to pure AlN. The effect was experimentally observed at up to 98% desorption of the impinging gallium. We found that under the conditions of significant thermal desorption, larger amounts of gallium were retained at lateral boundaries of 3D surface features than at flat terraces because of the higher binding energy of Ga atoms at specific surface defects. The selective accumulation of gallium resulted in an increase in the lateral growth component through the formation of the Ga-enriched AlGaN phase at boundaries of 3D surface features. We studied the temperature dependence of AlGaN growth rate and developed a kinetic model analytically describing this dependence. As the model was in good agreement with the experimental data, we used it to estimate the increase in the binding energy of Ga atoms at surface defects compared to terrace surface sites using data on the Ga content in different AlGaN phases. We also applied first-principles calculations to the thermodynamic analysis of stable configurations on the AlN surface and then used these surface configurations to compare the binding energy of Ga atoms at terraces and steps. Both first-principles calculations and analytical estimations of the experimental results gave similar values of difference in binding energies; this value is 0.3 eV. Finally, it was studied experimentally whether gallium can act as a surfactant in AlN growth by NH3 MBE at elevated temperatures. Gallium application has allowed us to grow a 300 nm thick AlN film with a RMS surface roughness of 2.2 Å over an area of 10 × 10 μm and a reduced density of screw dislocations.

WEB-DHM: A distributed biosphere hydrological model developed by coupling a simple biosphere scheme with a hillslope hydrological model

USDA-ARS?s Scientific Manuscript database

The coupling of land surface models and hydrological models potentially improves the land surface representation, benefiting both the streamflow prediction capabilities as well as providing improved estimates of water and energy fluxes into the atmosphere. In this study, the simple biosphere model 2...

Constraining the Surface Energy Balance of Snow in Complex Terrain

NASA Astrophysics Data System (ADS)

Lapo, Karl E.

Physically-based snow models form the basis of our understanding of current and future water and energy cycles, especially in mountainous terrain. These models are poorly constrained and widely diverge from each other, demonstrating a poor understanding of the surface energy balance. This research aims to improve our understanding of the surface energy balance in regions of complex terrain by improving our confidence in existing observations and improving our knowledge of remotely sensed irradiances (Chapter 1), critically analyzing the representation of boundary layer physics within land models (Chapter 2), and utilizing relatively novel observations to in the diagnoses of model performance (Chapter 3). This research has improved the understanding of the literal and metaphorical boundary between the atmosphere and land surface. Solar irradiances are difficult to observe in regions of complex terrain, as observations are subject to harsh conditions not found in other environments. Quality control methods were developed to handle these unique conditions. These quality control methods facilitated an analysis of estimated solar irradiances over mountainous environments. Errors in the estimated solar irradiance are caused by misrepresenting the effect of clouds over regions of topography and regularly exceed the range of observational uncertainty (up to 80Wm -2) in all regions examined. Uncertainty in the solar irradiance estimates were especially pronounced when averaging over high-elevation basins, with monthly differences between estimates up to 80Wm-2. These findings can inform the selection of a method for estimating the solar irradiance and suggest several avenues of future research for improving existing methods. Further research probed the relationship between the land surface and atmosphere as it pertains to the stable boundary layers that commonly form over snow-covered surfaces. Stable conditions are difficult to represent, especially for low wind speed values and coupled land-atmosphere models have difficulty representing these processes. We developed a new method analyzing turbulent fluxes at the land surface that relies on using the observed surface temperature, which we called the offline turbulence method. We used this method to test a number of stability schemes as they are implemented within land models. Stability schemes can cause small biases in the simulated sensible heat flux, but these are caused by compensating errors, as no single method was able to accurately reproduce the observed distribution of the sensible heat flux. We described how these turbulence schemes perform within different turbulence regimes, particularly noting the difficulty representing turbulence during conditions with faster wind speeds and the transition between weak and strong wind turbulence regimes. Heterogeneity in the horizontal distribution of surface temperature associated with different land surface types likely explains some of the missing physics within land models and is manifested as counter-gradient fluxes in observations. The coupling of land and atmospheric models needs further attention, as we highlight processes that are missing. Expanding on the utility of surface temperature, Ts, in model evaluations, we demonstrated the utility of using surface temperature in snow models evaluations. Ts is the diagnostic variable of the modeled surface energy balance within physically-based models and is an ideal supplement to traditional evaluation techniques. We demonstrated how modeling decisions affect Ts, specifically testing the impact of vertical layer structure, thermal conductivity, and stability corrections in addition to the effect of uncertainty in forcing data on simulated Ts. The internal modeling decisions had minimal impacts relative to uncertainty in the forcing data. Uncertainty in downwelling longwave was found to have the largest impact on simulated Ts. Using Ts, we demonstrated how various errors in the forcing data can be identified, noting that uncertainty in downwelling longwave and wind are the easiest to identify due to their effect on night time minimum Ts.

SEBAL-A: A remote sensing ET algorithm that accounts for advection with limited data. Part II: Test for transferability

USDA-ARS?s Scientific Manuscript database

Because the Surface Energy Balance Algorithm for Land (SEBAL) tends to underestimate ET under conditions of advection, the model was modified by incorporating an advection component as part of the energy usable for crop evapotranspiration (ET). The modification involved the estimation of advected en...

The energy requirements of an aircraft triggered discharge

NASA Astrophysics Data System (ADS)

Bicknell, J. A.; Shelton, R. W.

The corona produced at aircraft surfaces requires an energy input before the corona can develop into a high current discharge and, thus, a possible lightning stroke. This energy must be drawn from the space charge field of the thundercloud and, since this is of low density, the unique propagation characteristics of positive corona streamers may be important. Estimates of the energy made available by the propagation are compared with laboratory measurements of the minimum energy input required to trigger a breakdown. The comparison indicates a minimum streamer range for breakdown of several tens of meters. Also estimated is the energy released as a consequence of streamer-hydrometer interactions; this is shown to be significant so that breakdown could depend upon the precipitation rate within the cloud. Inhibiting streamer production may therefore provide an aircraft with a degree of corona protection.

Mapping Surface Heat Fluxes by Assimilating SMAP Soil Moisture and GOES Land Surface Temperature Data

NASA Astrophysics Data System (ADS)

Lu, Yang; Steele-Dunne, Susan C.; Farhadi, Leila; van de Giesen, Nick

2017-12-01

Surface heat fluxes play a crucial role in the surface energy and water balance. In situ measurements are costly and difficult, and large-scale flux mapping is hindered by surface heterogeneity. Previous studies have demonstrated that surface heat fluxes can be estimated by assimilating land surface temperature (LST) and soil moisture to determine two key parameters: a neutral bulk heat transfer coefficient (CHN) and an evaporative fraction (EF). Here a methodology is proposed to estimate surface heat fluxes by assimilating Soil Moisture Active Passive (SMAP) soil moisture data and Geostationary Operational Environmental Satellite (GOES) LST data into a dual-source (DS) model using a hybrid particle assimilation strategy. SMAP soil moisture data are assimilated using a particle filter (PF), and GOES LST data are assimilated using an adaptive particle batch smoother (APBS) to account for the large gap in the spatial and temporal resolution. The methodology is implemented in an area in the U.S. Southern Great Plains. Assessment against in situ observations suggests that soil moisture and LST estimates are in better agreement with observations after assimilation. The RMSD for 30 min (daytime) flux estimates is reduced by 6.3% (8.7%) and 31.6% (37%) for H and LE on average. Comparison against a LST-only and a soil moisture-only assimilation case suggests that despite the coarse resolution, assimilating SMAP soil moisture data is not only beneficial but also crucial for successful and robust flux estimation, particularly when the uncertainties in the model estimates are large.

Uncertainty in regional and zonal monthly mean downward surface irradiances from Edition 4.0 CERES Energy Balanced and Filled (EBAF) data product

NASA Astrophysics Data System (ADS)

Kato, S.; Rutan, D. A.; Rose, F. G.; Loeb, N. G.

2017-12-01

The surface of the Earth receives solar radiation (shortwave) and emission from the atmosphere (longwave). At a global and annual mean approximately 12% of solar radiation incident on the surface is reflected and the rest is absorbed by the surface. The surface emits radiation proportional to the forth power of the temperature. Although the uncertainty in global and annual mean surface irradiances is estimated in earlier studies (Zhang et al. 1995, 2004; L'Ecuyer et al. 2008; Stephens et al. 2012; Kato et al. 2012), only a few studies estimated the uncertainty in computed surface irradiances at smaller spatial and temporal scales (Zhang et al. 1995, 2004; Kato et al. 2012). We use surface observations at 46 buoys and 36 land sites and newly released the Edition 4.0 Clouds and the Earth's Radiant Energy System (CERES) Energy Balanced and Filled (EBAF)-surface data product to estimate the uncertainty in regional and zonal monthly mean downward shortwave and longwave surface irradiances. The root-mean-square difference of monthly mean computed and observed irradiances is used for the regional uncertainty. The uncertainty is separated into bias and spatially random components. The random component decreases when irradiances are averaged over a larger area, nearly inversely proportional to the number of surface observation sites. The presentation provides the uncertainty in the regional and zonal monthly mean downward surface irradiances over ocean and land. ReferencesKato, S. and N.G.Loeb, D. A.Rutan, F. G. Rose, S. Sun-Mack,W.F.Miller, and Y. Chen, 2012. Surv. Geophys., 33, 395-412, doi:10.1007/s10712-012-9179-x. L'Ecuyer, T. S., N. B. Wood, T. Haladay, G. L. Stephens, and P. W. Stackhouse Jr., 2008, J. Geophys. Res., 113, D00A15, doi:10.1029/2008JD009951. Stephens, G. L. and Coauthors, 2012, Nat. Geosci., 5, 691-696, doi:10.1038/ngeo1580. Zhang, Y., W. B. Rossow, A. A. Lacis, V. Oinas, and M. I. Mishchenko, 2004, J. Geophys. Res., 109, D19105, doi:10.1029/2003JD004457. Zhang, Y.-C., W. B. Rossow, and A. A. Lacis, 1995, J. Geophys. Res., 100, 1149-1165.

Vaporization of a solid surface in an ambient gas

NASA Astrophysics Data System (ADS)

Benilov, M. S.; Jacobsson, S.; Kaddani, A.; Zahrai, S.

2001-07-01

The net flux of vapour from a solid surface in an ambient gas is analysed with the aim to estimate the effect of vaporization cooling on the energy balance of an arc cathode under conditions typical for a high-power current breaker. If the ratio of the equilibrium vapour pressure pv to the ambient pressure p∞ is smaller than unity, the removal of vapour from the surface is due to diffusion into the bulk of the gas. As a consequence, the net flux of the vapour from the surface is much smaller than the emitted flux. An estimate of the diffusion rate under conditions typical for a high-power current breaker indicates that vaporization cooling plays a minor role in the energy balance of the cathode in this case. If ratio pv/p∞ is above unity, the flow of the vapour from the surface appears and the net flux is comparable to the emitted flux. A simple analytical solution has been obtained for this case, which is in a good agreement with results of the Monte Carlo modelling of preceding authors. If pv/p∞ exceeds approximately 4.5, vaporization occurs as into vacuum and the net flux is about 0.82 of the emitted flux.

Jump rates for surface diffusion of large molecules from first principles

DOE Office of Scientific and Technical Information (OSTI.GOV)

Shea, Patrick, E-mail: patrick.shea@dal.ca; Kreuzer, Hans Jürgen

2015-04-21

We apply a recently developed stochastic model for the surface diffusion of large molecules to calculate jump rates for 9,10-dithioanthracene on a Cu(111) surface. The necessary input parameters for the stochastic model are calculated from first principles using density functional theory (DFT). We find that the inclusion of van der Waals corrections to the DFT energies is critical to obtain good agreement with experimental results for the adsorption geometry and energy barrier for diffusion. The predictions for jump rates in our model are in excellent agreement with measured values and show a marked improvement over transition state theory (TST). Wemore » find that the jump rate prefactor is reduced by an order of magnitude from the TST estimate due to frictional damping resulting from energy exchange with surface phonons, as well as a rotational mode of the diffusing molecule.« less

Estimating the actual ET from a pecan farm using the OPEC energy-balance and Penman- Monteith methods

NASA Astrophysics Data System (ADS)

Debele, B.; Bawazir, S. A.

2006-12-01

Accurate estimation of ET from field crops/orchards is the basis for better irrigation water management. In areas like Mesilla Valley, NM, where water is scarce, it is even more important to precisely determine the crop ET. An OPEC energy balance system was run for 117 days (June 22 October 14, 2001) in a matured pecan farm at Mesilla Valley, NM. The actual evapotranspiration (ET) from pecan orchards was determined from the surface energy balance as a residual, having measured the net radiation, soil heat flux, and sensible heat components using the OPEC method. Since pecans are large trees, we have also examined the effect of including thermal energies stored in the air (Ga) and plant canopy (Gc), on top of the commonly used thermal energy stored in the soil (Gs), on surface energy balance, and hence ET. The results indicate that incorporating thermal energies stored in the air and canopy has a significant effect on total energy storage for shorter temporal resolutions, such as 30-minutes and an hour. Conversely, for longer temporal resolutions (e.g., diurnal and monthly averages), the effect of including thermal energies stored in the air and vegetation on total thermal energy storage is negligible. Our results also showed that the bulk of the total thermal energy storage (G = Gs + Ga + Gc) in the surface energy balance was stored in the soil (Gs). In addition, we have also determined the crop coefficient (Kc) of pecan by combining the actual ET obtained from the OPEC method and potential ET (ET0) calculated using weather data in the surrounding area. Our average pecan Kc values were comparable with the ones reported by other researchers using different methods. We conclude that the OPEC energy balance method can be used to calculate Kc values for pecan whereby farmers and extension agents use the calculated Kc values in combination with ET0 to determine the consumptive use of pecan trees.

On the calculation of puckering free energy surfaces

NASA Astrophysics Data System (ADS)

Sega, M.; Autieri, E.; Pederiva, F.

2009-06-01

Cremer-Pople puckering coordinates appear to be the natural candidate variables to explore the conformational space of cyclic compounds and in literature different parametrizations have been used to this end. However, while every parametrization is equivalent in identifying conformations, it is not obvious that they can also act as proper collective variables for the exploration of the puckered conformations free energy surface. It is shown that only the polar parametrization is fit to produce an unbiased estimate of the free energy landscape. As an example, the case of a six-membered ring, glucuronic acid, is presented, showing the artifacts that are generated when a wrong parametrization is used.

On the calculation of puckering free energy surfaces.

PubMed

Sega, M; Autieri, E; Pederiva, F

2009-06-14

Cremer-Pople puckering coordinates appear to be the natural candidate variables to explore the conformational space of cyclic compounds and in literature different parametrizations have been used to this end. However, while every parametrization is equivalent in identifying conformations, it is not obvious that they can also act as proper collective variables for the exploration of the puckered conformations free energy surface. It is shown that only the polar parametrization is fit to produce an unbiased estimate of the free energy landscape. As an example, the case of a six-membered ring, glucuronic acid, is presented, showing the artifacts that are generated when a wrong parametrization is used.

Evaluation of the soft x-ray reflectivity of micropore optics using anisotropic wet etching of silicon wafers

DOE Office of Scientific and Technical Information (OSTI.GOV)

Mitsuishi, Ikuyuki; Ezoe, Yuichiro; Koshiishi, Masaki

2010-02-20

The x-ray reflectivity of an ultralightweight and low-cost x-ray optic using anisotropic wet etching of Si (110) wafers is evaluated at two energies, C K{alpha}0.28 keV and Al K{alpha}1.49 keV. The obtained reflectivities at both energies are not represented by a simple planar mirror model considering surface roughness. Hence, an geometrical occultation effect due to step structures upon the etched mirror surface is taken into account. Then, the reflectivities are represented by the theoretical model. The estimated surface roughness at C K{alpha} ({approx}6 nm rms) is significantly larger than {approx}1 nm at Al K{alpha}. This can be explained by differentmore » coherent lengths at two energies.« less

Evaluation of the soft x-ray reflectivity of micropore optics using anisotropic wet etching of silicon wafers.

PubMed

Mitsuishi, Ikuyuki; Ezoe, Yuichiro; Koshiishi, Masaki; Mita, Makoto; Maeda, Yoshitomo; Yamasaki, Noriko Y; Mitsuda, Kazuhisa; Shirata, Takayuki; Hayashi, Takayuki; Takano, Takayuki; Maeda, Ryutaro

2010-02-20

The x-ray reflectivity of an ultralightweight and low-cost x-ray optic using anisotropic wet etching of Si (110) wafers is evaluated at two energies, C K(alpha)0.28 keV and Al K(alpha)1.49 keV. The obtained reflectivities at both energies are not represented by a simple planar mirror model considering surface roughness. Hence, an geometrical occultation effect due to step structures upon the etched mirror surface is taken into account. Then, the reflectivities are represented by the theoretical model. The estimated surface roughness at C K(alpha) (approximately 6 nm rms) is significantly larger than approximately 1 nm at Al K(alpha). This can be explained by different coherent lengths at two energies.

Implications of a reduced Arctic sea ice cover on the large-scale atmospheric energy and moisture budgets

NASA Astrophysics Data System (ADS)

Porter, David Felton

New estimates of the current energy budget of the north polar cap (the region north of 70N) are synthesized by combining data from new atmospheric reanalyses and satellite retrievals. For the period 2000-2005, monthly means from the Clouds and the Earth's Radiant Energy System (CERES) satellite data set are considered to provide the most reliable top-of-atmosphere (TOA) radiation budget. The remaining components of the energy budget, comprising of the energy storage, horizontal convergence of energy, and the net surface flux between the atmospheric and subsurface columns, are compiled using data from the Japanese 25-year Reanalysis Project (JRA) and the NCEP/NCAR Reanalysis (NRA). The annual cycles of energy budget components for the polar cap are fairly consistent between the JRA and NRA, but with some systematic differences. Estimates of the Arctic energy budget from WRF are compared with estimates from reanalyses and satellite observations. Apart from a few systematic shortcomings, WRF sufficiently captures the Arctic energy budget. The major deficiency, with differences from reanalyses and satellite observations as large as 40 W m-2 in summer months, is in the shortwave radiative fluxes at both the surface and top of the atmosphere, due to a specified constant sea ice albedo of 0.8, which is too high during the summer. Finally, the WRF model (version 3.2.0) is used to explore the sensitivity of the large-scale atmospheric circulation to prescribed changes in Arctic sea ice. Observed sea ice fractions and sea surface temperatures (SSTs) from 1996 and 2007, representing years of high and low sea ice extent, respectively, are used as WRF lower boundary conditions. This yields two 15-member ensembles that sample a large range of true climatic variability. Results of the simulations show both local and remote responses to the sea ice reduction. The local response is largest in October and November, dominated by increased turbulent heat fluxes resulting in a vertically deep heating and moistening of the Arctic atmosphere. Significant warming and moistening persists through November. This warmer and moister atmosphere is associated with an increase in cloud cover, affecting the surface and atmospheric energy budget. There is an enhancement of the hydrologic cycle, with increased evaporation in areas of sea ice loss paired with increased precipitation. Summertime changes in the hydrologic cycle reflect circulation responses to mid-latitude SSTs, highlighting the general sensitivity of the Arctic climate.

Investigation of the physical scaling of sea spray spume droplet production

NASA Astrophysics Data System (ADS)

Fairall, C. W.; Banner, M. L.; Peirson, W. L.; Asher, W.; Morison, R. P.

2009-10-01

In this paper we report on a laboratory study, the Spray Production and Dynamics Experiment (SPANDEX), conducted at the University of New South Wales Water Research Laboratory in Australia. The goals of SPANDEX were to illuminate physical aspects of spume droplet production and dispersion; verify theoretical simplifications used to estimate the source function from ambient droplet concentration measurements; and examine the relationship between the implied source strength and forcing parameters such as wind speed, surface turbulent stress, and wave properties. Observations of droplet profiles give reasonable confirmation of the basic power law profile relationship that is commonly used to relate droplet concentrations to the surface source strength. This essentially confirms that, even in a wind tunnel, there is a near balance between droplet production and removal by gravitational settling. The observations also indicate considerable droplet mass may be present for sizes larger than 1.5 mm diameter. Phase Doppler Anemometry observations revealed significant mean horizontal and vertical slip velocities that were larger closer to the surface. The magnitude seems too large to be an acceleration time scale effect. Scaling of the droplet production surface source strength proved to be difficult. The wind speed forcing varied only 23% and the stress increased a factor of 2.2. Yet, the source strength increased by about a factor of 7. We related this to an estimate of surface wave energy flux through calculations of the standard deviation of small-scale water surface disturbance, a wave-stress parameterization, and numerical wave model simulations. This energy index only increased by a factor of 2.3 with the wind forcing. Nonetheless, a graph of spray mass surface flux versus surface disturbance energy is quasi-linear with a substantial threshold.

Dynamic information for cardiotoxin protein desorption from a methyl-terminated self-assembled monolayer using steered molecular dynamics simulation

NASA Astrophysics Data System (ADS)

Hung, Shih-Wei; Hsiao, Pai-Yi; Chieng, Ching-Chang

2011-05-01

Dynamic information, such as force, structural change, interaction energy, and potential of mean force (PMF), about the desorption of a single cardiotoxin (CTX) protein from a methyl-terminated self-assembled monolayer (SAM) surface was investigated by means of steered molecular dynamics (SMD) simulations. The simulation results indicated that Loop I is the first loop to depart from the SAM surface, which is in good agreement with the results of the nuclear magnetic resonance spectroscopy experiment. The free energy landscape and the thermodynamic force of the CTX desorption process was represented by the PMF and by the derivative of PMF with respect to distance, respectively. By applying Jarzynski's equality, the PMF can be reconstructed from the SMD simulation. The PMFs, calculated by different estimators based upon Jarzynski's equality, were compared with the conventional umbrella sampling method. The best estimation was obtained by using the fluctuation-dissipation estimator with a pulling velocity of v = 0.25 nm/ns for the present study.

Downscaling Satellite Land Surface Temperatures in Urban Regions for Surface Energy Balance Study and Heat Index Development

NASA Astrophysics Data System (ADS)

Norouzi, H.; Bah, A.; Prakash, S.; Nouri, N.; Blake, R.

2017-12-01

A great percentage of the world's population reside in urban areas that are exposed to the threats of global and regional climate changes and associated extreme weather events. Among them, urban heat islands have significant health and economic impacts due to higher thermal gradients of impermeable surfaces in urban regions compared to their surrounding rural areas. Therefore, accurate characterization of the surface energy balance in urban regions are required to predict these extreme events. High spatial resolution Land surface temperature (LST) in the scale of street level in the cities can provide wealth of information to study surface energy balance and eventually providing a reliable heat index. In this study, we estimate high-resolution LST maps using combination of LandSat 8 and infrared based satellite products such as Moderate Resolution Imaging Spectroradiometer (MODIS) and newly launched Geostationary Operational Environmental Satellite-R Series (GOES-R). Landsat 8 provides higher spatial resolution (30 m) estimates of skin temperature every 16 days. However, MODIS and GOES-R have lower spatial resolution (1km and 4km respectively) with much higher temporal resolution. Several statistical downscaling methods were investigated to provide high spatiotemporal LST maps in urban regions. The results reveal that statistical methods such as Principal Component Analysis (PCA) can provide reliable estimations of LST downscaling with 2K accuracy. Other methods also were tried including aggregating (up-scaling) the high-resolution data to a coarse one to examine the limitations and to build the model. Additionally, we deployed flux towers over distinct materials such as concrete, asphalt, and rooftops in New York City to monitor the sensible and latent heat fluxes through eddy covariance method. To account for the incoming and outgoing radiation, a 4-component radiometer is used that can observe both incoming and outgoing longwave and shortwave radiation. This enables us to accurately build the relationship between LST, air temperature, and the heat index in the future.

Exploring load, velocity, and surface disorder dependence of friction with one-dimensional and two-dimensional models.

PubMed

Dagdeviren, Omur E

2018-08-03

The effect of surface disorder, load, and velocity on friction between a single asperity contact and a model surface is explored with one-dimensional and two-dimensional Prandtl-Tomlinson (PT) models. We show that there are fundamental physical differences between the predictions of one-dimensional and two-dimensional models. The one-dimensional model estimates a monotonic increase in friction and energy dissipation with load, velocity, and surface disorder. However, a two-dimensional PT model, which is expected to approximate a tip-sample system more realistically, reveals a non-monotonic trend, i.e. friction is inert to surface disorder and roughness in wearless friction regime. The two-dimensional model discloses that the surface disorder starts to dominate the friction and energy dissipation when the tip and the sample interact predominantly deep into the repulsive regime. Our numerical calculations address that tracking the minimum energy path and the slip-stick motion are two competing effects that determine the load, velocity, and surface disorder dependence of friction. In the two-dimensional model, the single asperity can follow the minimum energy path in wearless regime; however, with increasing load and sliding velocity, the slip-stick movement dominates the dynamic motion and results in an increase in friction by impeding tracing the minimum energy path. Contrary to the two-dimensional model, when the one-dimensional PT model is employed, the single asperity cannot escape to the minimum energy minimum due to constraint motion and reveals only a trivial dependence of friction on load, velocity, and surface disorder. Our computational analyses clarify the physical differences between the predictions of the one-dimensional and two-dimensional models and open new avenues for disordered surfaces for low energy dissipation applications in wearless friction regime.

Surface energy fluxes and their representation in CMIP5 models

NASA Astrophysics Data System (ADS)

Wild, M.

2016-12-01

Energy fluxes at the Earth surface play a key role in the determination of surface climate and in the coupling of atmosphere, land and ocean components. Unlike their counterparts at the top of atmosphere (TOA), surface fluxes cannot be directly measured from satellites, but have to be inferred from the space-born observations using additional models to account for atmospheric perturbations, or from the limited number of surface observations. Uncertainties in the energy fluxes at the surface have therefore traditionally been larger than at the TOA, and have limited our knowledge on the distribution of the energy flows within the climate system. Accordingly, current climate models still largely differ in their representation of surface and atmospheric energy fluxes. Since the mid-1990s, accurate flux measurements became increasingly available from surface networks such as BSRN, which allow to better constrain the surface energy fluxes. There is, however, still a lack of flux measurements particularly over oceans. Further, the larger-scale representativeness of the station records needs to be assessed to judge their suitability as anchor sites for gridded flux products inferred from satellites, reanalyses and climate models. In addition, historic records need to be carefully quality-checked and homogeneized. In parallel, satellite-derived products of surface fluxes profit from the great advancement in space-born observations since the turn of the millennium, and from improved validation capabilities with surface observations. Ultimately, it is the combination of surface and space-born observations, reanalyses and modeling approaches that will advance our knowledge on the distribution of the surface energy fluxes. Uncertainties remain in the determination of surface albedo, skin temperatures and the partitioning of surface net radiation into the sensible and latent heat. Climate models over generations up to present day (CMIP5) tend to overestimate the downward shortwave and underestimate the downward longwave radiation. A challenge also remains the consistent representation of the global energy and water cycles. Yet it is shown that those climate models with a realistic surface radiation balance also simulate global precipitation amounts within the uncertainty range of observational estimates.

Theoretical aspects of studies of oxide and semiconductor surfaces using low energy positrons

NASA Astrophysics Data System (ADS)

Fazleev, N. G.; Maddox, W. B.; Weiss, A. H.

2011-01-01

This paper presents the results of a theoretical study of positron surface and bulk states and annihilation characteristics of surface trapped positrons at the oxidized Cu(100) single crystal and at both As- and Ga-rich reconstructed GaAs(100) surfaces. The variations in atomic structure and chemical composition of the topmost layers of the surfaces associated with oxidation and reconstructions and the charge redistribution at the surfaces are found to affect localization and spatial extent of the positron surface-state wave functions. The computed positron binding energy, work function, and annihilation characteristics reveal their sensitivity to charge transfer effects, atomic structure and chemical composition of the topmost layers of the surfaces. Theoretical positron annihilation probabilities with relevant core electrons computed for the oxidized Cu(100) surface and the As- and Ga-rich reconstructed GaAs(100) surfaces are compared with experimental ones estimated from the positron annihilation induced Auger peak intensities measured from these surfaces.

Flocculation of deformable emulsion droplets. 2: Interaction energy

DOE Office of Scientific and Technical Information (OSTI.GOV)

Petsev, D.N.; Denkov, N.D.; Kralchevsky, P.A.

1995-12-01

The effect of different factors (drop radius, interfacial tension, Hamaker constant, electrolyte, micellar concentrations, etc.) on the interaction energy of emulsion droplets is studied theoretically. It is demonstrated that the deformation of the colliding droplets considerably affects the interaction energy. The contributions of the electrostatic, van der Waals, depletion, steric, and oscillatory surface forces, as well as for the surface stretching and bending energies, are estimated and discussed. The calculations show that the droplets interact as nondeformed spheres when the attractive interactions are weak. At stronger attractions an equilibrium plane parallel film is formed between the droplets, corresponding to minimummore » interaction energy of the system. For droplets in concentrated micellar surfactant solutions the oscillatory surface forces become operative and one can observe several minima of the energy surface,each corresponding to a metastable state with a different number of micellar layers inside the film formed between the droplets. The present theoretical analysis can find applications in predicting the behavior and stability of miniemulsions (containing micrometer and submicrometer droplets), as well as in interpretation of data obtained by light scattering, phase behavior, rheological and osmotic pressure measurements, etc.« less

Combined valence bond-molecular mechanics potential-energy surface and direct dynamics study of rate constants and kinetic isotope effects for the H + C2H6 reaction.

PubMed

Chakraborty, Arindam; Zhao, Yan; Lin, Hai; Truhlar, Donald G

2006-01-28

This article presents a multifaceted study of the reaction H+C(2)H(6)-->H(2)+C(2)H(5) and three of its deuterium-substituted isotopologs. First we present high-level electronic structure calculations by the W1, G3SX, MCG3-MPWB, CBS-APNO, and MC-QCISD/3 methods that lead to a best estimate of the barrier height of 11.8+/-0.5 kcal/mol. Then we obtain a specific reaction parameter for the MPW density functional in order that it reproduces the best estimate of the barrier height; this yields the MPW54 functional. The MPW54 functional, as well as the MPW60 functional that was previously parametrized for the H+CH(4) reaction, is used with canonical variational theory with small-curvature tunneling to calculate the rate constants for all four ethane reactions from 200 to 2000 K. The final MPW54 calculations are based on curvilinear-coordinate generalized-normal-mode analysis along the reaction path, and they include scaled frequencies and an anharmonic C-C bond torsion. They agree with experiment within 31% for 467-826 K except for a 38% deviation at 748 K; the results for the isotopologs are predictions since these rate constants have never been measured. The kinetic isotope effects (KIEs) are analyzed to reveal the contributions from subsets of vibrational partition functions and from tunneling, which conspire to yield a nonmonotonic temperature dependence for one of the KIEs. The stationary points and reaction-path potential of the MPW54 potential-energy surface are then used to parametrize a new kind of analytical potential-energy surface that combines a semiempirical valence bond formalism for the reactive part of the molecule with a standard molecular mechanics force field for the rest; this may be considered to be either an extension of molecular mechanics to treat a reactive potential-energy surface or a new kind of combined quantum-mechanical/molecular mechanical (QM/MM) method in which the QM part is semiempirical valence bond theory; that is, the new potential-energy surface is a combined valence bond molecular mechanics (CVBMM) surface. Rate constants calculated with the CVBMM surface agree with the MPW54 rate constants within 12% for 534-2000 K and within 23% for 200-491 K. The full CVBMM potential-energy surface is now available for use in variety of dynamics calculations, and it provides a prototype for developing CVBMM potential-energy surfaces for other reactions.

Adsorption of the astatine species on a gold surface: A relativistic density functional theory study

NASA Astrophysics Data System (ADS)

Demidov, Yuriy; Zaitsevskii, Andréi

2018-01-01

We report first-principle based studies of the adsorption interaction of astatine species on a gold surface. These studies are aimed primarily at the support and interpretation of gas chromatographic experiments with superheavy elements, tennessine (Ts, Z = 117), a heavier homologue of At, and possibly its pseudo-homologue nihonium (Nh, Z = 113). We use gold clusters with up to 69 atoms to simulate the adsorption sites and estimate the desorption energies of At & AtOH from a stable gold (1 1 1) surface. To describe the electronic structure of At -Aun and AtOH -Aun complexes, we combine accurate shape-consistent relativistic pseudopotentials and non-collinear two-component relativistic density functional theory. The predicted desorption energies of At and AtOH on gold are 130 ± 10 kJ/mol and 90 ± 10 kJ/mol, respectively. These results confirm the validity of the estimates derived from chromatographic data (147 ± 15 kJ/mol for At, and 100-10+20 kJ/mol for AtOH).

An estimation method for echo signal energy of pipe inner surface longitudinal crack detection by 2-D energy coefficients integration

NASA Astrophysics Data System (ADS)

Zhou, Shiyuan; Sun, Haoyu; Xu, Chunguang; Cao, Xiandong; Cui, Liming; Xiao, Dingguo

2015-03-01

The echo signal energy is directly affected by the incident sound beam eccentricity or angle for thick-walled pipes inner longitudinal cracks detection. A method for analyzing the relationship between echo signal energy between the values of incident eccentricity is brought forward, which can be used to estimate echo signal energy when testing inside wall longitudinal crack of pipe, using mode-transformed compression wave adaptation of shear wave with water-immersion method, by making a two-dimension integration of "energy coefficient" in both circumferential and axial directions. The calculation model is founded for cylinder sound beam case, in which the refraction and reflection energy coefficients of different rays in the whole sound beam are considered different. The echo signal energy is calculated for a particular cylinder sound beam testing different pipes: a beam with a diameter of 0.5 inch (12.7mm) testing a φ279.4mm pipe and a φ79.4mm one. As a comparison, both the results of two-dimension integration and one-dimension (circumferential direction) integration are listed, and only the former agrees well with experimental results. The estimation method proves to be valid and shows that the usual method of simplifying the sound beam as a single ray for estimating echo signal energy and choosing optimal incident eccentricity is not so appropriate.

Protein-ligand binding free energy estimation using molecular mechanics and continuum electrostatics. Application to HIV-1 protease inhibitors

NASA Astrophysics Data System (ADS)

Zoete, V.; Michielin, O.; Karplus, M.

2003-12-01

A method is proposed for the estimation of absolute binding free energy of interaction between proteins and ligands. Conformational sampling of the protein-ligand complex is performed by molecular dynamics (MD) in vacuo and the solvent effect is calculated a posteriori by solving the Poisson or the Poisson-Boltzmann equation for selected frames of the trajectory. The binding free energy is written as a linear combination of the buried surface upon complexation, SAS bur, the electrostatic interaction energy between the ligand and the protein, Eelec, and the difference of the solvation free energies of the complex and the isolated ligand and protein, ΔGsolv. The method uses the buried surface upon complexation to account for the non-polar contribution to the binding free energy because it is less sensitive to the details of the structure than the van der Waals interaction energy. The parameters of the method are developed for a training set of 16 HIV-1 protease-inhibitor complexes of known 3D structure. A correlation coefficient of 0.91 was obtained with an unsigned mean error of 0.8 kcal/mol. When applied to a set of 25 HIV-1 protease-inhibitor complexes of unknown 3D structures, the method provides a satisfactory correlation between the calculated binding free energy and the experimental pIC 50 without reparametrization.

Evaporation estimation of rift valley lakes: comparison of models.

PubMed

Melesse, Assefa M; Abtew, Wossenu; Dessalegne, Tibebe

2009-01-01

Evapotranspiration (ET) accounts for a substantial amount of the water flux in the arid and semi-arid regions of the World. Accurate estimation of ET has been a challenge for hydrologists, mainly because of the spatiotemporal variability of the environmental and physical parameters governing the latent heat flux. In addition, most available ET models depend on intensive meteorological information for ET estimation. Such data are not available at the desired spatial and temporal scales in less developed and remote parts of the world. This limitation has necessitated the development of simple models that are less data intensive and provide ET estimates with acceptable level of accuracy. Remote sensing approach can also be applied to large areas where meteorological data are not available and field scale data collection is costly, time consuming and difficult. In areas like the Rift Valley regions of Ethiopia, the applicability of the Simple Method (Abtew Method) of lake evaporation estimation and surface energy balance approach using remote sensing was studied. The Simple Method and a remote sensing-based lake evaporation estimates were compared to the Penman, Energy balance, Pan, Radiation and Complementary Relationship Lake Evaporation (CRLE) methods applied in the region. Results indicate a good correspondence of the models outputs to that of the above methods. Comparison of the 1986 and 2000 monthly lake ET from the Landsat images to the Simple and Penman Methods show that the remote sensing and surface energy balance approach is promising for large scale applications to understand the spatial variation of the latent heat flux.

Impact of hydrogeological and geomechanical properties on surface uplift at a CO2 injection site: Parameter estimation and uncertainty quantification

NASA Astrophysics Data System (ADS)

Newell, P.; Yoon, H.; Martinez, M. J.; Bishop, J. E.; Arnold, B. W.; Bryant, S.

2013-12-01

It is essential to couple multiphase flow and geomechanical response in order to predict a consequence of geological storage of CO2. In this study, we estimate key hydrogeologic features to govern the geomechanical response (i.e., surface uplift) at a large-scale CO2 injection project at In Salah, Algeria using the Sierra Toolkit - a multi-physics simulation code developed at Sandia National Laboratories. Importantly, a jointed rock model is used to study the effect of postulated fractures in the injection zone on the surface uplift. The In Salah Gas Project includes an industrial-scale demonstration of CO2 storage in an active gas field where CO2 from natural gas production is being re-injected into a brine-filled portion of the structure downdip of the gas accumulation. The observed data include millimeter scale surface deformations (e.g., uplift) reported in the literature and injection well locations and rate histories provided by the operators. Our preliminary results show that the intrinsic permeability and Biot coefficient of the injection zone are important. Moreover pre-existing fractures within the injection zone affect the uplift significantly. Estimation of additional (i.e., anisotropy ratio) and coupled parameters will help us to develop models, which account for the complex relationship between mechanical integrity and CO2 injection-induced pressure changes. Uncertainty quantification of model predictions will be also performed using various algorithms including null-space Monte Carlo and polynomial-chaos expansion methods. This work will highlight that our coupled reservoir and geomechanical simulations associated with parameter estimation can provide a practical solution for designing operating conditions and understanding subsurface processes associated with the CO2 injection. This work is supported as part of the Center for Frontiers of Subsurface Energy Security, an Energy Frontier Research Center funded by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences under Award Number DE-SC0001114. Sandia National Laboratories is a multi-program laboratory managed and operated by Sandia Corporation, a wholly owned subsidiary of Lockheed Martin Corporation, for the U.S. Department of Energy's National Nuclear Security Administration under contract DE-AC04-94AL85000.

The Global Energy Balance Archive (GEBA): A database for the worldwide measured surface energy fluxes

NASA Astrophysics Data System (ADS)

Wild, Martin; Ohmura, Atsumu; Schär, Christoph; Müller, Guido; Hakuba, Maria Z.; Mystakidis, Stefanos; Arsenovic, Pavle; Sanchez-Lorenzo, Arturo

2017-02-01

The Global Energy Balance Archive (GEBA) is a database for the worldwide measured energy fluxes at the Earth's surface. GEBA is maintained at ETH Zurich (Switzerland) and has been founded in the 1980s by Prof. Atsumu Ohmura. It has continuously been updated and currently contains around 2500 stations with 500`000 monthly mean entries of various surface energy balance components. Many of the records extend over several decades. The most widely measured quantity available in GEBA is the solar radiation incident at the Earth's surface ("global radiation"). The data sources include, in addition to the World Radiation Data Centre (WRDC) in St. Petersburg, data reports from National Weather Services, data from different research networks (BSRN, ARM, SURFRAD), data published in peer-reviewed publications and data obtained through personal communications. Different quality checks are applied to check for gross errors in the dataset. GEBA is used in various research applications, such as for the quantification of the global energy balance and its spatiotemporal variation, or for the estimation of long-term trends in the surface fluxes, which enabled the detection of multi-decadal variations in surface solar radiation, known as "global dimming" and "brightening". GEBA is further extensively used for the evaluation of climate models and satellite-derived surface flux products. On a more applied level, GEBA provides the basis for engineering applications in the context of solar power generation, water management, agricultural production and tourism. GEBA is publicly accessible over the internet via www.geba.ethz.ch.

Hartree-Fock theory of the inhomogeneous electron gas at a jellium metal surface: Rigorous upper bounds to the surface energy and accurate work functions

NASA Astrophysics Data System (ADS)

Sahni, V.; Ma, C. Q.

1980-12-01

The inhomogeneous electron gas at a jellium metal surface is studied in the Hartree-Fock approximation by Kohn-Sham density functional theory. Rigorous upper bounds to the surface energy are derived by application of the Rayleigh-Ritz variational principle for the energy, the surface kinetic, electrostatic, and nonlocal exchange energy functionals being determined exactly for the accurate linear-potential model electronic wave functions. The densities obtained by the energy minimization constraint are then employed to determine work-function results via the variationally accurate "displaced-profile change-in-self-consistent-field" expression. The theoretical basis of this non-self-consistent procedure and its demonstrated accuracy for the fully correlated system (as treated within the local-density approximation for exchange and correlation) leads us to conclude these results for the surface energies and work functions to be essentially exact. Work-function values are also determined by the Koopmans'-theorem expression, both for these densities as well as for those obtained by satisfaction of the constraint set on the electrostatic potential by the Budd-Vannimenus theorem. The use of the Hartree-Fock results in the accurate estimation of correlation-effect contributions to these surface properties of the nonuniform electron gas is also indicated. In addition, the original work and approximations made by Bardeen in this attempt at a solution of the Hartree-Fock problem are briefly reviewed in order to contrast with the present work.

Uncertainties in estimates of fAPAR for photosynthesis (fAPARPSN) in tropical, Arctic/boreal, coastal, and wetland-dominant regions when approximated with fAPARcanopy and NDVI

NASA Astrophysics Data System (ADS)

Zhang, Q.; Yao, T.

2016-12-01

The climate is affected by the land surface through regulating the exchange of mass and energy with the atmosphere. The energy that reaches the land surface has three pathways: (1) reflected into atmosphere; (2) absorbed for photosynthesis; and (3) discarded as latent and sensible heat or emitted as fluorescence. Vegetation removes CO2 from the atmosphere during the process of photosynthesis, but also releases CO2 back into the atmosphere through the process of respiration. The complex set of vegetation-soil-atmosphere interactions requires that a realistic land-surface parameterization be included in any climate model or general circulation model (GCM) to accurately simulate canopy photosynthesis and stomatal conductance.We retrieve fraction of PAR absorbed by chlorophyll (fAPARchl) with an advanced canopy-leaf-soil-snow-water coupled radiative transfer model. Most ecological models and land-surface models that simulate vegetation GPP with remote sensing data utilize fraction of PAR absorbed by the whole canopy (fAPARcanopy). However, only the PAR absorbed by chlorophyll is potentially available for photosynthesis since the PAR absorbed by non-photosynthetic vegetation section (NPV) of the canopy is not used for photosynthesis. Therefore, fAPARchl (rather than fAPARcanopy) should be utilized to estimate fAPAR for photosynthesis (fAPARPSN), and thus in GPP simulation. Globally selected sites include those sites in tropical, Arctic/boreal, coastal, and wetland-dominant regions. The fAPARchl and fAPARcanopy products for a surrounding area 50 km x 50 km of each site are mapped. The fAPARchl is utilized to estimate GPP, and compared to tower flux GPP for validation. The GPP estimation performance with fAPARchl is also compared with the GPP estimation performance with MOD15A2 FPAR. The fAPARchl product is further implemented into ecological models and land-surface models to simulate vegetation GPP. NDVI is the other proxy of fAPARPSN in GPP estimation. We quantify the uncertainties in estimates of fAPARPSN when approximated with fAPARcanopy and NDVI. The uncertainties are significant and vary spatially, temporally, and with plant functional types.

Near-Surface Meteorology During the Arctic Summer Cloud Ocean Study (ASCOS): Evaluation of Reanalyses and Global Climate Models.

NASA Technical Reports Server (NTRS)

De Boer, G.; Shupe, M.D.; Caldwell, P.M.; Bauer, Susanne E.; Persson, O.; Boyle, J.S.; Kelley, M.; Klein, S.A.; Tjernstrom, M.

2014-01-01

Atmospheric measurements from the Arctic Summer Cloud Ocean Study (ASCOS) are used to evaluate the performance of three atmospheric reanalyses (European Centre for Medium Range Weather Forecasting (ECMWF)- Interim reanalysis, National Center for Environmental Prediction (NCEP)-National Center for Atmospheric Research (NCAR) reanalysis, and NCEP-DOE (Department of Energy) reanalysis) and two global climate models (CAM5 (Community Atmosphere Model 5) and NASA GISS (Goddard Institute for Space Studies) ModelE2) in simulation of the high Arctic environment. Quantities analyzed include near surface meteorological variables such as temperature, pressure, humidity and winds, surface-based estimates of cloud and precipitation properties, the surface energy budget, and lower atmospheric temperature structure. In general, the models perform well in simulating large-scale dynamical quantities such as pressure and winds. Near-surface temperature and lower atmospheric stability, along with surface energy budget terms, are not as well represented due largely to errors in simulation of cloud occurrence, phase and altitude. Additionally, a development version of CAM5, which features improved handling of cloud macro physics, has demonstrated to improve simulation of cloud properties and liquid water amount. The ASCOS period additionally provides an excellent example of the benefits gained by evaluating individual budget terms, rather than simply evaluating the net end product, with large compensating errors between individual surface energy budget terms that result in the best net energy budget.

New Display-type Analyzer for Three-dimensional Fermi Surface Mapping and Atomic Orbital Analysis

DOE Office of Scientific and Technical Information (OSTI.GOV)

Takahashi, Nobuaki; Matsuda, Hiroyuki; Shigenai, Shin

2007-01-19

We have developed and installed a new Display-type ANAlyzer (DIANA) at Ritsumeikan SR center BL-7. We measured the angle-integrated energy distribution curve of poly-crystal gold and the photoelectron intensity angular distribution (PIAD) of HOPG to estimate the total energy resolution and to check the condition of the analyzer. The total energy resolution ({delta}E/E) is up to 0.78%, which is much higher than the old type. The PIAD of HOPG we obtained was the ring pattern as expected. Therefore, a detailed three-dimensional Fermi surface mapping and an analysis of the atomic orbitals constituting the electron energy bands are possible by combiningmore » them with a linearly polarized synchrotron radiation.« less

Estimating envelope thermal characteristics from single point in time thermal images

NASA Astrophysics Data System (ADS)

Alshatshati, Salahaldin Faraj

Energy efficiency programs implemented nationally in the U.S. by utilities have rendered savings which have cost on average 0.03/kWh. This cost is still well below generation costs. However, as the lowest cost energy efficiency measures are adopted, this the cost effectiveness of further investment declines. Thus there is a need to more effectively find the most opportunities for savings regionally and nationally, so that the greatest cost effectiveness in implementing energy efficiency can be achieved. Integral to this process. are at scale energy audits. However, on-site building energy audits process are expensive, in the range of US1.29/m2-$5.37/m2 and there are an insufficient number of professionals to perform the audits. Energy audits that can be conducted at-scale and at low cost are needed. Research is presented that addresses at community-wide scales characterization of building envelope thermal characteristics via drive-by and fly-over GPS linked thermal imaging. A central question drives this research: Can single point-in-time thermal images be used to infer U-values and thermal capacitances of walls and roofs? Previous efforts to use thermal images to estimate U-values have been limited to rare steady exterior weather conditions. The approaches posed here are based upon the development two models first is a dynamic model of a building envelope component with unknown U-value and thermal capacitance. The weather conditions prior to the thermal image are used as inputs to the model. The model is solved to determine the exterior surface temperature, ultimately predicted the temperature at the thermal measurement time. The model U-value and thermal capacitance are tuned in order to force the error between the predicted surface temperature and the measured surface temperature from thermal imaging to be near zero. This model is developed simply to show that such a model cannot be relied upon to accurately estimate the U-value. The second is a data-based methodology. This approach integrates the exterior surface temperature measurements, historical utility data, and easily accessible or potentially easily accessible housing data. A Random Forest model is developed from a training subset of residences for which the envelope U-value is known. This model is used to predict the envelope U-value for a validation set of houses with unknown U-value. Demonstrated is an ability to estimate the wall/roof U-value with an R-squared value in the range of 0.97 and 0.96 respectively, using as few as 9 and 24 training houses for respectively wall and ceiling U-value estimation. The implication of this research is significant, offering the possibility of auditing residences remotely at-scale via aerial and drive-by thermal imaging.

Assessment of the water and energy budget simulation of three land surface models: CLM4.5, CoLM2014, and CoLM2005

NASA Astrophysics Data System (ADS)

Li, C.; Lu, H.; Wen, X.

2015-12-01

Land surface model (LSM), which simulates energy, water and momentum exchanges between land and atmosphere, is an important component of Earth System Models (ESM). As shown in CMIP5, different ESMs usually use different LSMs and represent various land surface status. In order to select a land surface model which could be embedded into the ESM developed in Tsinghua University, we firstly evaluate the performance of three LSMs: Community Land Model (CLM4.5) and two different versions of Common Land Model (CoLM2005 and CoLM2014). All of three models were driven by CRUNCEP data and simulation results from 1980 to 2010 were used in this study. Diagnostic data provided by NCAR, global latent and sensible heat flux map estimated by Jung, net radiation from SRB, and in situ observation collected from FluxNet were used as reference data. Two variables, surface runoff and snow depth, were used for evaluating the model performance in water budget simulation, while three variables including net radiation, sensible heat, and latent heat were used for assessing energy budget simulation. For 30 years averaged runoff, global average value of Colm2014 is 0.44mm/day and close to the diagnostic value of 0.75 mm/day, while that of Colm2005 is 0.44mm/day and that of CLM is 0.20mm/day. For snow depth simulation, three models all have overestimation in the Northern Hemisphere and underestimation in the Southern Hemisphere compare to diagnostic data. For 30 years energy budget simulation, at global scale, CoLM2005 performs best in latent heat estimation, CoLM2014 performs best in sensible heat simulation, and CoLM2005 and CoLM2014 make similar performance in net radiation estimation but is still better than CLM. At regional and local scale, comparing to the four years average of flux tower observation, RMSE of CoLM2005 is the smallest for latent heat (9.717 W/m2) , and for sensible heat simulation, RMSE of CoLM2005 (13.048 W/m2) is slightly greater than CLM(10.767 W/m2) but still better than CoLM2014(30.085 W/m2). Our analysis shows that both CoLM 2005 and CoLM 2014 are able to reproduce comparable land surface water and energy fluxes. It implies that the ESM developed in Tsinghua University may use CoLM, a LSM developed and maintained in China, as the land surface component. .

Micrometeoroid Impacts and Optical Scatter in Space Environment

NASA Technical Reports Server (NTRS)

Heaney, James B.; Wang, Liqin L.; He, Charles C.

2010-01-01

This paper discusses the results of an attempt to use laboratory test data and empirically derived models to quantify the degree of surface damage and associated light scattering that might be expected from hypervelocity particle impacts in space environment. Published descriptions of the interplanetary dust environment were used as the sources of particle mass, size, and velocity estimates. Micrometeoroid sizes are predicted to be predominantly in the mass range 10(exp -5) g or less, with most having diameters near 1 micrometer, but some larger than I20 micrometers, with velocities near 20 kilometers per second. In a laboratory test, latex ( p = 1.1. grams per cubic centimeter) and iron (7.9 grams per cubic centimeter) particles with diameters ranging from 0.75 micrometers to 1.60 micrometers and with velocities ranging from 2.0 kilometers per second to 18.5 kilometers per second, were shot at a Be substrate mirror that had a dielectric coated gold reflecting surface. Scanning electron and atomic force microscopy were used to measure crater dimensions that were then associated with particle impact energies. These data were then fitted to empirical models derived from solar cell and other spacecraft surface components returned from orbit, as well as studies of impact craters studied on glassy materials returned from the lunar surface, to establish a link between particle energy and impact crater dimension. From these data, an estimate of total expected damaged area was computed and this result produced an estimate of expected surface scatter from the modeled environment.

Symmetry Energy and Its Components in Finite Nuclei

NASA Astrophysics Data System (ADS)

Antonov, A. N.; Gaidarov, M. K.; Kadrev, D. N.; Sarriguren, P.; Moya de Guerra, E.

2018-05-01

We derive the volume and surface components of the nuclear symmetry energy (NSE) and their ratio within the coherent density fluctuation model. The estimations use the results of the model for the NSE in finite nuclei based on the Brueckner and Skyrme energy-density functionals for nuclear matter. The obtained values of the volume and surface contributions to the NSE and their ratio for the Ni, Sn, and Pb isotopic chains are compared with estimations of other approaches which have used available experimental data on binding energies, neutron-skin thicknesses, and excitation energies to isobaric analog states (IAS). Apart from the density dependence investigated in our previous works, we study also the temperature dependence of the symmetry energy in finite nuclei in the framework of the local density approximation combining it with the self-consistent Skyrme-HFB method using the cylindrical transformed deformed harmonic-oscillator basis. The results for the thermal evolution of the NSE in the interval T = 0–4 MeV show that its values decrease with temperature. The investigations of the T-dependence of the neutron and proton root-mean-square radii and the corresponding neutron skin thickness point out that the effect of temperature leads mainly to a substantial increase of the neutron radii and skins, especially in nuclei which are more rich of neutrons.

Estimating Evapotranspiration Of Orange Orchards Using Surface Renewal And Remote Sensing Techniques

NASA Astrophysics Data System (ADS)

Consoli, S.; Russo, A.; Snyder, R.

2006-08-01

Surface renewal (SR) analysis was utilized to calculate sensible heat flux density from high frequency temperature measurements above orange orchard canopies during 2005 in eastern Sicily (Italy). The H values were employed to estimate latent heat flux density (LE) using measured net radiation (Rn) and soil heat flux density (G) in the energy balance (EB) equation. Crop coefficients were determined by calculating the ratio Kc=ETa/ETo, with reference ETo derived from the daily Penman-Monteith equation. The estimated daily Kc values showed an average of about 0.75 for canopy covers having about 70% ground shading and 80% of PAR light interception. Remote sensing estimates of Kc and ET fluxes were compared with those measured by SR-EB. IKONOS satellite estimates of Kc and NDVI were linearly correlated for the orchard stands.

Comparison of methods for quantifying surface sublimation over seasonally snow-covered terrain

USGS Publications Warehouse

Sexstone, Graham A.; Clow, David W.; Stannard, David I.; Fassnacht, Steven R.

2016-01-01

Snow sublimation can be an important component of the snow-cover mass balance, and there is considerable interest in quantifying the role of this process within the water and energy balance of snow-covered regions. In recent years, robust eddy covariance (EC) instrumentation has been used to quantify snow sublimation over snow-covered surfaces in complex mountainous terrain. However, EC can be challenging for monitoring turbulent fluxes in snow-covered environments because of intensive data, power, and fetch requirements, and alternative methods of estimating snow sublimation are often relied upon. To evaluate the relative merits of methods for quantifying surface sublimation, fluxes calculated by the EC, Bowen ratio–energy balance (BR), bulk aerodynamic flux (BF), and aerodynamic profile (AP) methods and their associated uncertainty were compared at two forested openings in the Colorado Rocky Mountains. Biases between methods are evaluated over a range of environmental conditions, and limitations of each method are discussed. Mean surface sublimation rates from both sites ranged from 0.33 to 0.36 mm day−1, 0.14 to 0.37 mm day−1, 0.10 to 0.17 mm day−1, and 0.03 to 0.10 mm day−1 for the EC, BR, BF and AP methods, respectively. The EC and/or BF methods are concluded to be superior for estimating surface sublimation in snow-covered forested openings. The surface sublimation rates quantified in this study are generally smaller in magnitude compared with previously published studies in this region and help to refine sublimation estimates for forested openings in the Colorado Rocky Mountains.

Regional aerosol radiative and hydrological effects over the mid-Atlantic corridor

NASA Astrophysics Data System (ADS)

Creekmore, Torreon N.

A thorough assessment of direct, indirect, and semi-direct influences of aerosols on Earth's energy budget is required to better understand climate and estimate how it may change in the future. Clear-sky surface broadband (measured and modeled) irradiance, spectral aerosol optical depth, heating rate profiles, and non-radiative flux measurements were conducted at a state-of-the-art site, developed by the NOAA-Howard University Center for Atmospheric Sciences (NCAS) program, providing a best estimate of aerosol radiative atmosphere-surface interactions. Methods developed by the Department of Energy (DOE) Atmospheric Radiation Measurement (ARM) Program were applied to: (1) temporally quantify regional aerosol forcing, (2) to derive an empirical equation describing a relationship between aerosol optical depth and normalized diffuse ratio, (3) evaluate aerosol impacts on atmospheric heating, and (4) evaluate how aerosol forcing impacts may possibly reduce latent and sensible fluxes. Measurements were obtained during the period of May--September for the years of 2005, 2006, and 2007. Atmospheric aerosols are among the key uncertainties affecting the Earth's climate and atmospheric radiative processes. Present-day increases in aerosol concentrations directly, indirectly, and semi-directly impact the Earth's energy budget (i.e., cooling the surface and heating the atmosphere), thereby contributing to climate change. The Howard University Beltsville Site (HUBS) has experienced a greater loss in mean normalized aerosol radiative forcing with time, as observations show a decrease from --0.9 in 2005 to --3.1 and --3.4 W/m2 for 2006 and 2007 respectively, in mean net surface irradiance. The mean normalized aerosol radiative forcing estimated for the period considered was --2.5 W/m2. The reduction in surface solar insolation is due to increased scattering and absorption related to increased aerosol burdens v for the period, promoting surface cooling and atmospheric heating. Calculation of radiative flux and heating rates profiles, which are constrained by HUBS observations, were performed by the 1-D Fu-Liou radiative transfer model to investigate the effect of polluted and pristine aerosol conditions on the surface energy budget and hydrological cycle. For HUBS the surface forcing (--14.2 W/m2) and atmospheric forcing (9.9 W/m2) were significantly larger than the TOA (--4.3 W/m2) radiative forcing. Associated aerosol heating, as well as reduced surface insolation, may lead to increasing near surface static stability, and reduced vertical transport of moisture into the atmospheric boundary layer, and over time, a possible spin-down of the hydrological cycle. It is shown that HUBS provides an ideal opportunity for improving measurements and datasets, thus allowing for both the study and understanding of aerosol impacts on the climate system. Further, results show that in order to provide reference quality data and constrain aerosol radiative effects over land, ground-based research sites must conform to HUBS standards of: (1) instrumentation (e.g. passive and active sensors); (2) operational protocols (e.g. calibration and routine cleaning); (3) rigorous cloud screening protocols; and (4) incorporation of ARM QC and modified FFA algorithms. HUBS surface measurements provides the reference quality data necessary and capability required to help enhance measurements and constrain current uncertainties in estimates of aerosol direct effects over land. Incorporating a combined technique of both active and passive instruments reduced the direct radiative forcing estimates by ˜82 W/m2. The analysis of aerosol effects over HUBS helps continue in bridging the gap of applying measurements for improvement of climate simulations by generating observational products, which describes aerosol and radiation field characteristics in detail.

An Analysis of Stochastic Jovian Oscillation Excitation by Moist Convection

NASA Astrophysics Data System (ADS)

Dederick, Ethan; Jackiewicz, Jason; Guillot, Tristan

2018-03-01

Recent observations of Jupiter have suggested the existence of global oscillatory modes at millihertz frequencies, yet the source mechanism responsible for driving these modes is still unknown. However, the energies necessary to produce observable surface oscillations have been predicted. Here we investigate if moist convection in Jupiter’s upper atmosphere can be responsible for driving the global oscillations and what moist convective energy requirements are necessary to achieve these theoretical mode energies and surface amplitudes. We begin by creating a one-dimensional moist convective cloud model and find that the available kinetic energy of the rising cloud column falls below theoretical estimates of oscillation energies. That is, mode excitation cannot occur with a single storm eruption. We then explore stochastic excitation scenarios of the oscillations by moist convective storms. We find that mode energies and amplitudes can reach theoretical estimates if the storm energy available to the modes is more than just kinetic. In order for the modes to be excited, we find that they require 5 × 1027 to 1028 erg per day. However, even for a large storm eruption each day, the available kinetic energy from the storms falls two orders of magnitude short of the required driving energy. Although our models may oversimplify the true complexity of the coupling between Jovian storms and global oscillations, our findings reveal that enough thermal energy is associated with moist convection to drive the modes, should it be available to them.

Quantitative Estimation of Land Surface Characteristic Parameters and Actual Evapotranspiration in the Nagqu River Basin over the Tibetan Plateau

NASA Astrophysics Data System (ADS)

Zhong, L.; Ma, Y.; Ma, W.; Zou, M.; Hu, Y.

2016-12-01

Actual evapotranspiration (ETa) is an important component of the water cycle in the Tibetan Plateau. It is controlled by many hydrological and meteorological factors. Therefore, it is of great significance to estimate ETa accurately and continuously. It is also drawing much attention of scientific community to understand land surface parameters and land-atmosphere water exchange processes in small watershed-scale areas. Based on in-situ meteorological data in the Nagqu river basin and surrounding regions, the main meteorological factors affecting the evaporation process were quantitatively analyzed and the point-scale ETa estimation models in the study area were successfully built. On the other hand, multi-source satellite data (such as SPOT, MODIS, FY-2C) were used to derive the surface characteristics in the river basin. A time series processing technique was applied to remove cloud cover and reconstruct data series. Then improved land surface albedo, improved downward shortwave radiation flux and reconstructed normalized difference vegetation index (NDVI) were coupled into the topographical enhanced surface energy balance system to estimate ETa. The model-estimated results were compared with those ETa values determined by combinatory method. The results indicated that the model-estimated ETa agreed well with in-situ measurements with correlation coefficient, mean bias error and root mean square error of 0.836, 0.087 and 0.140 mm/h respectively.

Dissipation in the Baltic proper during winter stratification

NASA Astrophysics Data System (ADS)

Lass, Hans Ulrich; Prandke, Hartmut; Liljebladh, Bengt

2003-06-01

Profiles of dissipation rates and stratification between 10 and 120 m depth were measured with a loosely tethered profiler over a 9-day winter period in the Gotland Basin of the Baltic Sea. Supplementary measurements of current profiles were made with moored ADCPs. Temporal and spatial patterns of the stratification were observed by means of towed CTD. Shallow freshwater lenses in the surface mixed layer, mesoscale eddies, inertial oscillations, and inertial waves as part of the internal wave spectrum provided the marine physical environment for the small-scale turbulence. Two well-separated turbulence regimes were detected. The turbulence in the surface mixed layer was well correlated with the wind. The majority of the energy flux from the wind to the turbulent kinetic energy was dissipated within the surface mixed layer. A minor part of this flux was consumed by changes of the potential energy of the fresh water lenses. The penetration depth Hpen of the wind-driven turbulence into the weakly stratified surface mixed layer depended on the local wind speed (W10) as Hpen = cW103/2 Active erosion of the Baltic halocline by wind-driven turbulence is expected for wind speeds greater than 14 m/s. The turbulence in the strongly stratified interior of the water column was quite independent of the meteorological forcing at the sea surface. The integrated production of turbulent kinetic energy exceeded the energy loss of inertial oscillations in the surface layer suggesting additional energy sources which might have been provided by inertial wave radiation during geostrophic adjustment of coastal jets and mesoscale eddies. The averaged dissipation rate profile in the stratified part of the water column, best fitted by ɛ ∝ EN, was different from the scaling of the dissipation in the thermocline of the ocean [, 1986]. The diapycnical mixing coefficient (Kv) was best fit by Kv = a0/N according to [1987] with a0 ≈ 0.87 × 10-7 m2/s2. The diapycnal diffusivity estimated from the dissipation rate was lower than those estimated by the bulk method.

On Averaging Timescales for the Surface Energy Budget Closure Problem

NASA Astrophysics Data System (ADS)

Grachev, A. A.; Fairall, C. W.; Persson, O. P. G.; Uttal, T.; Blomquist, B.; McCaffrey, K.

2017-12-01

An accurate determination of the surface energy budget (SEB) and all SEB components at the air-surface interface is of obvious relevance for the numerical modelling of the coupled atmosphere-land/ocean/snow system over different spatial and temporal scales, including climate modelling, weather forecasting, environmental impact studies, and many other applications. This study analyzes and discusses comprehensive measurements of the SEB and the surface energy fluxes (turbulent, radiative, and ground heat) made over different underlying surfaces based on the data collected during several field campaigns. Hourly-averaged, multiyear data sets collected at two terrestrial long-term research observatories located near the coast of the Arctic Ocean at Eureka (Canadian Archipelago) and Tiksi (East Siberia) and half-hourly averaged fluxes collected during a year-long field campaign (Wind Forecast Improvement Project 2, WFIP 2) at the Columbia River Gorge (Oregon) in areas of complex terrain. Our direct measurements of energy balance show that the sum of the turbulent sensible and latent heat fluxes systematically underestimate the available energy at half-hourly and hourly time scales by around 20-30% at these sites. This imbalance of the surface energy budget is comparable to other terrestrial sites. Surface energy balance closure is a formulation of the conservation of energy principle (the first law of thermodynamics). The lack of energy balance closure at hourly time scales is a fundamental and pervasive problem in micrometeorology and may be caused by inaccurate estimates of the energy storage terms in soils, air and biomass in the layer below the measurement height and above the heat flux plates. However, the residual energy imbalance is significantly reduced at daily and monthly timescales. Increasing the averaging time to daily scales substantially reduces the storage terms because energy locally entering the soil, air column, and vegetation in the morning is released in the afternoon and evening.

Characterization of the interface between cellulosic fibers and a thermoplastic matrix

Treesearch

Feipeng P. Liu; Michael P. Wolcott; Douglas J. Gardner; Timothy G. Rials

1994-01-01

The applicability of the microbond test to evaluate the interfacial properties between cellulosic fibers and thermoplastics was studied. Acetylation and beat treatment were applied to modify the surface of cellulosic fibers (rayon, cotton, and wood). The apparent diameters and surface free energies of the fibers were estimated by dynamic contact angle (DCA) analysis....

Retrieval of an available water-based soil moisture proxy from thermal infrared remote sensing. Part I: Methodology and validation

USDA-ARS?s Scientific Manuscript database

A retrieval of soil moisture is proposed using surface flux estimates from satellite-based thermal infrared (TIR) imagery and the Atmosphere-Land-Exchange-Inversion (ALEXI) model. The ability of ALEXI to provide valuable information about the partitioning of the surface energy budget, which can be l...

Remote Sensing of Evapotranspiration and Carbon Uptake at Harvard Forest

NASA Technical Reports Server (NTRS)

Min, Qilong; Lin, Bing

2005-01-01

A land surface vegetation index, defined as the difference of microwave land surface emissivity at 19 and 37 GHz, was calculated for a heavily forested area in north central Massachusetts. The microwave emissivity difference vegetation index (EDVI) was estimated from satellite SSM/I measurements at the defined wavelengths and used to estimate land surface turbulent fluxes. Narrowband visible and infrared measurements and broadband solar radiation observations were used in the EDVI retrievals and turbulent flux estimations. The EDVI values represent physical properties of crown vegetation such as vegetation water content of crown canopies. The collocated land surface turbulent and radiative fluxes were empirically linked together by the EDVI values. The EDVI values are statistically sensitive to evapotranspiration fractions (EF) with a correlation coefficient (R) greater than 0.79 under all-sky conditions. For clear skies, EDVI estimates exhibit a stronger relationship with EF than normalized difference vegetation index (NDVI). Furthermore, the products of EDVI and input energy (solar and photosynthetically-active radiation) are statistically significantly correlated to evapotranspiration (R=0.95) and CO2 uptake flux (R=0.74), respectively.

Linking soil type and rainfall characteristics towards estimation of surface evaporative capacitance

NASA Astrophysics Data System (ADS)

Or, D.; Bickel, S.; Lehmann, P.

2017-12-01

Separation of evapotranspiration (ET) to evaporation (E) and transpiration (T) components for attribution of surface fluxes or for assessment of isotope fractionation in groundwater remains a challenge. Regional estimates of soil evaporation often rely on plant-based (Penman-Monteith) ET estimates where is E is obtained as a residual or a fraction of potential evaporation. We propose a novel method for estimating E from soil-specific properties, regional rainfall characteristics and considering concurrent internal drainage that shelters soil water from evaporation. A soil-dependent evaporative characteristic length defines a depth below which soil water cannot be pulled to the surface by capillarity; this depth determines the maximal soil evaporative capacitance (SEC). The SEC is recharged by rainfall and subsequently emptied by competition between drainage and surface evaporation (considering canopy interception evaporation). We show that E is strongly dependent on rainfall characteristics (mean annual, number of storms) and soil textural type, with up to 50% of rainfall lost to evaporation in loamy soil. The SEC concept applied to different soil types and climatic regions offers direct bounds on regional surface evaporation independent of plant-based parameterization or energy balance calculations.

Active surface model improvement by energy function optimization for 3D segmentation.

PubMed

Azimifar, Zohreh; Mohaddesi, Mahsa

2015-04-01

This paper proposes an optimized and efficient active surface model by improving the energy functions, searching method, neighborhood definition and resampling criterion. Extracting an accurate surface of the desired object from a number of 3D images using active surface and deformable models plays an important role in computer vision especially medical image processing. Different powerful segmentation algorithms have been suggested to address the limitations associated with the model initialization, poor convergence to surface concavities and slow convergence rate. This paper proposes a method to improve one of the strongest and recent segmentation algorithms, namely the Decoupled Active Surface (DAS) method. We consider a gradient of wavelet edge extracted image and local phase coherence as external energy to extract more information from images and we use curvature integral as internal energy to focus on high curvature region extraction. Similarly, we use resampling of points and a line search for point selection to improve the accuracy of the algorithm. We further employ an estimation of the desired object as an initialization for the active surface model. A number of tests and experiments have been done and the results show the improvements with regards to the extracted surface accuracy and computational time of the presented algorithm compared with the best and recent active surface models. Copyright © 2015 Elsevier Ltd. All rights reserved.

Arsia Mons Spiral Cloud

NASA Image and Video Library

2002-02-16

This global map of Mars, based on data from NASA Mars Odyssey, shows estimates for amounts of high-energy-particle cosmic radiation reaching the surface, a serious health concern for any future human exploration of the planet.

An energy balance model for forest canopies: a case study

Treesearch

S. M. Goltz; James A. Smith

1996-01-01

The use of thermal scanning devices to map underlying terrain surface temperatures has been recognized as a potential tool for estimating evapotranspiration and latent heat flux densities in forest canopies.

Benefits estimation framework for automated vehicle operations.

DOT National Transportation Integrated Search

2015-08-01

Automated vehicles have the potential to bring about transformative safety, mobility, energy, and environmental benefits to the surface transportation system. They are also being introduced into a complex transportation system, where second-order imp...

Free energy barriers for escape of water molecules from protein hydration layer.

PubMed

Roy, Susmita; Bagchi, Biman

2012-03-08

Free energy barriers separating interfacial water molecules from the hydration layer at the surface of a protein to the bulk are obtained by using the umbrella sampling method of free energy calculation. We consider hydration layer of chicken villin head piece (HP-36) which has been studied extensively by molecular dynamics simulations. The free energy calculations reveal a strong sensitivity to the secondary structure. In particular, we find a region near the junction of first and second helix that contains a cluster of water molecules which are slow in motion, characterized by long residence times (of the order of 100 ps or more) and separated by a large free energy barrier from the bulk water. However, these "slow" water molecules constitute only about 5-10% of the total number of hydration layer water molecules. Nevertheless, they play an important role in stabilizing the protein conformation. Water molecules near the third helix (which is the important helix for biological function) are enthalpically least stable and exhibit the fastest dynamics. Interestingly, barrier height distributions of interfacial water are quite broad for water surrounding all the three helices (and the three coils), with the smallest barriers found for those near the helix-3. For the quasi-bound water molecules near the first and second helices, we use well-known Kramers' theory to estimate the residence time from the free energy surface, by estimating the friction along the reaction coordinate from the diffusion coefficient by using Einstein relation. The agreement found is satisfactory. We discuss the possible biological function of these slow, quasi-bound (but transient) water molecules on the surface.

Protein surface roughness accounts for binding free energy of Plasmepsin II-ligand complexes.

PubMed

Valdés-Tresanco, Mario E; Valdés-Tresanco, Mario S; Valiente, Pedro A; Cocho, Germinal; Mansilla, Ricardo; Nieto-Villar, J M

2018-01-01

The calculation of absolute binding affinities for protein-inhibitor complexes remains as one of the main challenges in computational structure-based ligand design. The present work explored the calculations of surface fractal dimension (as a measure of surface roughness) and the relationship with experimental binding free energies of Plasmepsin II complexes. Plasmepsin II is an attractive target for novel therapeutic compounds to treat malaria. However, the structural flexibility of this enzyme is a drawback when searching for specific inhibitors. Concerning that, we performed separate explicitly solvated molecular dynamics simulations using the available high-resolution crystal structures of different Plasmepsin II complexes. Molecular dynamics simulations allowed a better approximation to systems dynamics and, therefore, a more reliable estimation of surface roughness. This constitutes a novel approximation in order to obtain more realistic values of fractal dimension, because previous works considered only x-ray structures. Binding site fractal dimension was calculated considering the ensemble of structures generated at different simulation times. A linear relationship between binding site fractal dimension and experimental binding free energies of the complexes was observed within 20 ns. Previous studies of the subject did not uncover this relationship. Regression model, coined FD model, was built to estimate binding free energies from binding site fractal dimension values. Leave-one-out cross-validation showed that our model reproduced accurately the absolute binding free energies for our training set (R 2  = 0.76; <|error|> =0.55 kcal/mol; SD error  = 0.19 kcal/mol). The fact that such a simple model may be applied raises some questions that are addressed in the article. Copyright © 2017 John Wiley & Sons, Ltd.

Effect of Groove Surface Texture on Tribological Characteristics and Energy Consumption under High Temperature Friction.

PubMed

Wu, Wei; Chen, Guiming; Fan, Boxuan; Liu, Jianyou

2016-01-01

Energy consumption and tribological properties could be improved by proper design of surface texture in friction. However, some literature focused on investigating their performance under high temperature. In the study, different groove surface textures were fabricated on steels by a laser machine, and their tribological behaviors were experimentally studied with the employment of the friction and wear tester under distinct high temperature and other working conditions. The friction coefficient was recorded, and wear performance were characterized by double light interference microscope, scanning electron microscope (SEM) and x-ray energy dispersive spectrometry (EDS). Then, the performances of energy consumptions were carefully estimated. Results showed that friction coefficient, wear, and energy consumption could almost all be reduced by most textures under high temperature conditions, but to a different extent which depends on the experimental conditions and texture parameters. The main improvement mechanisms were analyzed, such as the hardness change, wear debris storage, thermal stress release and friction induced temperature reduction by the textures. Finally, a scattergram of the relatively reduced ratio of the energy consumption was drawn for different surface textures under four distinctive experimental conditions to illustrate the comprehensive energy consumption improving ability of textures, which was of benefit for the application of texture design.

Effect of Groove Surface Texture on Tribological Characteristics and Energy Consumption under High Temperature Friction

PubMed Central

Wu, Wei; Chen, Guiming; Fan, Boxuan; Liu, Jianyou

2016-01-01

Energy consumption and tribological properties could be improved by proper design of surface texture in friction. However, some literature focused on investigating their performance under high temperature. In the study, different groove surface textures were fabricated on steels by a laser machine, and their tribological behaviors were experimentally studied with the employment of the friction and wear tester under distinct high temperature and other working conditions. The friction coefficient was recorded, and wear performance were characterized by double light interference microscope, scanning electron microscope (SEM) and x-ray energy dispersive spectrometry (EDS). Then, the performances of energy consumptions were carefully estimated. Results showed that friction coefficient, wear, and energy consumption could almost all be reduced by most textures under high temperature conditions, but to a different extent which depends on the experimental conditions and texture parameters. The main improvement mechanisms were analyzed, such as the hardness change, wear debris storage, thermal stress release and friction induced temperature reduction by the textures. Finally, a scattergram of the relatively reduced ratio of the energy consumption was drawn for different surface textures under four distinctive experimental conditions to illustrate the comprehensive energy consumption improving ability of textures, which was of benefit for the application of texture design. PMID:27035658

Interpolating moving least-squares methods for fitting potential energy surfaces: using classical trajectories to explore configuration space.

PubMed

Dawes, Richard; Passalacqua, Alessio; Wagner, Albert F; Sewell, Thomas D; Minkoff, Michael; Thompson, Donald L

2009-04-14

We develop two approaches for growing a fitted potential energy surface (PES) by the interpolating moving least-squares (IMLS) technique using classical trajectories. We illustrate both approaches by calculating nitrous acid (HONO) cis-->trans isomerization trajectories under the control of ab initio forces from low-level HF/cc-pVDZ electronic structure calculations. In this illustrative example, as few as 300 ab initio energy/gradient calculations are required to converge the isomerization rate constant at a fixed energy to approximately 10%. Neither approach requires any preliminary electronic structure calculations or initial approximate representation of the PES (beyond information required for trajectory initial conditions). Hessians are not required. Both approaches rely on the fitting error estimation properties of IMLS fits. The first approach, called IMLS-accelerated direct dynamics, propagates individual trajectories directly with no preliminary exploratory trajectories. The PES is grown "on the fly" with the computation of new ab initio data only when a fitting error estimate exceeds a prescribed tight tolerance. The second approach, called dynamics-driven IMLS fitting, uses relatively inexpensive exploratory trajectories to both determine and fit the dynamically accessible configuration space. Once exploratory trajectories no longer find configurations with fitting error estimates higher than the designated accuracy, the IMLS fit is considered to be complete and usable in classical trajectory calculations or other applications.

Estimation of Actual Crop ET of Paddy Using the Energy Balance Model SMARET and Validation with Field Water Balance Measurements and a Crop Growth Model (ORYZA)

NASA Astrophysics Data System (ADS)

Nallasamy, N. D.; Muraleedharan, B. V.; Kathirvel, K.; Narasimhan, B.

2014-12-01

Sustainable management of water resources requires reliable estimates of actual evapotranspiration (ET) at fine spatial and temporal resolution. This is significant in the case of rice based irrigation systems, one of the major consumers of surface water resources and where ET forms a major component of water consumption. However huge tradeoff in the spatial and temporal resolution of satellite images coupled with lack of adequate number of cloud free images within a growing season act as major constraints in deriving ET at fine spatial and temporal resolution using remote sensing based energy balance models. The scale at which ET is determined is decided by the spatial and temporal scale of Land Surface Temperature (LST) and Normalized Difference Vegetation Index (NDVI), which form inputs to energy balance models. In this context, the current study employed disaggregation algorithms (NL-DisTrad and DisNDVI) to generate time series of LST and NDVI images at fine resolution. The disaggregation algorithms aimed at generating LST and NDVI at finer scale by integrating temporal information from concurrent coarse resolution data and spatial information from a single fine resolution image. The temporal frequency of the disaggregated images is further improved by employing composite images of NDVI and LST in the spatio-temporal disaggregation method. The study further employed half-hourly incoming surface insolation and outgoing long wave radiation obtained from the Indian geostationary satellite (Kalpana-1) to convert the instantaneous ET into daily ET and subsequently to the seasonal ET, thereby improving the accuracy of ET estimates. The estimates of ET were validated with field based water balance measurements carried out in Gadana, a subbasin predominated by rice paddy fields, located in Tamil Nadu, India.

A combined crossed molecular beams and theoretical study of the reaction CN + C2H4

NASA Astrophysics Data System (ADS)

Balucani, Nadia; Leonori, Francesca; Petrucci, Raffaele; Wang, Xingan; Casavecchia, Piergiorgio; Skouteris, Dimitrios; Albernaz, Alessandra F.; Gargano, Ricardo

2015-03-01

The CN + C2H4 reaction has been investigated experimentally, in crossed molecular beam (CMB) experiments at the collision energy of 33.4 kJ/mol, and theoretically, by electronic structure calculations of the relevant potential energy surface and Rice-Ramsperger-Kassel-Marcus (RRKM) estimates of the product branching ratio. Differently from previous CMB experiments at lower collision energies, but similarly to a high energy study, we have some indication that a second reaction channel is open at this collision energy, the characteristics of which are consistent with the channel leading to CH2CHNC + H. The RRKM estimates using M06L electronic structure calculations qualitatively support the experimental observation of C2H3NC formation at this and at the higher collision energy of 42.7 kJ/mol of previous experiments.

An estimation method for echo signal energy of pipe inner surface longitudinal crack detection by 2-D energy coefficients integration

DOE Office of Scientific and Technical Information (OSTI.GOV)

Zhou, Shiyuan, E-mail: redaple@bit.edu.cn; Sun, Haoyu, E-mail: redaple@bit.edu.cn; Xu, Chunguang, E-mail: redaple@bit.edu.cn

The echo signal energy is directly affected by the incident sound beam eccentricity or angle for thick-walled pipes inner longitudinal cracks detection. A method for analyzing the relationship between echo signal energy between the values of incident eccentricity is brought forward, which can be used to estimate echo signal energy when testing inside wall longitudinal crack of pipe, using mode-transformed compression wave adaptation of shear wave with water-immersion method, by making a two-dimension integration of “energy coefficient” in both circumferential and axial directions. The calculation model is founded for cylinder sound beam case, in which the refraction and reflection energymore » coefficients of different rays in the whole sound beam are considered different. The echo signal energy is calculated for a particular cylinder sound beam testing different pipes: a beam with a diameter of 0.5 inch (12.7mm) testing a φ279.4mm pipe and a φ79.4mm one. As a comparison, both the results of two-dimension integration and one-dimension (circumferential direction) integration are listed, and only the former agrees well with experimental results. The estimation method proves to be valid and shows that the usual method of simplifying the sound beam as a single ray for estimating echo signal energy and choosing optimal incident eccentricity is not so appropriate.« less

Surface Soil Moisture Estimates Across China Based on Multi-satellite Observations and A Soil Moisture Model

NASA Astrophysics Data System (ADS)

Zhang, Ke; Yang, Tao; Ye, Jinyin; Li, Zhijia; Yu, Zhongbo

2017-04-01

Soil moisture is a key variable that regulates exchanges of water and energy between land surface and atmosphere. Soil moisture retrievals based on microwave satellite remote sensing have made it possible to estimate global surface (up to about 10 cm in depth) soil moisture routinely. Although there are many satellites operating, including NASA's Soil Moisture Acitive Passive mission (SMAP), ESA's Soil Moisture and Ocean Salinity mission (SMOS), JAXA's Advanced Microwave Scanning Radiometer 2 mission (AMSR2), and China's Fengyun (FY) missions, key differences exist between different satellite-based soil moisture products. In this study, we applied a single-channel soil moisture retrieval model forced by multiple sources of satellite brightness temperature observations to estimate consistent daily surface soil moisture across China at a spatial resolution of 25 km. By utilizing observations from multiple satellites, we are able to estimate daily soil moisture across the whole domain of China. We further developed a daily soil moisture accounting model and applied it to downscale the 25-km satellite-based soil moisture to 5 km. By comparing our estimated soil moisture with observations from a dense observation network implemented in Anhui Province, China, our estimated soil moisture results show a reasonably good agreement with the observations (RMSE < 0.1 and r > 0.8).

Embedded cluster calculations for hydrogen chemisorption on the (111) surfaces of fcc Co, Ni, Cu, Rh, Pd and Ag

NASA Astrophysics Data System (ADS)

Muscat, J. P.; Newns, D. M.

1980-10-01

We present a muffin tin based calculation on (TM) 3H, (TM) 7H and (TM) 19H clusters embedded at the surface of an effective jellium-like medium whose potential is treated in scattering length approximation. We consider the changes occurring when the d-like perturbation of the TM muffin tins is switched on. The broad chemisorption-induced resonance seen for H on the effective jellium surface is narrowed and shifted down in energy. Furthermore the occupation of this resonance is increased from about 1.1 electrons to about 1.4 (on 3d metals) or 1.8 (on 4d metals), due to d-like states dropping down from the d band to form a relatively welldefined "bonding state". An antibonding state containing about 0.4 electrons is formed at the top of the d band. The results are compared with other calculations and with photoemission data. Implications for the metal-hydrogen distance and (for Ni) the demagnetizing effect of hydrogen chemisorption are discussed. We use the change in total single particle energy when the d-like perturbation is switched on to estimate trends in chemisorption energy along the 3d and 4d series. In the 3d case experimental data is available on the difference in chemisorption energy between Ni and Cu which is in reasonable agreement with our estimate.

Actual evapotranspiration modeling using the operational Simplified Surface Energy Balance (SSEBop) approach

USGS Publications Warehouse

Savoca, Mark E.; Senay, Gabriel B.; Maupin, Molly A.; Kenny, Joan F.; Perry, Charles A.

2013-01-01

Remote-sensing technology and surface-energy-balance methods can provide accurate and repeatable estimates of actual evapotranspiration (ETa) when used in combination with local weather datasets over irrigated lands. Estimates of ETa may be used to provide a consistent, accurate, and efficient approach for estimating regional water withdrawals for irrigation and associated consumptive use (CU), especially in arid cropland areas that require supplemental water due to insufficient natural supplies from rainfall, soil moisture, or groundwater. ETa in these areas is considered equivalent to CU, and represents the part of applied irrigation water that is evaporated and/or transpired, and is not available for immediate reuse. A recent U.S. Geological Survey study demonstrated the application of the remote-sensing-based Simplified Surface Energy Balance (SSEB) model to estimate 10-year average ETa at 1-kilometer resolution on national and regional scales, and compared those ETa values to the U.S. Geological Survey’s National Water-Use Information Program’s 1995 county estimates of CU. The operational version of the operational SSEB (SSEBop) method is now used to construct monthly, county-level ETa maps of the conterminous United States for the years 2000, 2005, and 2010. The performance of the SSEBop was evaluated using eddy covariance flux tower datasets compiled from 2005 datasets, and the results showed a strong linear relationship in different land cover types across diverse ecosystems in the conterminous United States (correlation coefficient [r] ranging from 0.75 to 0.95). For example, r for woody savannas (0.75), grassland (0.75), forest (0.82), cropland (0.84), shrub land (0.89), and urban (0.95). A comparison of the remote-sensing SSEBop method for estimating ETa and the Hamon temperature method for estimating potential ET (ETp) also was conducted, using regressions of all available county averages of ETa for 2005 and 2010, and yielded correlations of r = 0.60 and r = 0.71, respectively. Correlations generally are stronger in the Southeast where ETa is close to ETp. SSEBop ETa provides more spatial detail and accuracy in the Southwest where irrigation is practiced in a smaller proportion of the region.

Entropic Repulsion Between Fluctuating Surfaces

NASA Astrophysics Data System (ADS)

Janke, W.

The statistical mechanics of fluctuating surfaces plays an important role in a variety of physical systems, ranging from biological membranes to world sheets of strings in theories of fundamental interactions. In many applications it is a good approximation to assume that the surfaces possess no tension. Their statistical properties are then governed by curvature energies only, which allow for gigantic out-of-plane undulations. These fluctuations are the “entropic” origin of long-range repulsive forces in layered surface systems. Theoretical estimates of these forces for simple model surfaces are surveyed and compared with recent Monte Carlo simulations.

Free energy simulations with the AMOEBA polarizable force field and metadynamics on GPU platform.

PubMed

Peng, Xiangda; Zhang, Yuebin; Chu, Huiying; Li, Guohui

2016-03-05

The free energy calculation library PLUMED has been incorporated into the OpenMM simulation toolkit, with the purpose to perform enhanced sampling MD simulations using the AMOEBA polarizable force field on GPU platform. Two examples, (I) the free energy profile of water pair separation (II) alanine dipeptide dihedral angle free energy surface in explicit solvent, are provided here to demonstrate the accuracy and efficiency of our implementation. The converged free energy profiles could be obtained within an affordable MD simulation time when the AMOEBA polarizable force field is employed. Moreover, the free energy surfaces estimated using the AMOEBA polarizable force field are in agreement with those calculated from experimental data and ab initio methods. Hence, the implementation in this work is reliable and would be utilized to study more complicated biological phenomena in both an accurate and efficient way. © 2015 Wiley Periodicals, Inc. © 2015 Wiley Periodicals, Inc.

A deterministic method for estimating free energy genetic network landscapes with applications to cell commitment and reprogramming paths.

PubMed

Olariu, Victor; Manesso, Erica; Peterson, Carsten

2017-06-01

Depicting developmental processes as movements in free energy genetic landscapes is an illustrative tool. However, exploring such landscapes to obtain quantitative or even qualitative predictions is hampered by the lack of free energy functions corresponding to the biochemical Michaelis-Menten or Hill rate equations for the dynamics. Being armed with energy landscapes defined by a network and its interactions would open up the possibility of swiftly identifying cell states and computing optimal paths, including those of cell reprogramming, thereby avoiding exhaustive trial-and-error simulations with rate equations for different parameter sets. It turns out that sigmoidal rate equations do have approximate free energy associations. With this replacement of rate equations, we develop a deterministic method for estimating the free energy surfaces of systems of interacting genes at different noise levels or temperatures. Once such free energy landscape estimates have been established, we adapt a shortest path algorithm to determine optimal routes in the landscapes. We explore the method on three circuits for haematopoiesis and embryonic stem cell development for commitment and reprogramming scenarios and illustrate how the method can be used to determine sequential steps for onsets of external factors, essential for efficient reprogramming.

A deterministic method for estimating free energy genetic network landscapes with applications to cell commitment and reprogramming paths

PubMed Central

Olariu, Victor; Manesso, Erica

2017-01-01

Depicting developmental processes as movements in free energy genetic landscapes is an illustrative tool. However, exploring such landscapes to obtain quantitative or even qualitative predictions is hampered by the lack of free energy functions corresponding to the biochemical Michaelis–Menten or Hill rate equations for the dynamics. Being armed with energy landscapes defined by a network and its interactions would open up the possibility of swiftly identifying cell states and computing optimal paths, including those of cell reprogramming, thereby avoiding exhaustive trial-and-error simulations with rate equations for different parameter sets. It turns out that sigmoidal rate equations do have approximate free energy associations. With this replacement of rate equations, we develop a deterministic method for estimating the free energy surfaces of systems of interacting genes at different noise levels or temperatures. Once such free energy landscape estimates have been established, we adapt a shortest path algorithm to determine optimal routes in the landscapes. We explore the method on three circuits for haematopoiesis and embryonic stem cell development for commitment and reprogramming scenarios and illustrate how the method can be used to determine sequential steps for onsets of external factors, essential for efficient reprogramming. PMID:28680655

Improvements to water use and water stress estimates with the addition of IR and net radiometers to weather stations

USDA-ARS?s Scientific Manuscript database

Evapotranspiration (ET) is often estimated with the Penman-Monteith (P-M) equation. Net radiation (Rn) is a major component of the surface energy balance and an input to the P-M equation, but it is challenging and expensive to measure accurately. For these reasons, most weather stations do not inclu...

Surface properties of calcium and magnesium oxide nanopowders grafted with unsaturated carboxylic acids studied with inverse gas chromatography.

PubMed

Maciejewska, Magdalena; Krzywania-Kaliszewska, Alicja; Zaborski, Marian

2012-09-28

Inverse gas chromatography (IGC) was applied at infinite dilution to evaluate the surface properties of calcium and magnesium oxide nanoparticles and the effect of surface grafted unsaturated carboxylic acid on the nanopowder donor-acceptor characteristics. The dispersive components (γ(s)(D)) of the free energy of the nanopowders were determined by Gray's method, whereas their tendency to undergo specific interactions was estimated based on the electron donor-acceptor approach presented by Papirer. The calcium and magnesium oxide nanoparticles exhibited high surface energies (79 mJ/m² and 74 mJ/m², respectively). Modification of nanopowders with unsaturated carboxylic acids decreased their specific adsorption energy. The lowest value of γ(s)(D) was determined for nanopowders grafted with undecylenic acid, approximately 55 mJ/m². The specific interactions were characterised by the molar free energy (ΔG(A)(SP)) and molar enthalpy (ΔH(A)(SP)) of adsorption as well as the donor and acceptor interaction parameters (K(A), K(D)). Copyright © 2012 Elsevier B.V. All rights reserved.

A review of surface energy balance models for estimating actual evapotranspiration with remote sensing at high spatiotemporal resolution over large extents

USGS Publications Warehouse

McShane, Ryan R.; Driscoll, Katelyn P.; Sando, Roy

2017-09-27

Many approaches have been developed for measuring or estimating actual evapotranspiration (ETa), and research over many years has led to the development of remote sensing methods that are reliably reproducible and effective in estimating ETa. Several remote sensing methods can be used to estimate ETa at the high spatial resolution of agricultural fields and the large extent of river basins. More complex remote sensing methods apply an analytical approach to ETa estimation using physically based models of varied complexity that require a combination of ground-based and remote sensing data, and are grounded in the theory behind the surface energy balance model. This report, funded through cooperation with the International Joint Commission, provides an overview of selected remote sensing methods used for estimating water consumed through ETa and focuses on Mapping Evapotranspiration at High Resolution with Internalized Calibration (METRIC) and Operational Simplified Surface Energy Balance (SSEBop), two energy balance models for estimating ETa that are currently applied successfully in the United States. The METRIC model can produce maps of ETa at high spatial resolution (30 meters using Landsat data) for specific areas smaller than several hundred square kilometers in extent, an improvement in practice over methods used more generally at larger scales. Many studies validating METRIC estimates of ETa against measurements from lysimeters have shown model accuracies on daily to seasonal time scales ranging from 85 to 95 percent. The METRIC model is accurate, but the greater complexity of METRIC results in greater data requirements, and the internalized calibration of METRIC leads to greater skill required for implementation. In contrast, SSEBop is a simpler model, having reduced data requirements and greater ease of implementation without a substantial loss of accuracy in estimating ETa. The SSEBop model has been used to produce maps of ETa over very large extents (the conterminous United States) using lower spatial resolution (1 kilometer) Moderate Resolution Imaging Spectroradiometer (MODIS) data. Model accuracies ranging from 80 to 95 percent on daily to annual time scales have been shown in numerous studies that validated ETa estimates from SSEBop against eddy covariance measurements. The METRIC and SSEBop models can incorporate low and high spatial resolution data from MODIS and Landsat, but the high spatiotemporal resolution of ETa estimates using Landsat data over large extents takes immense computing power. Cloud computing is providing an opportunity for processing an increasing amount of geospatial “big data” in a decreasing period of time. For example, Google Earth EngineTM has been used to implement METRIC with automated calibration for regional-scale estimates of ETa using Landsat data. The U.S. Geological Survey also is using Google Earth EngineTM to implement SSEBop for estimating ETa in the United States at a continental scale using Landsat data.

Surface Energy and Mass Balance Model for Greenland Ice Sheet and Future Projections

NASA Astrophysics Data System (ADS)

Liu, Xiaojian

The Greenland Ice Sheet contains nearly 3 million cubic kilometers of glacial ice. If the entire ice sheet completely melted, sea level would raise by nearly 7 meters. There is thus considerable interest in monitoring the mass balance of the Greenland Ice Sheet. Each year, the ice sheet gains ice from snowfall and loses ice through iceberg calving and surface melting. In this thesis, we develop, validate and apply a physics based numerical model to estimate current and future surface mass balance of the Greenland Ice Sheet. The numerical model consists of a coupled surface energy balance and englacial model that is simple enough that it can be used for long time scale model runs, but unlike previous empirical parameterizations, has a physical basis. The surface energy balance model predicts ice sheet surface temperature and melt production. The englacial model predicts the evolution of temperature and meltwater within the ice sheet. These two models can be combined with estimates of precipitation (snowfall) to estimate the mass balance over the Greenland Ice Sheet. We first compare model performance with in-situ observations to demonstrate that the model works well. We next evaluate how predictions are degraded when we statistically downscale global climate data. We find that a simple, nearest neighbor interpolation scheme with a lapse rate correction is able to adequately reproduce melt patterns on the Greenland Ice Sheet. These results are comparable to those obtained using empirical Positive Degree Day (PDD) methods. Having validated the model, we next drove the ice sheet model using the suite of atmospheric model runs available through the CMIP5 atmospheric model inter-comparison, which in turn built upon the RCP 8.5 (business as usual) scenarios. From this exercise we predict how much surface melt production will increase in the coming century. This results in 4-10 cm sea level equivalent, depending on the CMIP5 models. Finally, we try to bound melt water production from CMIP5 data with the model by assuming that the Greenland Ice Sheet is covered in black carbon (lowering the albedo) and perpetually covered by optically thick clouds (increasing long wave radiation). This upper bound roughly triples surface meltwater production, resulting in 30 cm of sea level rise by 2100. These model estimates, combined with prior research suggesting an additional 40-100 cm of sea level rise associated with dynamical discharge, suggest that the Greenland Ice Sheet is poised to contribute significantly to sea level rise in the coming century.

Estimating spatially distributed turbulent heat fluxes from high-resolution thermal imagery acquired with a UAV system

PubMed Central

Brenner, Claire; Thiem, Christina Elisabeth; Wizemann, Hans-Dieter; Bernhardt, Matthias; Schulz, Karsten

2017-01-01

ABSTRACT In this study, high-resolution thermal imagery acquired with a small unmanned aerial vehicle (UAV) is used to map evapotranspiration (ET) at a grassland site in Luxembourg. The land surface temperature (LST) information from the thermal imagery is the key input to a one-source and two-source energy balance model. While the one-source model treats the surface as a single uniform layer, the two-source model partitions the surface temperature and fluxes into soil and vegetation components. It thus explicitly accounts for the different contributions of both components to surface temperature as well as turbulent flux exchange with the atmosphere. Contrary to the two-source model, the one-source model requires an empirical adjustment parameter in order to account for the effect of the two components. Turbulent heat flux estimates of both modelling approaches are compared to eddy covariance (EC) measurements using the high-resolution input imagery UAVs provide. In this comparison, the effect of different methods for energy balance closure of the EC data on the agreement between modelled and measured fluxes is also analysed. Additionally, the sensitivity of the one-source model to the derivation of the empirical adjustment parameter is tested. Due to the very dry and hot conditions during the experiment, pronounced thermal patterns developed over the grassland site. These patterns result in spatially variable turbulent heat fluxes. The model comparison indicates that both models are able to derive ET estimates that compare well with EC measurements under these conditions. However, the two-source model, with a more complex treatment of the energy and surface temperature partitioning between the soil and vegetation, outperformed the simpler one-source model in estimating sensible and latent heat fluxes. This is consistent with findings from prior studies. For the one-source model, a time-variant expression of the adjustment parameter (to account for the difference between aerodynamic and radiometric temperature) that depends on the surface-to-air temperature gradient yielded the best agreement with EC measurements. This study showed that the applied UAV system equipped with a dual-camera set-up allows for the acquisition of thermal imagery with high spatial and temporal resolution that illustrates the small-scale heterogeneity of thermal surface properties. The UAV-based thermal imagery therefore provides the means for analysing patterns of LST and other surface properties with a high level of detail that cannot be obtained by traditional remote sensing methods. PMID:28515537

Estimating spatially distributed turbulent heat fluxes from high-resolution thermal imagery acquired with a UAV system.

PubMed

Brenner, Claire; Thiem, Christina Elisabeth; Wizemann, Hans-Dieter; Bernhardt, Matthias; Schulz, Karsten

2017-05-19

In this study, high-resolution thermal imagery acquired with a small unmanned aerial vehicle (UAV) is used to map evapotranspiration (ET) at a grassland site in Luxembourg. The land surface temperature (LST) information from the thermal imagery is the key input to a one-source and two-source energy balance model. While the one-source model treats the surface as a single uniform layer, the two-source model partitions the surface temperature and fluxes into soil and vegetation components. It thus explicitly accounts for the different contributions of both components to surface temperature as well as turbulent flux exchange with the atmosphere. Contrary to the two-source model, the one-source model requires an empirical adjustment parameter in order to account for the effect of the two components. Turbulent heat flux estimates of both modelling approaches are compared to eddy covariance (EC) measurements using the high-resolution input imagery UAVs provide. In this comparison, the effect of different methods for energy balance closure of the EC data on the agreement between modelled and measured fluxes is also analysed. Additionally, the sensitivity of the one-source model to the derivation of the empirical adjustment parameter is tested. Due to the very dry and hot conditions during the experiment, pronounced thermal patterns developed over the grassland site. These patterns result in spatially variable turbulent heat fluxes. The model comparison indicates that both models are able to derive ET estimates that compare well with EC measurements under these conditions. However, the two-source model, with a more complex treatment of the energy and surface temperature partitioning between the soil and vegetation, outperformed the simpler one-source model in estimating sensible and latent heat fluxes. This is consistent with findings from prior studies. For the one-source model, a time-variant expression of the adjustment parameter (to account for the difference between aerodynamic and radiometric temperature) that depends on the surface-to-air temperature gradient yielded the best agreement with EC measurements. This study showed that the applied UAV system equipped with a dual-camera set-up allows for the acquisition of thermal imagery with high spatial and temporal resolution that illustrates the small-scale heterogeneity of thermal surface properties. The UAV-based thermal imagery therefore provides the means for analysing patterns of LST and other surface properties with a high level of detail that cannot be obtained by traditional remote sensing methods.

Spectra of electrons emitted as a result of the sticking and annihilation of low energy positrons to the surfaces of graphene and highly oriented pyrolytic graphite (HOPG)

NASA Astrophysics Data System (ADS)

Chrysler, M.; Chirayath, V.; McDonald, A.; Lim, Z.; Shastry, K.; Gladen, R.; Fairchild, A.; Koymen, A.; Weiss, A.

Positron annihilation induced Auger electron spectroscopy (PAES) was used to study the positron induced low energy electron spectra from HOPG and a sample composed of 6-8 layers of graphene grown on polycrystalline copper. A low energy (~2eV) beam of positrons was used to implant positrons into a surface localized state on the graphene and HOPG samples. Measurements of the energy spectra of the positron induced electrons obtained using a TOF spectrometer indicate the presence of an annihilation induced KLL C Auger peak (at ~263 eV) along with a narrow low energy secondary peak due to an Auger mediated positron sticking (AMPS) process. A broad spectral feature was also observed below ~15 eV which we believe may be due to a VVV C Auger transition not previously observed. The energy dependence of the integrated intensity of the AMPS peak was measured for a series of incident positron kinetic energies ranging from ~1.5 eV up to 11 eV from which the binding energy of the surface localized positron state on graphene and HOPG was estimated. The implication of our results regarding the applicability of AMPS and PAES to the study of graphene surfaces and interfaces will be discussed. This work was supported by NSF Grant No. DMR 1508719 and DMR 1338130.

Centrifuge impact cratering experiments: Scaling laws for non-porous targets

NASA Technical Reports Server (NTRS)

Schmidt, Robert M.

1987-01-01

A geotechnical centrifuge was used to investigate large body impacts onto planetary surfaces. At elevated gravity, it is possible to match various dimensionless similarity parameters which were shown to govern large scale impacts. Observations of crater growth and target flow fields have provided detailed and critical tests of a complete and unified scaling theory for impact cratering. Scaling estimates were determined for nonporous targets. Scaling estimates for large scale cratering in rock proposed previously by others have assumed that the crater radius is proportional to powers of the impactor energy and gravity, with no additional dependence on impact velocity. The size scaling laws determined from ongoing centrifuge experiments differ from earlier ones in three respects. First, a distinct dependence of impact velocity is recognized, even for constant impactor energy. Second, the present energy exponent for low porosity targets, like competent rock, is lower than earlier estimates. Third, the gravity exponent is recognized here as being related to both the energy and the velocity exponents.

Anomalous photoelectric emission from Ag on zinc-phthalocyanine film

DOE Office of Scientific and Technical Information (OSTI.GOV)

Tanaka, Senku, E-mail: senku@ele.kindai.ac.jp; Otani, Tomohiro; Fukuzawa, Ken

2014-05-12

Photoelectric emission from organic and metal thin films is generally observed with irradiation of photon energy larger than 4 eV. In this paper, however, we report photoelectric emission from Ag on a zinc-phthalocyanine (ZnPc) layer at a photon energy of 3.4 eV. The threshold energy for this photoelectric emission is much smaller than the work function of Ag estimated by conventional photoelectron spectroscopy. The photoelectric emission by low-energy photons is significant for Ag thicknesses of less than 1 nm. Photoelectron spectroscopy and morphological study of the Ag/ZnPc suggest that the anomalous photoelectric emission from the Ag surface is caused by a vacuum levelmore » shift at the Ag/ZnPc interface and by surface plasmons of the Ag nanoparticles.« less

Modelling temporal variance of component temperatures and directional anisotropy over vegetated canopy

NASA Astrophysics Data System (ADS)

Bian, Zunjian; du, yongming; li, hua

2016-04-01

Land surface temperature (LST) as a key variable plays an important role on hydrological, meteorology and climatological study. Thermal infrared directional anisotropy is one of essential factors to LST retrieval and application on longwave radiance estimation. Many approaches have been proposed to estimate directional brightness temperatures (DBT) over natural and urban surfaces. While less efforts focus on 3-D scene and the surface component temperatures used in DBT models are quiet difficult to acquire. Therefor a combined 3-D model of TRGM (Thermal-region Radiosity-Graphics combined Model) and energy balance method is proposed in the paper for the attempt of synchronously simulation of component temperatures and DBT in the row planted canopy. The surface thermodynamic equilibrium can be final determined by the iteration strategy of TRGM and energy balance method. The combined model was validated by the top-of-canopy DBTs using airborne observations. The results indicated that the proposed model performs well on the simulation of directional anisotropy, especially the hotspot effect. Though we find that the model overestimate the DBT with Bias of 1.2K, it can be an option as a data reference to study temporal variance of component temperatures and DBTs when field measurement is inaccessible

Forest Surface Energy Balance and Evapotranspiration Estimated From Four Eddy Covariance Towers

NASA Astrophysics Data System (ADS)

Rabbani, G. A.; Adam, J. C.; Elliot, W. J.; Liu, H.

2016-12-01

Evapotranspiration (ET), which refers to the combined effect of surface water evaporation and plant transpiration, is one of the vital elements of the global water balance. It is also an important process for plants, providing water, nutrient, and cooling needs, and helping to regulate carbon dioxide entry through open/closure of the plant's stomata. Quantifying ET in forested environments is an ongoing research area. Complex physiological responses with climatic variation, combined with difficulty in making wide-spread measurements, makes ET one of the least understood components of a forest water balance. The objective of this study is to estimate ET and energy balance closure by using flux net data from eddy covariance towers. ET is estimated for different forest types with multiple age classes during the years of 2011, 2012 and 2013. We studied two coniferous forests (F1, F2), one deciduous forest (F3) and one mixed forest (F4) in Washington, Wyoming, Wisconsin and New Jersey, respectively. Label 2 (Data checked and formatted by Carbon Dioxide Information Analysis Center) gap filled flux data were collected from the AmeriFlux database (ameriflux.ornl.gov). Discrepancies between turbulent fluxes and available energy are investigated. Among the studied forests, the highest and lowest average monthly ET are exhibited by the mixed forest (F4) and coniferous forest (F1) in 2012 which are 2,692 and 633 mm/month, respectively. Difference in average monthly ET can be an implication of substantial age difference between these two types of forest. The regression analysis showed significant correlation between turbulent fluxes and available energy (R2=0.91) for mixed forest where the discrepancy varied from 5-11%. Conversely, for coniferous and deciduous forests, the discrepancy varied from 46-49% and 28%, respectively, with almost similar correlation between the fluxes (0.86 and 0.84, respectively). This study will facilitate an improved understanding of how forest type and age pose differences in ET and surface energy components.

The Characterization of Atmospheric Boundary Layer Depth and Turbulence in a Mixed Rural and Urban Convective Environment

NASA Astrophysics Data System (ADS)

Hicks, Micheal M.

A comprehensive analysis of surface-atmosphere flux exchanges over a mixed rural and urban convective environment is conducted at Howard University Beltsville, MD Research Campus. This heterogeneous site consists of rural, suburban and industrial surface covers to its south, east and west, within a 2 km radius of a flux sensor. The eddy covariance method is utilized to estimate surface-atmosphere flux exchanges of momentum, heat and moisture. The attributes of these surface flux exchanges are contrasted to those of classical homogeneous sites and assessed for accuracy, to evaluate the following: (I) their similarity to conventional convective boundary layer (CBL) processes and (II) their representativeness of the surrounding environment's turbulent properties. Both evaluations are performed as a function of upwind surface conditions. In particular, the flux estimates' obedience to spectrum power laws and similarity theory relationships is used for performing the first evaluation, and their ability to close the surface energy balance and accurately model CBL heights is used for the latter. An algorithm that estimates atmospheric boundary layer heights from observed lidar extinction backscatter was developed, tested and applied in this study. The derived lidar based CBL heights compared well with those derived from balloon borne soundings, with an overall Pearson correlation coefficient and standard deviation of 0.85 and 223 m, respectively. This algorithm assisted in the evaluation of the response of CBL processes to surface heterogeneity, by deriving high temporal CBL heights and using them as independent references of the surrounding area averaged sensible heat fluxes. This study found that the heterogeneous site under evaluation was rougher than classical homogeneous sites, with slower dissipation rates of turbulent kinetic energy. Flux measurements downwind of the industrial complexes exhibited enhanced efficiency in surface-atmosphere momentum, heat, and moisture transport relative to their similarity theory predictions. In addition, these enhanced heat flux estimates ingested into the CBL slab model overestimated observed CBL heights. More spatial flux observations are needed to better understand the role that the industrial complexes are playing in enhancing the efficiency of turbulent processes, which may have important implications on the role humans are assuming in regional climate change.

Geometric effects on surface states in topological insulator Bi2Te3 nanowire

NASA Astrophysics Data System (ADS)

Sengupta, Parijat; Kubis, Tillman; Povolotskyi, Michael; Klimeck, Gerhard

2012-02-01

Bismuth Telluride (BT) is a 3D topological insulator (TI) with surface states that have energy dispersion linear in momentum and forms a Dirac cone at low energy. In this work we investigate the surface properties of a BT nanowire and demonstrate the existence of TI states. We also show how such states vanish under certain geometric conditions. An atomistic model (sp3d5s* TB) is used to compute the energy dispersion in a BT nanowire. Penetration depth of the surface states is estimated by ratio of Fermi velocity and band-gap. BT possesses a tiny band-gap, which creates small localization of surface states and greater penetration in to the bulk. To offset this large spatial penetration, which is undesirable to avoid a direct coupling between surfaces, we expect that bigger cross-sections of BT nanowires would be needed to obtain stable TI states. Our numerical work validates this prediction. Furthermore, geometry of the nanowire is shown to influence the TI states. Using a combined analytical and numerical approach our results reveal that surface roughness impact electronic structure leading to Rashba type splits along z-direction. Cylindrical and square cross-sections are given as illustrative examples.

Dynamics of an optically confined nanoparticle diffusing normal to a surface.

PubMed

Schein, Perry; O'Dell, Dakota; Erickson, David

2016-06-01

Here we measure the hindered diffusion of an optically confined nanoparticle in the direction normal to a surface, and we use this to determine the particle-surface interaction profile in terms of the absolute height. These studies are performed using the evanescent field of an optically excited single-mode silicon nitride waveguide, where the particle is confined in a height-dependent potential energy well generated from the balance of optical gradient and surface forces. Using a high-speed cmos camera, we demonstrate the ability to capture the short time-scale diffusion dominated motion for 800-nm-diam polystyrene particles, with measurement times of only a few seconds per particle. Using established theory, we show how this information can be used to estimate the equilibrium separation of the particle from the surface. As this measurement can be made simultaneously with equilibrium statistical mechanical measurements of the particle-surface interaction energy landscape, we demonstrate the ability to determine these in terms of the absolute rather than relative separation height. This enables the comparison of potential energy landscapes of particle-surface interactions measured under different experimental conditions, enhancing the utility of this technique.

Water, Energy, and Carbon with Artificial Neural Networks (WECANN): a statistically based estimate of global surface turbulent fluxes and gross primary productivity using solar-induced fluorescence

DOE Office of Scientific and Technical Information (OSTI.GOV)

Alemohammad, Seyed Hamed; Fang, Bin; Konings, Alexandra G.

A new global estimate of surface turbulent fluxes, latent heat flux (LE) and sensible heat flux ( H), and gross primary production (GPP) is developed using a machine learning approach informed by novel remotely sensed solar-induced fluorescence (SIF) and other radiative and meteorological variables. This is the first study to jointly retrieve LE, H, and GPP using SIF observations. The approach uses an artificial neural network (ANN) with a target dataset generated from three independent data sources, weighted based on a triple collocation (TC) algorithm. The new retrieval, named Water, Energy, and Carbon with Artificial Neural Networks (WECANN), provides estimatesmore » of LE, H, and GPP from 2007 to 2015 at 1° × 1° spatial resolution and at monthly time resolution. The quality of ANN training is assessed using the target data, and the WECANN retrievals are evaluated using eddy covariance tower estimates from the FLUXNET network across various climates and conditions. When compared to eddy covariance estimates, WECANN typically outperforms other products, particularly for sensible and latent heat fluxes. Analyzing WECANN retrievals across three extreme drought and heat wave events demonstrates the capability of the retrievals to capture the extent of these events. Uncertainty estimates of the retrievals are analyzed and the interannual variability in average global and regional fluxes shows the impact of distinct climatic events – such as the 2015 El Niño – on surface turbulent fluxes and GPP.« less

Water, Energy, and Carbon with Artificial Neural Networks (WECANN): a statistically based estimate of global surface turbulent fluxes and gross primary productivity using solar-induced fluorescence

DOE PAGES

Alemohammad, Seyed Hamed; Fang, Bin; Konings, Alexandra G.; ...

2017-09-20

A new global estimate of surface turbulent fluxes, latent heat flux (LE) and sensible heat flux ( H), and gross primary production (GPP) is developed using a machine learning approach informed by novel remotely sensed solar-induced fluorescence (SIF) and other radiative and meteorological variables. This is the first study to jointly retrieve LE, H, and GPP using SIF observations. The approach uses an artificial neural network (ANN) with a target dataset generated from three independent data sources, weighted based on a triple collocation (TC) algorithm. The new retrieval, named Water, Energy, and Carbon with Artificial Neural Networks (WECANN), provides estimatesmore » of LE, H, and GPP from 2007 to 2015 at 1° × 1° spatial resolution and at monthly time resolution. The quality of ANN training is assessed using the target data, and the WECANN retrievals are evaluated using eddy covariance tower estimates from the FLUXNET network across various climates and conditions. When compared to eddy covariance estimates, WECANN typically outperforms other products, particularly for sensible and latent heat fluxes. Analyzing WECANN retrievals across three extreme drought and heat wave events demonstrates the capability of the retrievals to capture the extent of these events. Uncertainty estimates of the retrievals are analyzed and the interannual variability in average global and regional fluxes shows the impact of distinct climatic events – such as the 2015 El Niño – on surface turbulent fluxes and GPP.« less

Momentum and heat flux estimation in the planetary boundary layer (PBL) with a 10.6-micron Doppler lidar

NASA Technical Reports Server (NTRS)

Gal-Chen, Tzvi; Xu, Mei; Eberhard, Wynn

1991-01-01

The mean wind, its standard deviation, and the momentum fluxes in the PBL are estimated with a 10.6-micron Doppler lidar. Spectral analysis of the radial velocities was performed, from which, by examining the amplitude of the power spectrum at the inertial range, the kinetic energy dissipation was deduced. The statistical form of the Navier-Stokes equations was used to derive the surface heat flux as the residual balance between the vertical gradient of the third moment of the vertical velocity and the kinetic energy dissipation.

Microscopically derived potential energy surfaces from mostly structural considerations

DOE Office of Scientific and Technical Information (OSTI.GOV)

Ermamatov, M.J.; Institute of Nuclear Physics, Ulughbek, Tashkent 100214; Hess, Peter O., E-mail: hess@nucleares.unam.mx

2016-08-15

A simple procedure to estimate the quadrupole Potential-Energy-Surface (PES) is presented, using mainly structural information, namely the content of the shell model space and the Pauli exclusion principle. Further microscopic properties are implicitly contained through the use of results from the Möller and Nix tables or experimental information. A mapping to the geometric potential is performed yielding the PES. The General Collective Model is used in order to obtain an estimate on the spectrum and quadrupole transitions, adjusting only the mass parameter. First, we test the conjecture on known nuclei, deriving the PES and compare them to known data. Wemore » will see that the PES approximates very well the structure expected. Having acquired a certain confidence, we predict the PES of several chain of isotopes of heavy and super-heavy nuclei and at the end we investigate the structure of nuclei in the supposed island of stability. One of the main points to show is that simple assumptions can provide already important information on the structure of nuclei outside known regions and that spectra and electromagnetic transitions can be estimated without using involved calculations and assumptions. The procedure does not allow to calculate binding energies. The method presented can be viewed as a starting point for further improvements.« less

Designing transition metal surfaces for their adsorption properties and chemical reactivity

NASA Astrophysics Data System (ADS)

Montemore, Matthew M.

Many technological processes, such as catalysis, electrochemistry, corrosion, and some materials synthesis techniques, involve molecules bonding to and/or reacting on surfaces. For many of these applications, transition metals have proven to have excellent chemical reactivity, and this reactivity is strongly tied to the surface's adsorption properties. This thesis focuses on predicting adsorption properties for use in the design of transition metal surfaces for various applications. First, it is shown that adsorption through a particular atom (e.g, C or O) can be treated in a unified way. This allows predictions of all C-bound adsorbates from a single, simple adsorbate, such as CH3. In particular, consideration of the adsorption site can improve the applicability of previous approaches, and gas-phase bond energies correlate with adsorption energies for similarly bound adsorbates. Next, a general framework is presented for understanding and predicting adsorption through any atom. The energy of the adsorbate's highest occupied molecular orbital (HOMO) determines the strength of the repulsion between the adsorbate and the surface. Because adsorbates with similar HOMO energies behave similarly, their adsorption energies correlate. This can improve the efficiency of predictions, but more importantly it constrains catalyst design and suggests strategies for circumventing these constraints. Further, the behavior of adsorbates with dissimilar HOMO energies varies in a systematic way, allowing predictions of adsorption energy differences between any two adsorbates. These differences are also useful in surface design. In both of these cases, the dependence of adsorption energies on surface electronic properties is explored. This dependence is used to justify the unified treatments mentioned above, and is used to gain further insight into adsorption. The properties of the surface's d band and p band control variations in adsorption energy, as does the strength of the adsorbate-surface coupling. A single equation, with only a single adsorbate-dependent fitting parameter as well as a few universal fitting parameters, is developed that can predict the adsorption energy of any radical on any close-packed transition metal surface. The surface electronic properties that are input into this equation can be estimated based on the alloy structure of the surface, improving prospects for high-throughput screening and rational catalyst design. The methods discussed in this thesis are used to design a novel catalyst for ethylene epoxidation, which is experimentally synthesized and tested. Initial tests indicate that this catalyst may have improved selectivity over pure Ag.

Full-dimensional quantum calculations of the dissociation energy, zero-point, and 10 K properties of H7+/D7+ clusters using an ab initio potential energy surface.

PubMed

Barragán, Patricia; Pérez de Tudela, Ricardo; Qu, Chen; Prosmiti, Rita; Bowman, Joel M

2013-07-14

Diffusion Monte Carlo (DMC) and path-integral Monte Carlo computations of the vibrational ground state and 10 K equilibrium state properties of the H7 (+)/D7 (+) cations are presented, using an ab initio full-dimensional potential energy surface. The DMC zero-point energies of dissociated fragments H5 (+)(D5 (+))+H2(D2) are also calculated and from these results and the electronic dissociation energy, dissociation energies, D0, of 752 ± 15 and 980 ± 14 cm(-1) are reported for H7 (+) and D7 (+), respectively. Due to the known error in the electronic dissociation energy of the potential surface, these quantities are underestimated by roughly 65 cm(-1). These values are rigorously determined for first time, and compared with previous theoretical estimates from electronic structure calculations using standard harmonic analysis, and available experimental measurements. Probability density distributions are also computed for the ground vibrational and 10 K state of H7 (+) and D7 (+). These are qualitatively described as a central H3 (+)/D3 (+) core surrounded by "solvent" H2/D2 molecules that nearly freely rotate.

On the use of radiative surface temperature to estimate sensible heat flux over sparse shrubs in Nevada

NASA Technical Reports Server (NTRS)

Chehbouni, A.; Nichols, W. D.; Qi, J.; Njoku, E. G.; Kerr, Y. H.; Cabot, F.

1994-01-01

The accurate partitioning of available energy into sensible and latent heat flux is crucial to the understanding of surface atmosphere interactions. This issue is more complicated in arid and semi arid regions where the relative contribution to surface fluxes from the soil and vegetation may vary significantly throughout the day and throughout the season. A three component model to estimate sensible heat flux over heterogeneous surfaces is presented. The surface was represented with two adjacent compartments. The first compartment is made up of two components, shrubs and shaded soil, the second of open 'illuminated' soil. Data collected at two different sites in Nevada (U.S.) during the Summers of 1991 and 1992 were used to evaluate model performance. The results show that the present model is sufficiently general to yield satisfactory results for both sites.

Water Ice Radiolytic O2, H2, and H2O2 Yields for Any Projectile Species, Energy, or Temperature: A Model for Icy Astrophysical Bodies

NASA Astrophysics Data System (ADS)

Teolis, B. D.; Plainaki, C.; Cassidy, T. A.; Raut, U.

2017-10-01

O2, H2, and H2O2 radiolysis from water ice is pervasive on icy astrophysical bodies, but the lack of a self-consistent, quantitative model of the yields of these water products versus irradiation projectile species and energy has been an obstacle to estimating the radiolytic oxidant sources to the surfaces and exospheres of these objects. A major challenge is the wide variation of O2 radiolysis yields between laboratory experiments, ranging over 4 orders of magnitude from 5 × 10-7 to 5 × 10-3 molecules/eV for different particles and energies. We revisit decades of laboratory data to solve this long-standing puzzle, finding an inverse projectile range dependence in the O2 yields, due to preferential O2 formation from an 30 Å thick oxygenated surface layer. Highly penetrating projectile ions and electrons with ranges ≳30 Å are therefore less efficient at producing O2 than slow/heavy ions and low-energy electrons (≲ 400 eV) which deposit most energy near the surface. Unlike O2, the H2O2 yields from penetrating projectiles fall within a comparatively narrow range of (0.1-6) × 10-3 molecules/eV and do not depend on range, suggesting that H2O2 forms deep in the ice uniformly along the projectile track, e.g., by reactions of OH radicals. We develop an analytical model for O2, H2, and H2O2 yields from pure water ice for electrons and singly charged ions of any mass and energy and apply the model to estimate possible O2 source rates on several icy satellites. The yields are upper limits for icy bodies on which surface impurities may be present.

Diagnostic Characteristics of Submesoscale Coastal Surface Currents

NASA Astrophysics Data System (ADS)

Soh, Hyun Sup; Kim, Sung Yong

2018-03-01

Submesoscale kinetic energy (KE) spectra and fluxes at the length scales ranging from 2 to 25 km are estimated from hourly and O(1) km-scale coastal surface current maps observed from shore-based high-frequency radars off southern San Diego. The one-dimensional wave number-domain KE spectra of the surface currents have decay slopes between k-2 and k-3 at a wave number (k) of 0.5 km-1. The KE spectra exhibit anisotropy associated with anisotropic circulation, which is constrained by the shoreline and bottom bathymetry. Moreover, the KE spectra exhibit weak seasonality related to the regional submesoscale eddies and low-frequency circulation with weak seasonal variability. The estimated KE fluxes are categorized into four cases of purely forward cascades and inverse cascades at all wave numbers, inverse-then-forward cascades with a single zero-crossing within the range of wave numbers (0.04 to 0.5 km-1), and residuals, which account for approximately 33%, 39%, 19%, and 9% of the total number of realizations, respectively. An injection scale where forward enstrophy cascade and inverse energy cascade occur is estimated to be 5 to 10 km from the cases of the inverse-then-forward cascade, which is consistent with the length scales of the regional submesoscale eddies. Thus, the regional submesoscale processes are initiated by surface frontogenesis due to the weak seasonal low-frequency surface circulation and topography-related currents, then maintained by baroclinic instabilities associated with the seasonal mixed layer and O(10) km-scale submesoscale eddies with weak seasonal variability.

Benefits Estimation Model for Automated Vehicle Operations: Phase 2 Final Report

DOT National Transportation Integrated Search

2018-01-01

Automated vehicles have the potential to bring about transformative safety, mobility, energy, and environmental benefits to the surface transportation system. They are also being introduced into a complex transportation system, where second-order imp...

Estimation of Surface Air Temperature Over Central and Eastern Eurasia from MODIS Land Surface Temperature

NASA Technical Reports Server (NTRS)

Shen, Suhung; Leptoukh, Gregory G.

2011-01-01

Surface air temperature (T(sub a)) is a critical variable in the energy and water cycle of the Earth.atmosphere system and is a key input element for hydrology and land surface models. This is a preliminary study to evaluate estimation of T(sub a) from satellite remotely sensed land surface temperature (T(sub s)) by using MODIS-Terra data over two Eurasia regions: northern China and fUSSR. High correlations are observed in both regions between station-measured T(sub a) and MODIS T(sub s). The relationships between the maximum T(sub a) and daytime T(sub s) depend significantly on land cover types, but the minimum T(sub a) and nighttime T(sub s) have little dependence on the land cover types. The largest difference between maximum T(sub a) and daytime T(sub s) appears over the barren and sparsely vegetated area during the summer time. Using a linear regression method, the daily maximum T(sub a) were estimated from 1 km resolution MODIS T(sub s) under clear-sky conditions with coefficients calculated based on land cover types, while the minimum T(sub a) were estimated without considering land cover types. The uncertainty, mean absolute error (MAE), of the estimated maximum T(sub a) varies from 2.4 C over closed shrublands to 3.2 C over grasslands, and the MAE of the estimated minimum Ta is about 3.0 C.

Heat and turbulent kinetic energy budgets for surface layer cooling induced by the passage of Hurricane Frances (2004)

NASA Astrophysics Data System (ADS)

Huang, Peisheng; Sanford, Thomas B.; Imberger, JöRg

2009-12-01

Heat and turbulent kinetic energy budgets of the ocean surface layer during the passage of Hurricane Frances were examined using a three-dimensional hydrodynamic model. In situ data obtained with the Electromagnetic-Autonomous Profiling Explorer (EM-APEX) floats were used to set up the initial conditions of the model simulation and to compare to the simulation results. The spatial heat budgets reveal that during the hurricane passage, not only the entrainment in the bottom of surface mixed layer but also the horizontal water advection were important factors determining the spatial pattern of sea surface temperature. At the free surface, the hurricane-brought precipitation contributed a negligible amount to the air-sea heat exchange, but the precipitation produced a negative buoyancy flux in the surface layer that overwhelmed the instability induced by the heat loss to the atmosphere. Integrated over the domain within 400 km of the hurricane eye on day 245.71 of 2004, the rate of heat anomaly in the surface water was estimated to be about 0.45 PW (1 PW = 1015 W), with about 20% (0.09 PW in total) of this was due to the heat exchange at the air-sea interface, and almost all the remainder (0.36 PW) was downward transported by oceanic vertical mixing. Shear production was the major source of turbulent kinetic energy amounting 88.5% of the source of turbulent kinetic energy, while the rest (11.5%) was attributed to the wind stirring at sea surface. The increase of ocean potential energy due to vertical mixing represented 7.3% of the energy deposited by wind stress.

Time of flight spectrometer for background-free positron annihilation induced Auger electron spectroscopy

DOE Office of Scientific and Technical Information (OSTI.GOV)

Mukherjee, S.; Shastry, K.; Anto, C. V.

2016-03-15

We describe a novel spectrometer designed for positron annihilation induced Auger electron spectroscopy employing a time-of-flight spectrometer. The spectrometer’s new configuration enables us to implant monoenergetic positrons with kinetic energies as low as 1.5 eV on the sample while simultaneously allowing for the detection of electrons emitted from the sample surface at kinetic energies ranging from ∼500 eV to 0 eV. The spectrometer’s unique characteristics made it possible to perform (a) first experiments demonstrating the direct transition of a positron from an unbound scattering state to a bound surface state and (b) the first experiments demonstrating that Auger electron spectramore » can be obtained down to 0 eV without the beam induced secondary electron background obscuring the low energy part of the spectra. Data are presented which show alternative means of estimating positron surface state binding energy and background-free Auger spectra.« less

Free energy surfaces for the interaction of D-glucose with planar aromatic groups in aqueous solution

NASA Astrophysics Data System (ADS)

Wohlert, Jakob; Schnupf, Udo; Brady, John W.

2010-10-01

Multidimensional potentials of mean force for the interactions in aqueous solution of both anomers of D-glucopyranose with two planar aromatic molecules, indole and para-methyl-phenol, have been calculated using molecular dynamics simulations with umbrella sampling and were subsequently used to estimate binding free energies. Indole and para-methyl-phenol serve as models for the side chains of the amino acids tryptophan and tyrosine, respectively. In all cases, a weak affinity between the glucose molecules and the flat aromatic surfaces was found. The global minimum for these interactions was found to be for the case when the pseudoplanar face of β-D-glucopyranose is stacked against the planar surfaces of the aromatic residues. The calculated binding free energies are in good agreement with both experiment and previous simulations. The multidimensional free energy maps suggest a mechanism that could lend kinetic stability to the complexes formed by sugars bound to sugar-binding proteins.

A New Potential Energy Surface for N+O2: Is There an NOO Minimum?

NASA Technical Reports Server (NTRS)

Walch, Stephen P.

1995-01-01

We report a new calculation of the N+02 potential energy surface using complete active space self-consistent field internally contracted configuration interaction with the Dunning correlation consistent basis sets. The peroxy isomer of N02 is found to be a very shallow minimum separated from NO+O by a barrier of only 0.3 kcal/mol (excluding zero-point effects). The entrance channel barrier height is estimated to be 8.6 kcal/mol for ICCI+Q calculations correlating all but the Ols and N1s electrons with a cc-p VQZ basis set.

An evaluation of gas transfer velocity parameterizations during natural convection using DNS

NASA Astrophysics Data System (ADS)

Fredriksson, Sam T.; Arneborg, Lars; Nilsson, Hâkan; Zhang, Qi; Handler, Robert A.

2016-02-01

Direct numerical simulations (DNS) of free surface flows driven by natural convection are used to evaluate different methods of estimating air-water gas exchange at no-wind conditions. These methods estimate the transfer velocity as a function of either the horizontal flow divergence at the surface, the turbulent kinetic energy dissipation beneath the surface, the heat flux through the surface, or the wind speed above the surface. The gas transfer is modeled via a passive scalar. The Schmidt number dependence is studied for Schmidt numbers of 7, 150 and 600. The methods using divergence, dissipation and heat flux estimate the transfer velocity well for a range of varying surface heat flux values, and domain depths. The two evaluated empirical methods using wind (in the limit of no wind) give reasonable estimates of the transfer velocity, depending however on the surface heat flux and surfactant saturation. The transfer velocity is shown to be well represented by the expression, ks=A |Bν|1/4 Sc-n, where A is a constant, B is the buoyancy flux, ν is the kinematic viscosity, Sc is the Schmidt number, and the exponent n depends on the water surface characteristics. The results suggest that A=0.39 and n≈1/2 and n≈2/3 for slip and no-slip boundary conditions at the surface, respectively. It is further shown that slip and no-slip boundary conditions predict the heat transfer velocity corresponding to the limits of clean and highly surfactant contaminated surfaces, respectively. This article was corrected on 22 MAR 2016. See the end of the full text for details.

Estimating discharge of shallow groundwater by transpiration from greasewood in the Northern Great Basin

USGS Publications Warehouse

Nichols, William D.

1993-01-01

Evapotranspiration from bare soil and phreatophytes is a principal mechanism of groundwater discharge in arid and semiarid regions of the midwestern and western United States including the Great Basin. The imbalance between independent estimates of groundwater recharge from precipitation and of groundwater discharge based on estimates of groundwater evapotranspiration leads to large uncertainties in groundwater budgets. Few studies have addressed this problem. Energy budget micrometeorological field studies were conducted in a stand of sparse-canopy greasewood growing in an area of shallow groundwater in the western Great Basin during the summer of 1989. The data were used to calculate above-canopy fluxes of sensible and latent heat using the energy budget-Bowen ratio method. The calculated energy budget fluxes were used, with soil surface and plant canopy temperature measurements, to calibrate and apply a two-component, energy-combination model that partitions the energy and heat fluxes between bare soil and the canopy. This permitted the separation of evaporation from the soil and transpiration from greasewood. The calibrated model was used to estimate daily transpiration of groundwater by greasewood growing in an area with a depth to water of about 2 m. The daily rate of groundwater discharge by transpiration during July and August was estimated to be 2.4 mm. A period of 100 days for groundwater discharge at this rate was assumed to estimate an annual discharge of groundwater of 24 cm at the study site.

Surface photovoltage in exciton absorption range in CdS

NASA Technical Reports Server (NTRS)

Morawski, A.; Banisch, R.; Lagowski, J.

1977-01-01

The high resolution, intrinsic spectra of surface photovoltage are reported for semiconducting n-type CdS single crystals. At reduced temperatures (120-160 K) the spectra exhibit three sharp maxima due to A, B and C free exciton transitions. Energy positions of these lines and valence band parameters (spin-orbit and crystal field splittings) estimated from surface photovoltage are in good agreement with values obtained by other methods. The excitonic transitions are very sensitive to surface treatment, i.e. polishing, etching, background illumination and surface doping. The mechanism of direct interaction of free excitons with surface states is proposed to explain exciton lines in surface photovoltage.

Thermal Infrared Remote Sensing for Analysis of Landscape Ecological Processes: Methods and Applications

NASA Technical Reports Server (NTRS)

Quattrochi, Dale A.; Luvall, Jeffrey C.

1998-01-01

Thermal Infrared (TIR) remote sensing data can provide important measurements of surface energy fluxes and temperatures, which are integral to understanding landscape processes and responses. One example of this is the successful application of TIR remote sensing data to estimate evapotranspiration and soil moisture, where results from a number of studies suggest that satellite-based measurements from TIR remote sensing data can lead to more accurate regional-scale estimates of daily evapotranspiration. With further refinement in analytical techniques and models, the use of TIR data from airborne and satellite sensors could be very useful for parameterizing surface moisture conditions and developing better simulations of landscape energy exchange over a variety of conditions and space and time scales. Thus, TIR remote sensing data can significantly contribute to the observation, measurement, and analysis of energy balance characteristics (i.e., the fluxes and redistribution of thermal energy within and across the land surface) as an implicit and important aspect of landscape dynamics and landscape functioning. The application of TIR remote sensing data in landscape ecological studies has been limited, however, for several fundamental reasons that relate primarily to the perceived difficulty in use and availability of these data by the landscape ecology community, and from the fragmentation of references on TIR remote sensing throughout the scientific literature. It is our purpose here to provide evidence from work that has employed TIR remote sensing for analysis of landscape characteristics to illustrate how these data can provide important data for the improved measurement of landscape energy response and energy flux relationships. We examine the direct or indirect use of TIR remote sensing data to analyze landscape biophysical characteristics, thereby offering some insight on how these data can be used more robustly to further the understanding and modeling of landscape ecological processes.

Scale - dependent effects on the surface energy fluxes modelling in Iberian oak-savanna (dehesa) using the Two-Source Energy Balance (TSEB)

NASA Astrophysics Data System (ADS)

Andreu, Ana; Nieto, Hector; Gómez-Giráldez, Pedro; González-Dugo, Maria P.

2017-04-01

Iberian semi-arid oak-savannas (dehesas) are complex ecosystems where bare soil and different layers of vegetation (grass/scrubs/trees) are distributed following heterogeneous patterns. An assumption of the two source energy balance models is that the effective source/sink for turbulent flux exchange at the surface(canopy/soil) is described by a bulk radiometric surface temperature (TRAD) and resistance. Therefore, the agreement of the TRAD used as an input to these models, with the "bulk" concept (determined by the spatial resolution), will influence the final energy fluxes estimations. The representativeness of the field-ground measurements, the spatial resolution of sensors, the averaging and the up-scaling of TRAD and the ecosystem vegetation parameters, will be crucial for the precision of the results, more than in homogeneous landscapes. The aim of this study is to analyze the scale-effects derived from TSEB application, comparing the observed energy fluxes and the estimated ones obtained from multiple TRAD data sources of different nature: tree/grass/soil ground-based observations, tower footprint, hyperspectral reflectance imagery acquired with an airborne platform, medium (Landsat) and low spatial resolution satellite data (Sentinel 3, MODIS), and how the up-scaling of the vegetation structural characteristics contribute to the discrepancies. The study area selected for this purpose is a dehesa site (Santa Clotilde, Cordoba), which present canopy mosaics (oak, annual grasses and bushes) differing in phenology, physiology and functioning, and bare soil, all of them influencing the turbulent and radiative exchanges.

Aerodynamic method for obtaining the soil water retention curve

NASA Astrophysics Data System (ADS)

Alekseev, V. V.; Maksimov, I. I.

2013-07-01

A new method for the rapid plotting of the soil water retention curve (SWRC) has been proposed that considers the soil water as an environment limited by the soil solid phase on one side and by the soil air on the other side. Both contact surfaces have surface energies, which play the main role in water retention. The use of an idealized soil model with consideration for the nonequilibrium thermodynamic laws and the aerodynamic similarity principles allows us to estimate the volumetric specific surface areas of soils and, using the proposed pedotransfer function (PTF), to plot the SWRC. The volumetric specific surface area of the solid phase, the porosity, and the specific free surface energy at the water-air interface are used as the SWRC parameters. Devices for measuring the parameters are briefly described. The differences between the proposed PTF and the experimental data have been analyzed using the statistical processing of the data.

DOE Office of Scientific and Technical Information (OSTI.GOV)

Han, Chang W.; Iddir, Hakim; Uzun, Alper

To address the challenge of fast, direct atomic-scale visualization of the diffusion of atoms and clusters on surfaces, we used aberration-corrected scanning transmission electron microscopy (STEM) with high scan speeds (as little as ~0.1 s per frame) to visualize the diffusion of (1) a heavy atom (Ir) on the surface of a support consisting of light atoms, MgO(100), and (2) an Ir 3 cluster on MgO(110). Sequential Z-contrast images elucidate the diffusion mechanisms, including the hopping of Ir1 and the rotational migration of Ir 3 as two Ir atoms remain anchored to the surface. Density functional theory (DFT) calculations providedmore » estimates of the diffusion energy barriers and binding energies of the iridium species to the surfaces. The results show how the combination of fast-scan STEM and DFT calculations allow real-time visualization and fundamental understanding of surface diffusion phenomena pertaining to supported catalysts and other materials.« less

Surface diffusion of a carbon-adatom on Au(110) surfaces

NASA Astrophysics Data System (ADS)

Kim, E.; Safavi-Naini, A.; Hite, D. A.; McKay, K. S.; Pappas, D. P.; Weck, P. F.; Sadeghpour, H. R.

We have investigated the surface diffusion of carbon-adatom on gold surfaces using density functional theory and detailed scanning probe microscopy. The decoherence of trapped-ion quantum gates due to heating of their motional modes is a fundamental science and engineering problem. In an effort to understand heating at the trap-electrode surfaces, we investigate the possible source of noise by focusing on the diffusion of carbon-containing adsorbates onto the Au(110) surface. In this study, we show how the diffusive motion of carbon adatom on gold surface significantly affects the energy landscape and adatom dipole moment variation. A simple model for the diffusion noise, which varies quadratically with the variation of the dipole moment, qualitatively reproduces the measured noise spectrum, and the estimate of the noise spectral density is in accord with measured values. Sandia National Laboratories is a multiprogram laboratory operated by Sandia Corporation, a wholly owned subsidiary of Lockheed Martin Company, for the United States Department of Energy's NNSA under Contract DE-AC04-94AL85000.

The Hydrological Sensitivity to Global Warming and Solar Geoengineering Derived from Thermodynamic Constraints

DOE Office of Scientific and Technical Information (OSTI.GOV)

Kleidon, Alex; Kravitz, Benjamin S.; Renner, Maik

2015-01-16

We derive analytic expressions of the transient response of the hydrological cycle to surface warming from an extremely simple energy balance model in which turbulent heat fluxes are constrained by the thermodynamic limit of maximum power. For a given magnitude of steady-state temperature change, this approach predicts the transient response as well as the steady-state change in surface energy partitioning and the hydrologic cycle. We show that the transient behavior of the simple model as well as the steady state hydrological sensitivities to greenhouse warming and solar geoengineering are comparable to results from simulations using highly complex models. Many ofmore » the global-scale hydrological cycle changes can be understood from a surface energy balance perspective, and our thermodynamically-constrained approach provides a physically robust way of estimating global hydrological changes in response to altered radiative forcing.« less

Well-tempered metadynamics as a tool for characterizing multi-component, crystalline molecular machines.

PubMed

Ilott, Andrew J; Palucha, Sebastian; Hodgkinson, Paul; Wilson, Mark R

2013-10-10

The well-tempered, smoothly converging form of the metadynamics algorithm has been implemented in classical molecular dynamics simulations and used to obtain an estimate of the free energy surface explored by the molecular rotations in the plastic crystal, octafluoronaphthalene. The biased simulations explore the full energy surface extremely efficiently, more than 4 orders of magnitude faster than unbiased molecular dynamics runs. The metadynamics collective variables used have also been expanded to include the simultaneous orientations of three neighboring octafluoronaphthalene molecules. Analysis of the resultant three-dimensional free energy surface, which is sampled to a very high degree despite its significant complexity, demonstrates that there are strong correlations between the molecular orientations. Although this correlated motion is of limited applicability in terms of exploiting dynamical motion in octafluoronaphthalene, the approach used is extremely well suited to the investigation of the function of crystalline molecular machines.

Energy budgets and resistances to energy transport in sparsely vegetated rangeland

USGS Publications Warehouse

Nichols, W.D.

1992-01-01

Partitioning available energy between plants and bare soil in sparsely vegetated rangelands will allow hydrologists and others to gain a greater understanding of water use by native vegetation, especially phreatophytes. Standard methods of conducting energy budget studies result in measurements of latent and sensible heat fluxes above the plant canopy which therefore include the energy fluxes from both the canopy and the soil. One-dimensional theoretical numerical models have been proposed recently for the partitioning of energy in sparse crops. Bowen ratio and other micrometeorological data collected over phreatophytes growing in areas of shallow ground water in central Nevada were used to evaluate the feasibility of using these models, which are based on surface and within-canopy aerodynamic resistances, to determine heat and water vapor transport in sparsely vegetated rangelands. The models appear to provide reasonably good estimates of sensible heat flux from the soil and latent heat flux from the canopy. Estimates of latent heat flux from the soil were less satisfactory. Sensible heat flux from the canopy was not well predicted by the present resistance formulations. Also, estimates of total above-canopy fluxes were not satisfactory when using a single value for above-canopy bulk aerodynamic resistance. ?? 1992.

Potential for natural evaporation as a reliable renewable energy resource

DOE Office of Scientific and Technical Information (OSTI.GOV)

Cavusoglu, Ahmet-Hamdi; Chen, Xi; Gentine, Pierre

About 50% of the solar energy absorbed at the Earth’s surface drives evaporation, fueling the water cycle that affects various renewable energy resources, such as wind and hydropower. Recent advances demonstrate our nascent ability to convert evaporation energy into work, yet there is little understanding about the potential of this resource. Here in this paper we study the energy available from natural evaporation to predict the potential of this ubiquitous resource. We find that natural evaporation from open water surfaces could provide power densities comparable to current wind and solar technologies while cutting evaporative water losses by nearly half. Wemore » estimate up to 325 GW of power is potentially available in the United States. Strikingly, water’s large heat capacity is sufficient to control power output by storing excess energy when demand is low, thus reducing intermittency and improving reliability. Our findings motivate the improvement of materials and devices that convert energy from evaporation.« less

Potential for natural evaporation as a reliable renewable energy resource

DOE PAGES

Cavusoglu, Ahmet-Hamdi; Chen, Xi; Gentine, Pierre; ...

2017-09-26

About 50% of the solar energy absorbed at the Earth’s surface drives evaporation, fueling the water cycle that affects various renewable energy resources, such as wind and hydropower. Recent advances demonstrate our nascent ability to convert evaporation energy into work, yet there is little understanding about the potential of this resource. Here in this paper we study the energy available from natural evaporation to predict the potential of this ubiquitous resource. We find that natural evaporation from open water surfaces could provide power densities comparable to current wind and solar technologies while cutting evaporative water losses by nearly half. Wemore » estimate up to 325 GW of power is potentially available in the United States. Strikingly, water’s large heat capacity is sufficient to control power output by storing excess energy when demand is low, thus reducing intermittency and improving reliability. Our findings motivate the improvement of materials and devices that convert energy from evaporation.« less

Sensitivity Analysis on Remote Sensing Evapotranspiration Algorithm of Surface Energy Balance for Land

NASA Astrophysics Data System (ADS)

Wang, J.; Samms, T.; Meier, C.; Simmons, L.; Miller, D.; Bathke, D.

2005-12-01

Spatial evapotranspiration (ET) is usually estimated by Surface Energy Balance Algorithm for Land. The average accuracy of the algorithm is 85% on daily basis and 95% on seasonable basis. However, the accuracy of the algorithm varies from 67% to 95% on instantaneous ET estimates and, as reported in 18 studies, 70% to 98% on 1 to 10-day ET estimates. There is a need to understand the sensitivity of the ET calculation with respect to the algorithm variables and equations. With an increased understanding, information can be developed to improve the algorithm, and to better identify the key variables and equations. A Modified Surface Energy Balance Algorithm for Land (MSEBAL) was developed and validated with data from a pecan orchard and an alfalfa field. The MSEBAL uses ground reflectance and temperature data from ASTER sensors along with humidity, wind speed, and solar radiation data from a local weather station. MSEBAL outputs hourly and daily ET with 90 m by 90 m resolution. A sensitivity analysis was conducted for MSEBAL on ET calculation. In order to observe the sensitivity of the calculation to a particular variable, the value of that variable was changed while holding the magnitudes of the other variables. The key variables and equations to which the ET calculation most sensitive were determined in this study. href='http://weather.nmsu.edu/pecans/SEBALFolder/San%20Francisco%20AGU%20meeting/ASensitivityAnalysisonMSE">http://weather.nmsu.edu/pecans/SEBALFolder/San%20Francisco%20AGU%20meeting/ASensitivityAnalysisonMSE

Recent Improvements in Retrieving Near-Surface Air Temperature and Humidity Using Microwave Remote Sensing

NASA Technical Reports Server (NTRS)

Roberts, J. Brent

2010-01-01

Detailed studies of the energy and water cycles require accurate estimation of the turbulent fluxes of moisture and heat across the atmosphere-ocean interface at regional to basin scale. Providing estimates of these latent and sensible heat fluxes over the global ocean necessitates the use of satellite or reanalysis-based estimates of near surface variables. Recent studies have shown that errors in the surface (10 meter)estimates of humidity and temperature are currently the largest sources of uncertainty in the production of turbulent fluxes from satellite observations. Therefore, emphasis has been placed on reducing the systematic errors in the retrieval of these parameters from microwave radiometers. This study discusses recent improvements in the retrieval of air temperature and humidity through improvements in the choice of algorithms (linear vs. nonlinear) and the choice of microwave sensors. Particular focus is placed on improvements using a neural network approach with a single sensor (Special Sensor Microwave/Imager) and the use of combined sensors from the NASA AQUA satellite platform. The latter algorithm utilizes the unique sampling available on AQUA from the Advanced Microwave Scanning Radiometer (AMSR-E) and the Advanced Microwave Sounding Unit (AMSU-A). Current estimates of uncertainty in the near-surface humidity and temperature from single and multi-sensor approaches are discussed and used to estimate errors in the turbulent fluxes.

Assessment of Wind Datasets for Estimating Offshore Wind Energy along the Central California Coast

NASA Astrophysics Data System (ADS)

Wang, Y. H.; Walter, R. K.; Ruttenberg, B.; White, C.

2017-12-01

Offshore renewable energy along the central California coastline has gained significant interest in recent years. We present a comprehensive analysis of near-surface wind datasets available in this region to facilitate future estimates of wind power generation potential. The analyses are based on local NDBC buoys, satellite-based measurements (QuickSCAT and CCMP V2.0), reanalysis products (NARR and MERRA), and a regional climate model (WRF). There are substantial differences in the diurnal signal during different months among the various products (i.e., satellite-based, reanalysis, and modeled) relative to the local buoys. Moreover, the datasets tended to underestimate wind speed under light wind conditions and overestimate under strong wind conditions. In addition to point-to-point comparisons against local buoys, the spatial variations of bias and error in both the reanalysis products and WRF model data in this region were compared against satellite-based measurements. NARR's bias and root-mean-square-error were generally small in the study domain and decreased with distance from coastlines. Although its smaller spatial resolution is likely to be insufficient to reveal local effects, the small bias and error in near-surface winds, as well as the availability of wind data at the proposed turbine hub heights, suggests that NARR is an ideal candidate for use in offshore wind energy production estimates along the central California coast. The framework utilized here could be applied in other site-specific regions where offshore renewable energy is being considered.

Modeling apple surface temperature dynamics based on weather data.

PubMed

Li, Lei; Peters, Troy; Zhang, Qin; Zhang, Jingjin; Huang, Danfeng

2014-10-27

The exposure of fruit surfaces to direct sunlight during the summer months can result in sunburn damage. Losses due to sunburn damage are a major economic problem when marketing fresh apples. The objective of this study was to develop and validate a model for simulating fruit surface temperature (FST) dynamics based on energy balance and measured weather data. A series of weather data (air temperature, humidity, solar radiation, and wind speed) was recorded for seven hours between 11:00-18:00 for two months at fifteen minute intervals. To validate the model, the FSTs of "Fuji" apples were monitored using an infrared camera in a natural orchard environment. The FST dynamics were measured using a series of thermal images. For the apples that were completely exposed to the sun, the RMSE of the model for estimating FST was less than 2.0 °C. A sensitivity analysis of the emissivity of the apple surface and the conductance of the fruit surface to water vapour showed that accurate estimations of the apple surface emissivity were important for the model. The validation results showed that the model was capable of accurately describing the thermal performances of apples under different solar radiation intensities. Thus, this model could be used to more accurately estimate the FST relative to estimates that only consider the air temperature. In addition, this model provides useful information for sunburn protection management.

Modeling Apple Surface Temperature Dynamics Based on Weather Data

PubMed Central

Li, Lei; Peters, Troy; Zhang, Qin; Zhang, Jingjin; Huang, Danfeng

2014-01-01

The exposure of fruit surfaces to direct sunlight during the summer months can result in sunburn damage. Losses due to sunburn damage are a major economic problem when marketing fresh apples. The objective of this study was to develop and validate a model for simulating fruit surface temperature (FST) dynamics based on energy balance and measured weather data. A series of weather data (air temperature, humidity, solar radiation, and wind speed) was recorded for seven hours between 11:00–18:00 for two months at fifteen minute intervals. To validate the model, the FSTs of “Fuji” apples were monitored using an infrared camera in a natural orchard environment. The FST dynamics were measured using a series of thermal images. For the apples that were completely exposed to the sun, the RMSE of the model for estimating FST was less than 2.0 °C. A sensitivity analysis of the emissivity of the apple surface and the conductance of the fruit surface to water vapour showed that accurate estimations of the apple surface emissivity were important for the model. The validation results showed that the model was capable of accurately describing the thermal performances of apples under different solar radiation intensities. Thus, this model could be used to more accurately estimate the FST relative to estimates that only consider the air temperature. In addition, this model provides useful information for sunburn protection management. PMID:25350507

Electron emission from surfaces resulting from low energy positron bombardment

NASA Astrophysics Data System (ADS)

Mukherjee, Saurabh

Measurements of the secondary electron energy spectra resulting from very low energy positron bombardment of a polycrystalline Au and Cu (100) surfaces are presented that provide evidence for a single step transition from an unbound scattering state to an image potential bound state. The primary positron energy threshold for secondary electron emission and energy cutoff of the positron induced secondary electron energy peak are consistent with an Auger like process in which an incident positron make a transition from a scattering state to a surface-image potential bound while transferring all of the energy difference to an outgoing secondary electron. We term this process: the Auger mediated quantum sticking effect (AQSE). The intensities of the positron induced secondary electron peak are used to estimate the probability of this process as a function of incident positron energy. Positron annihilation induced Auger spectra (PAES) of Cu and Au are presented that are free of all primary beam induced secondary electron background. This background was eliminated by setting the positron beam energy below AQSE threshold. The background free PAES spectra obtained include the first measurements of the low energy tail of CVV Auger transitions all the way down to zero kinetic energy. The integrated intensity of this tail is several times larger than Auger peak itself which provides strong evidence for multi-electron Auger processes.

Quantifying planetary limits of Earth system processes relevant to human activity using a thermodynamic view of the whole Earth system

NASA Astrophysics Data System (ADS)

Kleidon, Axel

2014-05-01

Food, water, and energy play, obviously, a central role in maintaining human activity. In this contribution, I derive estimates for the fundamental limits on the rates by which these resources are provided by Earth system processes and the levels at which these can be used sustainably. The key idea here is that these resources are, directly or indirectly, generated out of the energy associated with the absorption of sunlight, and that the energy conversions from sunlight to other forms ultimately limit the generation of these resources. In order to derive these conversion limits, we need to trace the links between the processes that generate food, water and energy to the absorption of sunlight. The resource "food" results from biomass production by photosynthesis, which requires light and a sufficient magnitude of gas exchange of carbon dioxide at the surface, which is maintained by atmospheric motion which in turn is generated out of differential radiative heating and cooling. The resource "water" is linked to hydrologic cycling, with its magnitude being linked to the latent heat flux of the surface energy balance and water vapor transport in the atmosphere which is also driven by differential radiative heating and cooling. The availability of (renewable) energy is directly related to the generation of different forms of energy of climate system processes, such as the kinetic energy of atmospheric motion, which, again, relates to radiative heating differences. I use thermodynamics and its limits as a basis to establish the planetary limits of these processes and use a simple model to derive first-order estimates. These estimates compare quite well with observations, suggesting that this thermodynamic view of the whole Earth system provides an objective, physical basis to define and quantify planetary boundaries as well as the factors that shape these boundaries.

Faraday efficiency and mechanism of electrochemical surface reactions: CO2 reduction and H2 formation on Pt(111).

PubMed

Hussain, Javed; Jónsson, Hannes; Skúlason, Egill

2016-12-22

An atomic scale model of the electrical double layer is used to calculate the mechanism and rate of electrochemical reduction of CO 2 as well as H 2 formation at a Pt(111) electrode. The water layer contains solvated protons and the electrode has excess electrons at the surface. Density functional theory within the generalized gradient approximation is used to describe the electronic structure while the mechanism and activation energy of the various elementary reactions is obtained by calculating minimum energy paths using the nudged elastic band method. The applied electrical potential is deduced from the calculated work function. The optimal reaction mechanism for CO 2 reduction to either methane or methanol is found and the estimated rate compared with that of the competing reaction, H 2 formation. When the free energy of only the intermediates and reactants is taken into account, not the activation energy, Pt(111) would seem to be a good electrocatalyst for CO 2 reduction, significantly better than Cu(111). This, however, contradicts experimental findings. Detailed calculations reported here show that the activation energy for CO 2 reduction is high for both Heyrovsky and Tafel mechanisms on Pt(111) in the relevant range of applied potential. The rate-limiting step of the Heyrovsky mechanism, *COOH + H + + e - → *CO + H 2 O, is estimated to have an activation energy of 0.95 eV at -0.9 V vs. standard hydrogen electrode. Under the same conditions, the activation energy for H 2 formation is estimated to be only 0.5 eV. This explains why attempts to reduce CO 2 using platinum electrodes have produced only H 2 . A comparison is made with analogous results for Cu(111) [J. Hussain et al., Procedia Comput. Sci., 2015, 51, 1865] where a reaction mechanism with low activation energy for CO 2 electroreduction to methane was identified. The difference between the two electrocatalysts is discussed.

Satellite Estimation of Daily Land Surface Water Vapor Pressure Deficit from AMSR- E

NASA Astrophysics Data System (ADS)

Jones, L. A.; Kimball, J. S.; McDonald, K. C.; Chan, S. K.; Njoku, E. G.; Oechel, W. C.

2007-12-01

Vapor pressure deficit (VPD) is a key variable for monitoring land surface water and energy exchanges, and estimating plant water stress. Multi-frequency day/night brightness temperatures from the Advanced Microwave Scanning Radiometer on EOS Aqua (AMSR-E) were used to estimate daily minimum and average near surface (2 m) air temperatures across a North American boreal-Arctic transect. A simple method for determining daily mean VPD (Pa) from AMSR-E air temperature retrievals was developed and validated against observations across a regional network of eight study sites ranging from boreal grassland and forest to arctic tundra. The method assumes that the dew point and minimum daily air temperatures tend to equilibrate in areas with low night time temperatures and relatively moist conditions. This assumption was tested by comparing the VPD algorithm results derived from site daily temperature observations against results derived from AMSR-E retrieved temperatures alone. An error analysis was conducted to determine the amount of error introduced in VPD estimates given known levels of error in satellite retrieved temperatures. Results indicate that the assumption generally holds for the high latitude study sites except for arid locations in mid-summer. VPD estimates using the method with AMSR-E retrieved temperatures compare favorably with site observations. The method can be applied to land surface temperature retrievals from any sensor with day and night surface or near-surface thermal measurements and shows potential for inferring near-surface wetness conditions where dense vegetation may hinder surface soil moisture retrievals from low-frequency microwave sensors. This work was carried out at The University of Montana, at San Diego State University, and at the Jet Propulsion Laboratory, California Institute of Technology, under contract to the National Aeronautics and Space Administration.

Validation and application of MODIS-derived clean snow albedo and dust radiative forcing

NASA Astrophysics Data System (ADS)

Rittger, K. E.; Bryant, A. C.; Seidel, F. C.; Bair, E. H.; Skiles, M.; Goodale, C. E.; Ramirez, P.; Mattmann, C. A.; Dozier, J.; Painter, T.

2012-12-01

Snow albedo is an important control on snowmelt. Though albedo evolution of aging snow can be roughly modeled from grain growth, dust and other light absorbing impurities are extrinsic and therefore must be measured. Estimates of clean snow albedo and surface radiative forcing from impurities, which can be inferred from MODIS 500 m surface reflectance products, can provide this driving data for snowmelt models. Here we use MODSCAG (MODIS snow covered area and grain size) to estimate the clean snow albedo and MODDRFS (MODIS dust radiative forcing of snow) to estimate the additional absorbed solar radiation from dust and black carbon. With its finer spatial (20 m) and spectral (10 nm) resolutions, AVIRIS provides a way to estimate the accuracy of MODIS products and understand variability of snow albedo at a finer scale that we explore though a range of topography. The AVIRIS database includes images from late in the accumulation season through the melt season when we are most interested in changes in snow albedo. In addition to the spatial validation, we employ the best estimate of albedo from MODIS in an energy balance reconstruction model to estimate the maximum snow water equivalent. MODDRFS calculates radiative forcing only in pixels that are completely snow-covered, so we spatially interpolate the product to estimate the forcing in all pixels where MODSCAG has given us estimates of clean snow albedo. Comparisons with snow pillows and courses show better agreement when the radiative forcing from absorbing impurities is included in the energy balance reconstruction.

Combining Observations in the Reflective Solar and Thermal Domains for Improved Mapping of Carbon, Water and Energy FLuxes

NASA Technical Reports Server (NTRS)

Houborg, Rasmus; Anderson, Martha; Kustas, Bill; Rodell, Matthew

2011-01-01

This study investigates the utility of integrating remotely sensed estimates of leaf chlorophyll (C(sub ab)) into a thermal-based Two-Source Energy Balance (TSEB) model that estimates land-surface CO2 and energy fluxes using an analytical, light-use-efficiency (LUE) based model of canopy resistance. Day to day variations in nominal LUE (LUE(sub n)) were assessed for a corn crop field in Maryland U.S.A. through model calibration with CO2 flux tower observations. The optimized daily LUE(sub n) values were then compared to estimates of C(sub ab) integrated from gridded maps of chlorophyll content weighted over the tower flux source area. Changes in Cab exhibited a curvilinear relationship with corresponding changes in daily calibrated LUE(sub n) values derived from the tower flux data, and hourly water, energy and carbon flux estimation accuracies from TSEB were significantly improved when using C(sub ab) for delineating spatio-temporal variations in LUE(sub n). The results demonstrate the synergy between thermal infrared and shortwave reflective wavebands in producing valuable remote sensing data for monitoring of carbon and water fluxes.

Estimating surface energy fluxes over an Andalusian Dehesa ecosystem using a thermal-based two-source energy balance model and validation with flux tower measurements

USDA-ARS?s Scientific Manuscript database

The Dehesa, the most widespread agroforestry land-use system in Europe (˜ 3 million ha), is recognized as an example of sustainable land use and for its importance in the rural economy (Diaz et al., 1997; Plieninger and Wilbrand, 2001). It consists of widely-spaced oak forest (mostly Quercus Ilex L....

Cutting a Drop of Water Pinned by Wire Loops Using a Superhydrophobic Surface and Knife

PubMed Central

Yanashima, Ryan; García, Antonio A.; Aldridge, James; Weiss, Noah; Hayes, Mark A.; Andrews, James H.

2012-01-01

A water drop on a superhydrophobic surface that is pinned by wire loops can be reproducibly cut without formation of satellite droplets. Drops placed on low-density polyethylene surfaces and Teflon-coated glass slides were cut with superhydrophobic knives of low-density polyethylene and treated copper or zinc sheets, respectively. Distortion of drop shape by the superhydrophobic knife enables a clean break. The driving force for droplet formation arises from the lower surface free energy for two separate drops, and it is modeled as a 2-D system. An estimate of the free energy change serves to guide when droplets will form based on the variation of drop volume, loop spacing and knife depth. Combining the cutting process with an electrofocusing driving force could enable a reproducible biomolecular separation without troubling satellite drop formation. PMID:23029297

An Analysis of the Effect of Surface Heat Exchange on the Thermal Behavior of an Idealized Aquifer Thermal Energy Storage System

NASA Astrophysics Data System (ADS)

Güven, O.; Melville, J. G.; Molz, F. J.

1983-06-01

Analytical expressions are derived for the temperature distribution and the mean temperature of an idealized aquifer thermal energy storage (ATES) system, taking into account the heat exchange at the ground surface and the finite thickness of the overlying layer above the storage aquifer. The analytical expressions for the mean temperature may be used to obtain rough estimates of first-cycle recovery factors for preliminary evaluations of shallow confined or unconfined ATES systems. The results, which are presented in nondimensional plots, indicate that surface heat exchange may have a significant influence on the thermal behavior of shallow ATES systems. Thus it is suggested that the effects of surface heat exchange should be considered carefully and included in the detailed analyses of such ATES systems.

The Mercury Laser Altimeter Instrument for the MESSENGER Mission

NASA Technical Reports Server (NTRS)

Cavanaugh, John F.; Smith, James C.; Sun, Xiaoli; Bartels, Arlin E.; Ramos-Izquierdo, Luis; Krebs, Danny J.; Novo-Gradac, Anne marie; McGarry, Jan F.; Trunzo, Raymond; Britt, Jamie L.

2006-01-01

The Mercury Laser Altimeter (MLA) is one of the payload science instruments on the MErcury Surface, Space ENvironment, GEochemistry, and Ranging (MESSENGER) mission, which launched on 3 August 2004. The altimeter will measure the round trip time-of-flight of transmitted laser pulses reflected from the surface of the planet that, in combination with the spacecraft orbit position and pointing data, gives a high-precision measurement of surface topography referenced to Mercury's center of mass. The altimeter measurements will be used to determine the planet's forced librations by tracking the motion of large-scale topographic features as a function of time. MLA's laser pulse energy monitor and the echo pulse energy estimate will provide an active measurement of the surface reflectivity at 1064 nm. This paper describes the instrument design, prelaunch testing, calibration, and results of post-launch testing.

SILAR derived CdO films: Effect of triethanolamine on the surface morphology and optical bandgap energy

NASA Astrophysics Data System (ADS)

Sahin, B.; Aydin, R.

2018-07-01

Nanostructured CdO films have been successfully synthesized with different ratios of surfactant triethanolamine (TEA) under SILAR condition. The influence of addition of TEA on the physical properties of CdO nanoparticles was studied. The surface morphology of the films was studied by metallurgical microscope and SEM analysis. Surface topography of the film was studied by AFM. The structural properties of the samples were studied by X-ray diffraction (XRD). The XRD studies confirm that the deposited CdO films has cubic structure (111) preferred orientation with well-crystallinity and purity. The optical bandgap energy was estimated based on the UV-vis spectroscopies which were obtained in the range of 2.16 eV-2.46 eV. Our study is encouraging to get enhanced surface topography by surfactant TEA.

Modelling the line shape of very low energy peaks of positron beam induced secondary electrons measured using a time of flight spectrometer

NASA Astrophysics Data System (ADS)

Fairchild, A. J.; Chirayath, V. A.; Gladen, R. W.; Chrysler, M. D.; Koymen, A. R.; Weiss, A. H.

2017-01-01

In this paper, we present results of numerical modelling of the University of Texas at Arlington’s time of flight positron annihilation induced Auger electron spectrometer (UTA TOF-PAES) using SIMION® 8.1 Ion and Electron Optics Simulator. The time of flight (TOF) spectrometer measures the energy of electrons emitted from the surface of a sample as a result of the interaction of low energy positrons with the sample surface. We have used SIMION® 8.1 to calculate the times of flight spectra of electrons leaving the sample surface with energies and angles dispersed according to distribution functions chosen to model the positron induced electron emission process and have thus obtained an estimate of the true electron energy distribution. The simulated TOF distribution was convolved with a Gaussian timing resolution function and compared to the experimental distribution. The broadening observed in the simulated TOF spectra was found to be consistent with that observed in the experimental secondary electron spectra of Cu generated as a result of positrons incident with energy 1.5 eV to 901 eV, when a timing resolution of 2.3 ns was assumed.

Photoelectric dust levitation around airless bodies revised using realistic photoelectron velocity distributions

NASA Astrophysics Data System (ADS)

Senshu, H.; Kimura, H.; Yamamoto, T.; Wada, K.; Kobayashi, M.; Namiki, N.; Matsui, T.

2015-10-01

The velocity distribution function of photoelectrons from a surface exposed to solar UV radiation is fundamental to the electrostatic status of the surface. There is one and only one laboratory measurement of photoelectron emission from astronomically relevant material, but the energy distribution function was measured only in the emission angle from the normal to the surface of 0 to about π / 4. Therefore, the measured distribution is not directly usable to estimate the vertical structure of a photoelectric sheath above the surface. In this study, we develop a new analytical method to calculate an angle-resolved velocity distribution function of photoelectrons from the laboratory measurement data. We find that the photoelectric current and yield for lunar surface fines measured in a laboratory have been underestimated by a factor of two. We apply our new energy distribution function of photoelectrons to model the formation of photoelectric sheath above the surface of asteroid 433 Eros. Our model shows that a 0.1 μm-radius dust grain can librate above the surface of asteroid 433 Eros regardless of its launching velocity. In addition, a 0.5 μm grain can hover over the surface if the grain was launched at a velocity slower than 0.4 m/s, which is a more stringent condition for levitation than previous studies. However, a lack of high-energy data on the photoelectron energy distribution above 6 eV prevents us from firmly placing a constraint on the levitation condition.

Characterization of Turbulent Latent and Sensible Heat Flux Exchange Between the Atmosphere and Ocean in MERRA

NASA Technical Reports Server (NTRS)

Robert, J. Brent; Robertson, Franklin R.; Clayson, Carol Anne; Bosilovich, Michael G.

2012-01-01

Turbulent fluxes of heat and moisture across the atmosphere-ocean interface are fundamental components of the Earth's energy and water balance. Characterizing both the spatiotemporal variability and the fidelity of these exchanges of heat and moisture is critical to understanding the global water and energy cycle variations, quantifying atmosphere-ocean feedbacks, and improving model predictability. This study examines the veracity of the recently completed NASA Modern-Era Retrospective analysis for Research and Applications (MERRA) product with respect to its representation of the surface turbulent heat fluxes. A validation of MERRA turbulent heat fluxes and near-surface bulk variables at local, high-resolution space and time scales is achieved by making comparisons to a large suite of direct observations. Both in situ and satellite-observed gridded surface heat flux estimates are employed to investigate the spatial and temporal variability of the surface fluxes with respect to their annual mean climatologies, their seasonal covariability of near-surface bulk parameters, and their representation of extremes. The impact of data assimilation on the near-surface parameters is assessed through evaluation of incremental analysis update tendencies produced by the assimilation procedure. It is found that MERRA turbulent surface heat fluxes are relatively accurate for typical conditions but have systematically weak vertical gradients in moisture and temperature and have a weaker covariability between the near-surface gradients and wind speed than found in observations. This results in an underestimate of the surface latent and sensible heat fluxes over the western boundary current and storm track regions. The assimilation of observations mostly acts to bring MERRA closer to observational products by increasing moisture and temperature near the surface and decreasing the near-surface wind speeds. The major patterns of spatial and temporal variability of the turbulent heat fluxes produced by MERRA compare favorably to observationally based estimates. However, MERRA is distinct in terms of amplitude. These results suggest that MERRA is likely to be a valuable resource for a number of research applications though, as with all turbulent flux estimates, systematic issues should be taken into account

Characterization of Turbulent Latent and Sensible Heat Flux Exchange Between the Atmosphere and Ocean in MERRA

NASA Technical Reports Server (NTRS)

Roberts, J. Brent; Robertson, Franklin R.; Clayson, Carol Anne; Bosilovich, Michael G.

2012-01-01

Turbulent fluxes of heat and moisture across the atmosphere-ocean interface are fundamental components of the Earth s energy and water balance. Characterizing both the spatiotemporal variability and the fidelity of these exchanges of heat and moisture is critical to understanding the global water and energy cycle variations, quantifying atmosphere-ocean feedbacks, and improving model predictability. This study examines the veracity of the recently completed NASA Modern-Era Retrospective analysis for Research and Applications (MERRA) product with respect to its representation of the surface turbulent heat fluxes. A validation of MERRA turbulent heat fluxes and near-surface bulk variables at local, high-resolution space and time scales is achieved by making comparisons to a large suite of direct observations. Both in situ and satellite-observed gridded surface heat flux estimates are employed to investigate the spatial and temporal variability of the surface fluxes with respect to their annual mean climatologies, their seasonal covariability of near-surface bulk parameters, and their representation of extremes. The impact of data assimilation on the near-surface parameters is assessed through evaluation of incremental analysis update tendencies produced by the assimilation procedure. It is found that MERRA turbulent surface heat fluxes are relatively accurate for typical conditions but have systematically weak vertical gradients in moisture and temperature and have a weaker covariability between the near-surface gradients and wind speed than found in observations. This results in an underestimate of the surface latent and sensible heat fluxes over the western boundary current and storm track regions. The assimilation of observations mostly acts to bring MERRA closer to observational products by increasing moisture and temperature near the surface and decreasing the near-surface wind speeds. The major patterns of spatial and temporal variability of the turbulent heat fluxes produced by MERRA compare favorably to observationally based estimates. However, MERRA is distinct in terms of amplitude. These results suggest that MERRA is likely to be a valuable resource for a number of research applications though, as with all turbulent flux estimates, systematic issues should be taken into account.

Estimating Global Impervious Surface based on Social-economic Data and Satellite Observations

NASA Astrophysics Data System (ADS)

Zeng, Z.; Zhang, K.; Xue, X.; Hong, Y.

2016-12-01

Impervious surface areas around the globe are expanding and significantly altering the surface energy balance, hydrology cycle and ecosystem services. Many studies have underlined the importance of impervious surface, r from hydrological modeling to contaminant transport monitoring and urban development estimation. Therefore accurate estimation of the global impervious surface is important for both physical and social sciences. Given the limited coverage of high spatial resolution imagery and ground survey, using satellite remote sensing and geospatial data to estimate global impervious areas is a practical approach. Based on the previous work of area-weighted imperviousness for north branch of the Chicago River provided by HDR, this study developed a method to determine the percentage of impervious surface using latest global land cover categories from multi-source satellite observations, population density and gross domestic product (GDP) data. Percent impervious surface at 30-meter resolution were mapped. We found that 1.33% of the CONUS (105,814 km2) and 0.475% of the land surface (640,370km2) are impervious surfaces. To test the utility and practicality of the proposed method, National Land Cover Database (NLCD) 2011 percent developed imperviousness for the conterminous United States was used to evaluate our results. The average difference between the derived imperviousness from our method and the NLCD data across CONUS is 1.14%, while difference between our results and the NLCD data are within ±1% over 81.63% of the CONUS. The distribution of global impervious surface map indicates that impervious surfaces are primarily concentrated in China, India, Japan, USA and Europe where are highly populated and/or developed. This study proposes a straightforward way of mapping global imperviousness, which can provide useful information for hydrologic modeling and other applications.

Estimating Water and Heat Fluxes with a Four-dimensional Weak-constraint Variational Data Assimilation Approach

NASA Astrophysics Data System (ADS)

Bateni, S. M.; Xu, T.

2015-12-01

Accurate estimation of water and heat fluxes is required for irrigation scheduling, weather prediction, and water resources planning and management. A weak-constraint variational data assimilation (WC-VDA) scheme is developed to estimate water and heat fluxes by assimilating sequences of land surface temperature (LST) observations. The commonly used strong-constraint VDA systems adversely affect the accuracy of water and heat flux estimates as they assume the model is perfect. The WC-VDA approach accounts for structural and model errors and generates more accurate results via adding a model error term into the surface energy balance equation. The two key unknown parameters of the WC-VDA system (i.e., CHN, the bulk heat transfer coefficient and EF, evaporative fraction) and the model error term are optimized by minimizing the cost function. The WC-VDA model was tested at two sites with contrasting hydrological and vegetative conditions: the Daman site (a wet site located in an oasis area and covered by seeded corn) and the Huazhaizi site (a dry site located in a desert area and covered by sparse grass) in middle stream of Heihe river basin, northwest China. Compared to the strong-constraint VDA system, the WC-VDA method generates more accurate estimates of water and energy fluxes over the desert and oasis sites with dry and wet conditions.

Satellite Estimates of Surface Short-wave Fluxes: Issues of Implementation

NASA Technical Reports Server (NTRS)

Wang, H.; Pinker, Rachel; Minnis, Patrick

2006-01-01

Surface solar radiation reaching the Earth's surface is the primary forcing function of the land surface energy and water cycle. Therefore, there is a need for information on this parameter, preferably, at global scale. Satellite based estimates are now available at accuracies that meet the demands of many scientific objectives. Selection of an approach to estimate such fluxes requires consideration of trade-offs between the use of multi-spectral observations of cloud optical properties that are more difficult to implement at large scales, and methods that are simplified but easier to implement. In this study, an evaluation of such trade-offs will be performed. The University of Maryland Surface Radiation Model (UMD/SRB) has been used to reprocess five years of GOES-8 satellite observations over the United States to ensure updated calibration and improved cloud detection over snow. The UMD/SRB model was subsequently modified to allow input of information on aerosol and cloud optical depth with information from independent satellite sources. Specifically, the cloud properties from the Atmospheric Radiation Measurement (ARM) Satellite Data Analysis Program (Minnis et al., 1995) are used to drive the modified version of the model to estimate surface short-wave fluxes over the Southern Great Plain ARM sites for a twelve month period. The auxiliary data needed as model inputs such as aerosol optical depth, spectral surface albedo, water vapor and total column ozone amount were kept the same for both versions of the model. The estimated shortwave fluxes are evaluated against ground observations at the ARM Central Facility and four satellite ARM sites. During summer, the estimated fluxes based on cloud properties derived from the multi-spectral approach were in better agreement with ground measurements than those derived from the UMD/SRB model. However, in winter, the fluxes derived with the UMD/SRB model were in better agreement with ground observations than those estimated from cloud properties provided by the ARM Satellite Data Analysis Program. During the transition periods, the results were comparable.

Conformational Transitions and Convergence of Absolute Binding Free Energy Calculations

PubMed Central

Lapelosa, Mauro; Gallicchio, Emilio; Levy, Ronald M.

2011-01-01

The Binding Energy Distribution Analysis Method (BEDAM) is employed to compute the standard binding free energies of a series of ligands to a FK506 binding protein (FKBP12) with implicit solvation. Binding free energy estimates are in reasonably good agreement with experimental affinities. The conformations of the complexes identified by the simulations are in good agreement with crystallographic data, which was not used to restrain ligand orientations. The BEDAM method is based on λ -hopping Hamiltonian parallel Replica Exchange (HREM) molecular dynamics conformational sampling, the OPLS-AA/AGBNP2 effective potential, and multi-state free energy estimators (MBAR). Achieving converged and accurate results depends on all of these elements of the calculation. Convergence of the binding free energy is tied to the level of convergence of binding energy distributions at critical intermediate states where bound and unbound states are at equilibrium, and where the rate of binding/unbinding conformational transitions is maximal. This finding mirrors similar observations in the context of order/disorder transitions as for example in protein folding. Insights concerning the physical mechanism of ligand binding and unbinding are obtained. Convergence for the largest FK506 ligand is achieved only after imposing strict conformational restraints, which however require accurate prior structural knowledge of the structure of the complex. The analytical AGBNP2 model is found to underestimate the magnitude of the hydrophobic driving force towards binding in these systems characterized by loosely packed protein-ligand binding interfaces. Rescoring of the binding energies using a numerical surface area model corrects this deficiency. This study illustrates the complex interplay between energy models, exploration of conformational space, and free energy estimators needed to obtain robust estimates from binding free energy calculations. PMID:22368530

Tests of a robust eddy correlation system for sensible heat flux

NASA Astrophysics Data System (ADS)

Blanford, J. H.; Gay, L. W.

1992-03-01

Sensible heat flux estimates from a simple, one-propeller eddy correlation system (OPEC) were compared with those from a sonic anemometer eddy correlation system (SEC). In accordance with similarity theory, the performance of the OPEC system improved with increasing height of the sensor above the surface. Flux totals from the two systems at sites with adequate fetch were in excellent agreement after frequency response corrections were applied. The propeller system appears suitable for long periods of unattended measurement. The sensible heat flux measurements can be combined with net radiation and soil heat flux measurements to estimate latent heat as a residual in the surface energy balance.

Estimation of the sustainable geothermal potential of Vienna

NASA Astrophysics Data System (ADS)

Tissen, Carolin; Benz, Susanne A.; Keck, Christiane A.; Bayer, Peter; Blum, Philipp

2017-04-01

Regarding the limited availability of fossil fuels and the absolute necessity to reduce CO2 emissions in order to mitigate the worldwide climate change, renewable resources and new energy systems are required to provide sustainable energy for the future. Shallow geothermal energy holds a huge untapped potential especially for heating and hot water, which represent up to 50% of the global energy demand. Previous studies quantified the capacity of shallow geothermal energy for closed and open systems in cities such as Vienna, London (Westminster) and Ludwigsburg in Germany. In the present study, these approaches are combined and also include the anthropogenic heat input by the urban heat island (UHI) effect. The objective of the present study is therefore to estimate the sustainable geothermal potential of Vienna. Furthermore, the amount of energy demand for heating and hot water that can be supplied by open and closed geothermal systems will be determined. The UHI effect in Vienna is reflected in higher ground water temperatures within the city centre (14 ˚ C to 18 ˚ C) in comparison to lower ones in rural areas (10 ˚ C to 13 ˚ C). A preliminary estimation of the anthropogenic heat flow into the ground water caused by elevated basement temperatures and land surface temperatures is 3,5 × 108 kWh/a. This additional heat flow leads to a total geothermal potential which is 2.5 times larger than the estimated annual energy demand for heating and hot water in Vienna.

Combining remote sensing and water-balance evapotranspiration estimates for the conterminous United States

USGS Publications Warehouse

Reitz, Meredith; Senay, Gabriel; Sanford, Ward E.

2017-01-01

Evapotranspiration (ET) is a key component of the hydrologic cycle, accounting for ~70% of precipitation in the conterminous U.S. (CONUS), but it has been a challenge to predict accurately across different spatio-temporal scales. The increasing availability of remotely sensed data has led to significant advances in the frequency and spatial resolution of ET estimates, derived from energy balance principles with variables such as temperature used to estimate surface latent heat flux. Although remote sensing methods excel at depicting spatial and temporal variability, estimation of ET independently of other water budget components can lead to inconsistency with other budget terms. Methods that rely on ground-based data better constrain long-term ET, but are unable to provide the same temporal resolution. Here we combine long-term ET estimates from a water-balance approach with the SSEBop (operational Simplified Surface Energy Balance) remote sensing-based ET product for 2000–2015. We test the new combined method, the original SSEBop product, and another remote sensing ET product (MOD16) against monthly measurements from 119 flux towers. The new product showed advantages especially in non-irrigated areas where the new method showed a coefficient of determination R2 of 0.44, compared to 0.41 for SSEBop or 0.35 for MOD16. The resulting monthly data set will be a useful, unique contribution to ET estimation, due to its combination of remote sensing-based variability and ground-based long-term water balance constraints.

Estimation of spin contamination error in dissociative adsorption of Au2 onto MgO(0 0 1) surface: First application of approximate spin projection (AP) method to plane wave basis

NASA Astrophysics Data System (ADS)

Tada, Kohei; Koga, Hiroaki; Okumura, Mitsutaka; Tanaka, Shingo

2018-06-01

Spin contamination error in the total energy of the Au2/MgO system was estimated using the density functional theory/plane-wave scheme and approximate spin projection methods. This is the first investigation in which the errors in chemical phenomena on a periodic surface are estimated. The spin contamination error of the system was 0.06 eV. This value is smaller than that of the dissociation of Au2 in the gas phase (0.10 eV). This is because of the destabilization of the singlet spin state due to the weakening of the Au-Au interaction caused by the Au-MgO interaction.

Theoretical aspects of studies of high coverage oxidation of the Cu(100) surface using low energy positrons

NASA Astrophysics Data System (ADS)

Fazleev, N. G.; Maddox, W. B.; Reed, J. A.

2011-03-01

The study of adsorption of oxygen on transition metal surface is important for the understanding of oxidation, heterogeneous catalysis, and metal corrosion. The structures formed on transition metal surfaces vary from simple adlayers of chemisorbed oxygen to more complex structures which results from diffusion of oxygen into the sub-surface regions. In this work we present the results of an ab-initio investigation of positron surface and bulk states and annihilation probabilities of surface-trapped positrons with relevant core electrons at the Cu(100) missing row reconstructed surface under conditions of high oxygen coverage. Calculations are performed for various surface and subsurface oxygen coverages ranging from 0.50 to 1.50 monolayers. Calculations are also performed for the on-surface adsorption of oxygen on the unreconstructed Cu(001) surface for coverages up to one monolayer to use for comparison. Estimates of the positron binding energy, positron work function, and annihilation characteristics reveal their sensitivity to atomic structure of the topmost layers of the surface and charge transfer. Theoretical results are compared with experimental data obtained from studies of oxidation of the Cu(100) surface using positron annihilation induced Auger electron spectroscopy.

Estimation of bare soil evaporation using multifrequency airborne SAR

NASA Technical Reports Server (NTRS)

Soares, Joao V.; Shi, Jiancheng; Van Zyl, Jakob; Engman, E. T.

1992-01-01

It is shown that for homogeneous areas soil moisture can be derived from synthetic aperture radar (SAR) measurements, so that the use of microwave remote sensing can given realistic estimates of energy fluxes if coupled to a simple two-layer model repesenting the soil. The model simulates volumetric water content (Wg) using classical meterological data, provided that some of the soil thermal and hydraulic properties are known. Only four parameters are necessary: mean water content, thermal conductivity and diffusitivity, and soil resistance to evaporation. They may be derived if a minimal number of measured values of Wg and surface layer temperature (Tg) are available together with independent measurements of energy flux to compare with the estimated values. The estimated evaporation is shown to be realistic and in good agreement with drying stage theory in which the transfer of water in the soil is in vapor form.

The impact of solar radiation on the heating and cooling of buildings

NASA Astrophysics Data System (ADS)

Witmer, Lucas

This work focuses on the impact of solar energy on the heating and cooling of buildings. The sun can be the primary driver for building cooling loads as well as a significant source of heat in the winter. Methods are presented for the calculation of solar energy incident on tilted surfaces and the irradiance data source options. A key deficiency in current building energy modeling softwares is reviewed with a demonstration of the impact of calculating for shade on opaque surfaces. Several tools include methods for calculating shade incident on windows, while none do so automatically for opaque surfaces. The resulting calculations for fully irradiated wall surfaces underestimate building energy consumption in the winter and overestimate in the summer by significant margins. A method has been developed for processing and filtering solar irradiance data based on local shading. This method is used to compare situations where a model predictive control system can make poor decisions for building comfort control. An MPC system informed by poor quality solar data will negatively impact comfort in perimeter building zones during the cooling season. The direct component of irradiance is necessary for the calculation of irradiance on a tilted surface. Using graphical analysis and conditional probability distributions, this work demonstrates a proof of concept for estimating direct normal irradiance from a multi-pyranometer array by leveraging inter-surface relationships without directly inverting a sky model.

Soil-Water Balance (SWB) model estimates of soil-moisture variability and groundwater recharge in the South Platte watershed, Colorado

NASA Astrophysics Data System (ADS)

Anderson, A. M.; Walker, E. L.; Hogue, T. S.; Ruybal, C. J.

2015-12-01

Unconventional energy production in semi-arid regions places additional stress on already over-allocated water systems. Production of shale gas and oil resources in northern Colorado has rapidly increased since 2010, and is expected to continue growing due to advances in horizontal drilling and hydraulic fracturing. This unconventional energy production has implications for the availability of water in the South Platte watershed, where water demand for hydraulic fracturing of unconventional shale resources reached ~16,000 acre-feet in 2014. Groundwater resources are often exploited to meet water demands for unconventional energy production in regions like the South Platte basin, where surface water supply is limited and allocated across multiple uses. Since groundwater is often a supplement to surface water in times of drought and peak demand, variability in modeled recharge estimates can significantly impact projected availability. In the current work we used the Soil-Water Balance Model (SWB) to assess the variability in model estimates of actual evapotranspiration (ET) and soil-moisture conditions utilized to derive estimates of groundwater recharge. Using both point source and spatially distributed data, we compared modeled actual ET and soil-moisture derived from several potential ET methods, such as Thornthwaite-Mather, Jense-Haise, Turc, and Hargreaves-Samani, to historic soil moisture conditions obtained through sources including the Gravity Recovery and Climate Experiment (GRACE). In addition to a basin-scale analysis, we divided the South Platte watershed into sub-basins according to land cover to evaluate model capabilities of estimating soil-moisture parameters with variations in land cover and topography. Results ultimately allow improved prediction of groundwater recharge under future scenarios of climate and land cover change. This work also contributes to complementary subsurface groundwater modeling and decision support modeling in the South Platte.

Comparison of sea surface flux measured by instrumented aircraft and ship during SOFIA and SEMAPHORE experiments

NASA Astrophysics Data System (ADS)

Durand, Pierre; Dupuis, HéLèNe; Lambert, Dominique; BéNech, Bruno; Druilhet, Aimé; Katsaros, Kristina; Taylor, Peter K.; Weill, Alain

1998-10-01

Two major campaigns (Surface of the Oceans, Fluxes and Interactions with the Atmosphere (SOFIA) and Structure des Echanges Mer-Atmosphère, Propriétés des Hétérogénéités Océaniques: Recherche Expérimentale (SEMAPHORE)) devoted to the study of ocean-atmosphere interaction were conducted in 1992 and 1993, respectively, in the Azores region. Among the various platforms deployed, instrumented aircraft and ship allowed the measurement of the turbulent flux of sensible heat, latent heat, and momentum. From coordinated missions we can evaluate the sea surface fluxes from (1) bulk relations and mean measurements performed aboard the ship in the atmospheric surface layer and (2) turbulence measurements aboard aircraft, which allowed the flux profiles to be estimated through the whole atmospheric boundary layer and therefore to be extrapolated toward the sea surface level. Continuous ship fluxes were calculated with bulk coefficients deduced from inertial-dissipation measurements in the same experiments, whereas aircraft fluxes were calculated with eddy-correlation technique. We present a comparison between these two estimations. Although momentum flux agrees quite well, aircraft estimations of sensible and latent heat flux are lower than those of the ship. This result is surprising, since aircraft momentum flux estimates are often considered as much less accurate than scalar flux estimates. The various sources of errors on the aircraft and ship flux estimates are discussed. For sensible and latent heat flux, random errors on aircraft estimates, as well as variability of ship flux estimates, are lower than the discrepancy between the two platforms, whereas the momentum flux estimates cannot be considered as significantly different. Furthermore, the consequence of the high-pass filtering of the aircraft signals on the flux values is analyzed; it is weak at the lowest altitudes flown and cannot therefore explain the discrepancies between the two platforms but becomes considerable at upper levels in the boundary layer. From arguments linked to the imbalance of the surface energy budget, established during previous campaigns performed over land surfaces with aircraft, we conclude that aircraft heat fluxes are probably also underestimated over the sea.

Spectral and temperature-dependent infrared emissivity measurements of painted metals for improved temperature estimation during laser damage testing

NASA Astrophysics Data System (ADS)

Baumann, Sean M.; Keenan, Cameron; Marciniak, Michael A.; Perram, Glen P.

2014-10-01

A database of spectral and temperature-dependent emissivities was created for painted Al-alloy laser-damage-testing targets for the purpose of improving the uncertainty to which temperature on the front and back target surfaces may be estimated during laser-damage testing. Previous temperature estimates had been made by fitting an assumed gray-body radiance curve to the calibrated spectral radiance data collected from the back surface using a Telops Imaging Fourier Transform Spectrometer (IFTS). In this work, temperature-dependent spectral emissivity measurements of the samples were made from room temperature to 500 °C using a Surface Optics Corp. SOC-100 Hemispherical Directional Reflectometer (HDR) with Nicolet FTS. Of particular interest was a high-temperature matte-black enamel paint used to coat the rear surfaces of the Al-alloy samples. The paint had been assumed to have a spectrally flat and temperatureinvariant emissivity. However, the data collected using the HDR showed both spectral variation and temperature dependence. The uncertainty in back-surface temperature estimation during laser-damage testing made using the measured emissivities was improved from greater than +10 °C to less than +5 °C for IFTS pixels away from the laser burn-through hole, where temperatures never exceeded those used in the SOC-100 HDR measurements. At beam center, where temperatures exceeded those used in the SOC-100 HDR, uncertainty in temperature estimates grew beyond those made assuming gray-body emissivity. Accurate temperature estimations during laser-damage testing are useful in informing a predictive model for future high-energy-laser weapon applications.

Reaction of water with MgO(100) surfaces: Part III. X-ray standing wave studies

NASA Astrophysics Data System (ADS)

Liu, P.; Kendelewicz, T.; Nelson, E. J.; Brown, G. E.

1998-09-01

Clean MgO(100) surfaces cleaved in vacuum and exposed to water vapor or bulk water were studied using the X-ray standing wave (XSW) technique in back reflection mode and surface sensitive, element specific O KLL and Mg KLL Auger electron yield detection. The effects of surface charging were mitigated, but not entirely eliminated, by using a low-energy electron flood gun. Simulation of the XSW signal showed that the effect of surface charging on the XSW data could be minimized with careful experimental design. We demonstrate that the XSW method can be applied to studies of insulating surfaces, and our results for MgO(100) surfaces exposed to water vapor or bulk water indicate the following: (1) the vacuum-cleaved clean surface undergoes no surface reconstruction or significant relaxation perpendicular to the surface; (2) Mg-OH distances on surfaces exposed to water vapor or bulk water measured perpendicular to the (100) surface are the same as in bulk MgO; and (3) the z-position of the surface Mg atoms does not change within the estimated error [±2% of the (200) spacing] after the surface is fully hydroxylated. Our results for the clean, vacuum-cleaved surface disagree with results from impact collision ion-scattering spectroscopy and surface-extended electron-loss fine structure for MgO(100), which indicate 15 and 17% inward relaxation, respectively, and they support results from low-energy electron diffraction, reflection high-energy electron diffraction, and photoelectron diffraction that show little, if any, relaxation or rumpling of the surface.

Comparison of Surface Ground Temperature from Satellite Observations and the Off-Line Land Surface GEOS Assimilation System

NASA Technical Reports Server (NTRS)

Yang, R.; Houser, P.; Joiner, J.

1998-01-01

The surface ground temperature (Tg) is an important meteorological variable, because it represents an integrated thermal state of the land surface determined by a complex surface energy budget. Furthermore, Tg affects both the surface sensible and latent heat fluxes. Through these fluxes. the surface budget is coupled with the atmosphere above. Accurate Tg data are useful for estimating the surface radiation budget and fluxes, as well as soil moisture. Tg is not included in conventional synoptical weather station reports. Currently, satellites provide Tg estimates globally. It is necessary to carefully consider appropriate methods of using these satellite data in a data assimilation system. Recently, an Off-line Land surface GEOS Assimilation (OLGA) system was implemented at the Data Assimilation Office at NASA-GSFC. One of the goals of OLGA is to assimilate satellite-derived Tg data. Prior to the Tg assimilation, a thorough investigation of satellite- and model-derived Tg, including error estimates, is required. In this study we examine the Tg from the n Project (ISCCP DI) data and the OLGA simulations. The ISCCP data used here are 3-hourly DI data (2.5x2.5 degree resolution) for 1992 summer months (June, July, and August) and winter months (January and February). The model Tg for the same periods were generated by OLGA. The forcing data for this OLGA 1992 simulation were generated from the GEOS-1 Data Assimilation System (DAS) at Data Assimilation Office NASA-GSFC. We examine the discrepancies between ISCCP and OLGA Tg with a focus on its spatial and temporal characteristics, particularly on the diurnal cycle. The error statistics in both data sets, including bias, will be estimated. The impact of surface properties, including vegetation cover and type, topography, etc, on the discrepancies will be addressed.

Analysis of a resistance-energy balance method for estimating daily evaporation from wheat plots using one-time-of-day infrared temperature observations

NASA Technical Reports Server (NTRS)

Choudhury, B. J.; Idso, S. B.; Reginato, R. J.

1986-01-01

Accurate estimates of evaporation over field-scale or larger areas are needed in hydrologic studies, irrigation scheduling, and meteorology. Remotely sensed surface temperature might be used in a model to calculate evaporation. A resistance-energy balance model, which combines an energy balance equation, the Penman-Monteith (1981) evaporation equation, and van den Honert's (1948) equation for water extraction by plant roots, is analyzed for estimating daily evaporation from wheat using postnoon canopy temperature measurements. Additional data requirements are half-hourly averages of solar radiation, air and dew point temperatures, and wind speed, along with reasonable estimates of canopy emissivity, albedo, height, and leaf area index. Evaporation fluxes were measured in the field by precision weighing lysimeters for well-watered and water-stressed wheat. Errors in computed daily evaporation were generally less than 10 percent, while errors in cumulative evaporation for 10 clear sky days were less than 5 percent for both well-watered and water-stressed wheat. Some results from sensitivity analysis of the model are also given.

Distribution of free carriers near heavily-doped epitaxial surfaces of n-type Ge(100) upon HF and HCl treatments

DOE Office of Scientific and Technical Information (OSTI.GOV)

Park, S. J.; Bolotov, L.; Uchida, N.

2015-10-15

Carrier distributions near n-type epitaxially-grown Ge(100) surfaces with high impurity concentrations (1 × 10{sup 20} cm{sup −3}) were studied using high resolution electron energy loss spectroscopy (HREELS) upon surface treatments in aqueous solutions of HF and HCl. After surface treatments with HCl and HF, the molecular vibration modes distinctly showed either chloride or hydride terminations of Ge surfaces with negligible oxidation. The free-carrier concentration profile was inferred from the conduction band plasmon measurements as a function of the incident electron energies employing a dielectric theory simulation with a 4-layer structure and an effective electron mass of 0.02m{sub 0}. A carrier-freemore » layer of 40 and 24 Å were derived for HCl- and HF-treated Ge(100), respectively. The surface band bending was estimated to be 0.32 eV for HF-treated Ge. HCl-treated Ge surfaces showed a band bending of 0.91 eV attributed to the strong effect of the surface Cl-Ge dipole.« less

How Consistent are Recent Variations in the Tropical Energy and Water Cycle Resolved by Satellite Measurements?

NASA Technical Reports Server (NTRS)

Robertson, F. R.; Lu, H.-I.

2004-01-01

One notable aspect of Earth's climate is that although the planet appears to be very close to radiative balance at top-of-atmosphere (TOA), the atmosphere itself and underlying surface are not. Profound exchanges of energy between the atmosphere and oceans, land and cryosphere occur over a range of time scales. Recent evidence from broadband satellite measurements suggests that even these TOA fluxes contain some detectable variations. Our ability to measure and reconstruct radiative fluxes at the surface and at the top of atmosphere is improving rapidly. One question is 'How consistent, physically, are these diverse remotely-sensed data sets'? The answer is of crucial importance to understanding climate processes, improving physical models, and improving remote sensing algorithms. In this work we will evaluate two recently released estimates of radiative fluxes, focusing primarily on surface estimates. The International Satellite Cloud Climatology Project 'FD' radiative flux profiles are available from mid-1983 to near present and have been constructed by driving the radiative transfer physics from the Goddard Institute for Space Studies (GISS) global model with ISCCP clouds and TOVS (TIROS Operational Vertical Sounder)thermodynamic profiles. Full and clear sky SW and LW fluxes are produced. A similar product from the NASA/GEWEX Surface Radiation Budget Project using different radiative flux codes and thermodynamics from the NASA/Goddard Earth Observing System (GEOS-1) assimilation model makes a similar calculation of surface fluxes. However this data set currently extends only through 1995. We also employ precipitation measurements from the Global Precipitation Climatology Project (GPCP) and the Tropical Rainfall Measuring Mission (TRMM). Finally, ocean evaporation estimates from the Special Sensor Microwave Imager (SSM/I) are considered as well as derived evaporation from the NCAR/NCEP Reanalysis. Additional information is included in the original extended abstract.

A Three Component Model to Estimate Sensible Heat Flux Over Sparse Shrubs in Nevada

USGS Publications Warehouse

Chehbouni, A.; Nichols, W.D.; Njoku, E.G.; Qi, J.; Kerr, Y.H.; Cabot, F.

1997-01-01

It is now recognized that accurate partitioning of available energy into sensible and latent heat flux is crucial to understanding surface-atmosphere interactions. This issue is more complicated in arid and semi-arid regions where the relative contribution to surface fluxes from the soil and vegetation may vary significantly throughout the day and throughout the season. The objective of this paper is to present a three-component model to estimate sensible heat flux over heterogeneous surfaces. The surface was represented with two adjacent compartments. The first compartment is made up of two components, shrubs and shaded soil; the second compartment consists of bare, unshaded soil. Data collected at two different sites in Nevada during the summers of 1991 and 1992 were used to evaluate model performance. The results show that the present model is sufficiently general to yield satisfactory results for both sites.

Sea ice-atmosphere interaction. Application of multispectral satellite data in polar surface energy flux estimates

NASA Technical Reports Server (NTRS)

Steffen, Konrad; Key, Jeff; Maslanik, Jim; Haefliger, Marcel; Fowler, Chuck

1992-01-01

Satellite data for the estimation of radiative and turbulent heat fluxes is becoming an increasingly important tool in large-scale studies of climate. One parameter needed in the estimation of these fluxes is surface temperature. To our knowledge, little effort has been directed to the retrieval of the sea ice surface temperature (IST) in the Arctic, an area where the first effects of a changing climate are expected to be seen. The reason is not one of methodology, but rather our limited knowledge of atmospheric temperature, humidity, and aerosol profiles, the microphysical properties of polar clouds, and the spectral characteristics of the wide variety of surface types found there. We have developed a means to correct for the atmospheric attenuation of satellite-measured clear sky brightness temperatures used in the retrieval of ice surface temperature from the split-window thermal channels of the advanced very high resolution radiometer (AVHRR) sensors on-board three of the NOAA series satellites. These corrections are specified for three different 'seasons' and as a function of satellite viewing angle, and are expected to be applicable to the perennial ice pack in the central Arctic Basin.

Algorithm of regional surface evaporation using remote sensing: A case study of Haihe basin, China

NASA Astrophysics Data System (ADS)

Xiong, Jun; Wu, Bingfang; Yan, Nana; Hu, Minggang

2007-11-01

Evapotranspiration (ET, or latent heat flux) is the most essential and uncertain factor in water resource management. Remote sensing is a promising tool for estimation of spatial distribution of ET at regional scale with limited ground observations. We developed an algorithm for estimating regional evapotranspiration from MODIS 1b data and ancillary meteorological data. The algorithm is an integration of Penman-Monteith equation and SEBS (Surface Energy Balance System) model. The former is a combination of the energy balance theory and the mass transfer method to compute the evaporation from cropped surfaces from standard climatological records of sunshine, temperature, humidity and wind speed by introducing resistance factors, and the latter determines the spatio-temporal variability of regional evaporative condition. First, we characterized key land surface parameters on satellite over passing days, including fractional vegetation cover (fc), roughness height for momentum (z0m), net radiation (Rn) and soil heat flux (G0); Second, SEBS was applied to partition the sensible heat (H) from latent heat (LE) in combination with Planetary Boundary Layer (PBL) information from seven meteorological stations. A parameterization of surface roughness was applied at mountainous area considering topographic influence; third, we chose available surface resistance (RS) as the temporal-scaling factor. With bulk surface resistance is properly defined, P-M methods is valid for both soil and vegetation canopy. We validated ET from this algorithm with limited actual observations of ET including 2 eddy covariance system dataset and 1 lysimeter sites. Water balance equation is used as a trend-analysis tool to show the consistency between rainfall and ET on four drainage area. As a result, the prototype products showed different accuracy and applicability on different underlying and time scale, which demonstrates the potential of this approach for estimating ET from 1-km to regional spatial scale in North China Plain.

A simple hydrologically based model of land surface water and energy fluxes for general circulation models

NASA Technical Reports Server (NTRS)

Liang, XU; Lettenmaier, Dennis P.; Wood, Eric F.; Burges, Stephen J.

1994-01-01

A generalization of the single soil layer variable infiltration capacity (VIC) land surface hydrological model previously implemented in the Geophysical Fluid Dynamics Laboratory (GFDL) general circulation model (GCM) is described. The new model is comprised of a two-layer characterization of the soil column, and uses an aerodynamic representation of the latent and sensible heat fluxes at the land surface. The infiltration algorithm for the upper layer is essentially the same as for the single layer VIC model, while the lower layer drainage formulation is of the form previously implemented in the Max-Planck-Institut GCM. The model partitions the area of interest (e.g., grid cell) into multiple land surface cover types; for each land cover type the fraction of roots in the upper and lower zone is specified. Evapotranspiration consists of three components: canopy evaporation, evaporation from bare soils, and transpiration, which is represented using a canopy and architectural resistance formulation. Once the latent heat flux has been computed, the surface energy balance is iterated to solve for the land surface temperature at each time step. The model was tested using long-term hydrologic and climatological data for Kings Creek, Kansas to estimate and validate the hydrological parameters, and surface flux data from three First International Satellite Land Surface Climatology Project Field Experiment (FIFE) intensive field campaigns in the summer-fall of 1987 to validate the surface energy fluxes.

Evaluating the two-source energy balance model using local thermal and surface flux observations in a strongly advective irrigated agricultural area

NASA Astrophysics Data System (ADS)

Kustas, William P.; Alfieri, Joseph G.; Anderson, Martha C.; Colaizzi, Paul D.; Prueger, John H.; Evett, Steven R.; Neale, Christopher M. U.; French, Andrew N.; Hipps, Lawrence E.; Chávez, José L.; Copeland, Karen S.; Howell, Terry A.

2012-12-01

Application and validation of many thermal remote sensing-based energy balance models involve the use of local meteorological inputs of incoming solar radiation, wind speed and air temperature as well as accurate land surface temperature (LST), vegetation cover and surface flux measurements. For operational applications at large scales, such local information is not routinely available. In addition, the uncertainty in LST estimates can be several degrees due to sensor calibration issues, atmospheric effects and spatial variations in surface emissivity. Time differencing techniques using multi-temporal thermal remote sensing observations have been developed to reduce errors associated with deriving the surface-air temperature gradient, particularly in complex landscapes. The Dual-Temperature-Difference (DTD) method addresses these issues by utilizing the Two-Source Energy Balance (TSEB) model of Norman et al. (1995) [1], and is a relatively simple scheme requiring meteorological input from standard synoptic weather station networks or mesoscale modeling. A comparison of the TSEB and DTD schemes is performed using LST and flux observations from eddy covariance (EC) flux towers and large weighing lysimeters (LYs) in irrigated cotton fields collected during BEAREX08, a large-scale field experiment conducted in the semi-arid climate of the Texas High Plains as described by Evett et al. (2012) [2]. Model output of the energy fluxes (i.e., net radiation, soil heat flux, sensible and latent heat flux) generated with DTD and TSEB using local and remote meteorological observations are compared with EC and LY observations. The DTD method is found to be significantly more robust in flux estimation compared to the TSEB using the remote meteorological observations. However, discrepancies between model and measured fluxes are also found to be significantly affected by the local inputs of LST and vegetation cover and the representativeness of the remote sensing observations with the local flux measurement footprint.

Continental Heat Gain in the Global Climate System

NASA Astrophysics Data System (ADS)

Smerdon, J. E.; Beltrami, H.; Pollack, H. N.; Huang, S.

2001-12-01

Observed increases in 20th century surface-air temperatures are one consequence of a net energy flux into all major components of the Earth climate system including the atmosphere, ocean, cryosphere, and lithosphere. Levitus et al. [2001] have estimated the heat gained by the atmosphere, ocean and cryosphere as 18.2x1022 J, 6.6x1021 J, and 8.1x1021 J, respectively, over the past half-century. However the heat gain of the lithosphere via a heat flux across the solid surface of the continents (30% of the Earth's surface) was not addressed in the Levitus analysis. Here we calculate that final component of Earth's changing energy budget, using ground-surface temperature reconstructions for the continents [Huang et al., 2000]. These reconstructions have shown a warming of at least 0.5 K in the 20th century and were used to determine the flux estimates presented here. In the last half-century, the interval of time considered by Levitus et al., there was an average flux of 40 mW/m2 across the land surface into the subsurface, leading to 9.2x1021 J absorbed by the ground. This amount of heat is significantly less than the energy transferred into the oceans, but of the same magnitude as the energy absorbed by the atmosphere or cryosphere. The heat inputs into all the major components of the climate system - atmosphere, ocean, cryosphere, lithosphere - conservatively sum to more than 20x1022 J during the last half-century, and reinforce the conclusion that the warming in this interval has been truly global. Huang, S., Pollack, H.N., and Shen, P.-Y. 2000. Temperature trends over the past five centuries reconstructed from borehole temperatures. Nature. 403. 756-758 Levitus, S., Antonov, J., Wang, J., Delworth, T. L., Dixon, K. and Broccoli, A. 2001. Anthropogenic warming of the Earth's climate system. Science, 292, 267-270

Generating a global soil evaporation dataset using SMAP soil moisture data to estimate components of the surface water balance

NASA Astrophysics Data System (ADS)

Carbone, E.; Small, E. E.; Badger, A.; Livneh, B.

2016-12-01

Evapotranspiration (ET) is fundamental to the water, energy and carbon cycles. However, our ability to measure ET and partition the total flux into transpiration and evaporation from soil is limited. This project aims to generate a global, observationally-based soil evaporation dataset (E-SMAP): using SMAP surface soil moisture data in conjunction with models and auxiliary observations to observe or estimate each component of the surface water balance. E-SMAP will enable a better understanding of water balance processes and contribute to forecasts of water resource availability. Here we focus on the flux between the soil surface and root zone layers (qbot), which dictates the proportion of water that is available for soil evaporation. Any water that moves from the surface layer to the root zone contributes to transpiration or groundwater recharge. The magnitude and direction of qbot are driven by gravity and the gradient in matric potential. We use a highly discretized Richards Equation-type model (e.g. Hydrus 1D software) with meteorological forcing from the North American Land Data Assimilation System (NLDAS) to estimate qbot. We verify the simulations using SMAP L4 surface and root zone soil moisture data. These data are well suited for evaluating qbot because they represent the most advanced estimate of the surface to root zone soil moisture gradient at the global scale. Results are compared with similar calculations using NLDAS and in situ soil moisture data. Preliminary calculations show that the greatest amount of variability between qbot determined from NLDAS, in situ and SMAP occurs directly after precipitation events. At these times, uncertainties in qbot calculations significantly affect E-SMAP estimates.

How well can we measure the vertical wind speed? Implications for fluxes of energy and mass

Treesearch

John Kochendorfer; Tilden P. Meyers; John Frank; William J. Massman; Mark W. Heuer

2012-01-01

Sonic anemometers are capable of measuring the wind speed in all three dimensions at high frequencies (10­50 Hz), and are relied upon to estimate eddy-covariance-based fluxes of mass and energy over a wide variety of surfaces and ecosystems. In this study, wind-velocity measurement errors from a three-dimensional sonic anemometer with a nonorthogonal transducer...

Early Student Support for a Process Study of Oceanic Responses to Typhoons

DTIC Science & Technology

2015-06-21

responses to tropical cyclone forcing are surface waves, wind-driven currents, shear and turbulence, and inertial currents. Quantifying the effect ...Cd is estimated assuming a balance between the time rate change of the depth-integrated horizontal momentum, Coriolis force, and the wind stress. This...negligible pressure gradient effect . Most of the observed horizontal kinetic energy is within the upper 100 m. The available potential energy and

Urban Heat Islands

NASA Technical Reports Server (NTRS)

Luvall, Jeffrey C.; Quattrochi, Dale A.; Rickman, Doug L.; Estes, Maury G.

2011-01-01

It is estimated that by the year 2025, 80% of the world's population will live in cities. This conversion of the natural landscape vegetation into man-made urban structures such as roads and buildings drastically alter the regional surface energy budgets, hydrology, precipitation patterns, and meteorology. Research studies from many cities have documented these effects range from decreases in air quality, increased energy consumption and alteration of regional climate to direct effects on human health.

What is Required to Model the Global Ocean Circulation?

DTIC Science & Technology

2011-01-01

eddy kinetic energy (EKE) in the upper-ocean, encompassed by mesoscale eddies, meanders and rings of the boundary currents [ Stammer , 1997; Ferrari...Resolution studies [Bryan, et al., 2007 ; Smith, et al., 2000; Hogan and Hurlburt, 2000; Oschlies, 2002] show that increasing the horizontal resolution...energy estimates from surface drifter observations [Lumpkin and Pazos, 2007 ], satellite altimetry (150 m) [Ducet, et al., 2000], ARGO floats at 1,000

mBEEF-vdW: Robust fitting of error estimation density functionals

DOE Office of Scientific and Technical Information (OSTI.GOV)

Lundgaard, Keld T.; Wellendorff, Jess; Voss, Johannes

Here, we propose a general-purpose semilocal/nonlocal exchange-correlation functional approximation, named mBEEF-vdW. The exchange is a meta generalized gradient approximation, and the correlation is a semilocal and nonlocal mixture, with the Rutgers-Chalmers approximation for van der Waals (vdW) forces. The functional is fitted within the Bayesian error estimation functional (BEEF) framework. We improve the previously used fitting procedures by introducing a robust MM-estimator based loss function, reducing the sensitivity to outliers in the datasets. To more reliably determine the optimal model complexity, we furthermore introduce a generalization of the bootstrap 0.632 estimator with hierarchical bootstrap sampling and geometric mean estimator overmore » the training datasets. Using this estimator, we show that the robust loss function leads to a 10% improvement in the estimated prediction error over the previously used least-squares loss function. The mBEEF-vdW functional is benchmarked against popular density functional approximations over a wide range of datasets relevant for heterogeneous catalysis, including datasets that were not used for its training. Overall, we find that mBEEF-vdW has a higher general accuracy than competing popular functionals, and it is one of the best performing functionals on chemisorption systems, surface energies, lattice constants, and dispersion. We also show the potential-energy curve of graphene on the nickel(111) surface, where mBEEF-vdW matches the experimental binding length. mBEEF-vdW is currently available in gpaw and other density functional theory codes through Libxc, version 3.0.0.« less

mBEEF-vdW: Robust fitting of error estimation density functionals

DOE PAGES

Lundgaard, Keld T.; Wellendorff, Jess; Voss, Johannes; ...

2016-06-15

Here, we propose a general-purpose semilocal/nonlocal exchange-correlation functional approximation, named mBEEF-vdW. The exchange is a meta generalized gradient approximation, and the correlation is a semilocal and nonlocal mixture, with the Rutgers-Chalmers approximation for van der Waals (vdW) forces. The functional is fitted within the Bayesian error estimation functional (BEEF) framework. We improve the previously used fitting procedures by introducing a robust MM-estimator based loss function, reducing the sensitivity to outliers in the datasets. To more reliably determine the optimal model complexity, we furthermore introduce a generalization of the bootstrap 0.632 estimator with hierarchical bootstrap sampling and geometric mean estimator overmore » the training datasets. Using this estimator, we show that the robust loss function leads to a 10% improvement in the estimated prediction error over the previously used least-squares loss function. The mBEEF-vdW functional is benchmarked against popular density functional approximations over a wide range of datasets relevant for heterogeneous catalysis, including datasets that were not used for its training. Overall, we find that mBEEF-vdW has a higher general accuracy than competing popular functionals, and it is one of the best performing functionals on chemisorption systems, surface energies, lattice constants, and dispersion. We also show the potential-energy curve of graphene on the nickel(111) surface, where mBEEF-vdW matches the experimental binding length. mBEEF-vdW is currently available in gpaw and other density functional theory codes through Libxc, version 3.0.0.« less

Remotely-Sensed Regional-Scale Evapotranspiration of a Semi-Arid Great Basin Desert and its Relationship to Geomorphology, Soils, and Vegetation

NASA Technical Reports Server (NTRS)

Laymon, C.; Quattrochi, D.; Malek, E.; Hipps, L.; Boettinger, J.; McCurdy, G.

1998-01-01

Landsat thematic mapper data are used to estimate instantaneous regional-scale surface water and energy fluxes in a semi-arid Great Basin desert of the western United States. Results suggest that it is possible to scale from point measurements of environmental state variables to regional estimates of water and energy exchange. This research characterizes the unifying thread in the classical climate-topography-soil-vegetation relation -the surface water and energy balance-through maps of the partitioning of energy throughout the landscape. The study was conducted in Goshute Valley of northeastern Nevada, which is characteristic of most faulted graben valleys of the Basin and Range Province of the western United States. The valley comprises a central playa and lake plain bordered by alluvial fans emanating from the surrounding mountains. The distribution of evapotranspiration (ET) is lowest in the middle reaches of the fans where the water table is deep and plants are small, resulting in low evaporation and transpiration. Highest ET occurs in the center of the valley, particularly in the playa, where limited to no vegetation occurs, but evaporation is relatively high because of a shallow water table and silty clay soil capable of large capillary movement. Intermediate values of ET are associated with large shrubs and is dominated by transpiration.

Remotely-Sensed Regional-Scale Evapotranspiration of a Semi-Arid Great Basin Desert and its Relationship to Geomorphology, Soils, and Vegetation

NASA Technical Reports Server (NTRS)

Laymon, C.; Quattrochi, D.; Malek, E.; Hipps, L.; Boettinger, J.; McCurdy, G.

1997-01-01

Landsat Thematic Mapper data is used to estimate instantaneous regional-scale surface water and energy fluxes in a semi-arid Great Basin desert of the western United States. Results suggest that it is possible to scale from point measurements of environmental state variables to regional estimates of water and energy exchange. This research characterizes the unifying thread in the classical climate-topography-soil-vegetation relation-the surface water and energy balance-through maps of the partitioning of energy throughout the landscape. The study was conducted in Goshute Valley of northeastern Nevada, which is characteristic of most faulted graben valleys of the Basin and Range Province of the western United States. The valley comprises a central playa and lake plain bordered by alluvial fans emanating from the surrounding mountains. The distribution of evapotranspiration (ET) is lowest in the middle reaches of the fans where the water table is deep and plants are small, resulting in low evaporation and transpiration. Highest ET occurs in the center of the valley, particularly in the playa, where limited to no vegetation occurs, but evaporation is relatively high because of a shallow water table and silty clay soil capable of large capillary movement. Intermediate values of ET are associated with large shrubs and is dominated by transpiration.

Surveying implicit solvent models for estimating small molecule absolute hydration free energies

PubMed Central

Knight, Jennifer L.

2011-01-01

Implicit solvent models are powerful tools in accounting for the aqueous environment at a fraction of the computational expense of explicit solvent representations. Here, we compare the ability of common implicit solvent models (TC, OBC, OBC2, GBMV, GBMV2, GBSW, GBSW/MS, GBSW/MS2 and FACTS) to reproduce experimental absolute hydration free energies for a series of 499 small neutral molecules that are modeled using AMBER/GAFF parameters and AM1-BCC charges. Given optimized surface tension coefficients for scaling the surface area term in the nonpolar contribution, most implicit solvent models demonstrate reasonable agreement with extensive explicit solvent simulations (average difference 1.0-1.7 kcal/mol and R2=0.81-0.91) and with experimental hydration free energies (average unsigned errors=1.1-1.4 kcal/mol and R2=0.66-0.81). Chemical classes of compounds are identified that need further optimization of their ligand force field parameters and others that require improvement in the physical parameters of the implicit solvent models themselves. More sophisticated nonpolar models are also likely necessary to more effectively represent the underlying physics of solvation and take the quality of hydration free energies estimated from implicit solvent models to the next level. PMID:21735452

Energy-saving approaches to solid state street lighting

NASA Astrophysics Data System (ADS)

Vitta, Pranciškus; Stanikūnas, Rytis; Tuzikas, Arūnas; Reklaitis, Ignas; Stonkus, Andrius; Petrulis, Andrius; Vaitkevičius, Henrikas; Žukauskas, Artūras

2011-10-01

We consider the energy-saving potential of solid-state street lighting due to improved visual performance, weather sensitive luminance control and tracking of pedestrians and vehicles. A psychophysical experiment on the measurement of reaction time with a decision making task was performed under mesopic levels of illumination provided by a highpressure sodium (HPS) lamp and different solid-state light sources, such as daylight and warm-white phosphor converted light-emitting diodes (LEDs) and red-green-blue LED clusters. The results of the experiment imply that photopic luminances of road surface provided by solid-state light sources with an optimized spectral power distribution might be up to twice as low as those provided by the HPS lamp. Dynamical correction of road luminance against road surface conditions typical of Lithuanian climate was estimated to save about 20% of energy in comparison with constant-level illumination. The estimated energy savings due to the tracking of pedestrians and vehicles amount at least 25% with the cumulative effect of intelligent control of at least 40%. A solid-state street lighting system with intelligent control was demonstrated using a 300 m long test ground consisting of 10 solid-state street luminaires, a meteorological station and microwave motion sensor network operated via power line communication.

Analysis of Stationary, Photovoltaic-based Surface Power System Designs at the Lunar South Pole

NASA Technical Reports Server (NTRS)

Freeh, Joshua E.

2009-01-01

Combinations of solar arrays and either batteries or regenerative fuel cells are analyzed for a surface power system module at the lunar south pole. The systems are required to produce 5 kW of net electrical power in sunlight and 2 kW of net electrical power during lunar night periods for a 10-year period between 2020 and 2030. Systems-level models for energy conservation, performance, degradation, and mass are used to compare to various systems. The sensitivities of important and/or uncertain variables including battery specific energy, fuel cell operating voltage, and DC-DC converter efficiency are compared to better understand the system. Switching unit efficiency, battery specific energy, and fuel cell operating voltage appear to be important system-level variables for this system. With reasonably sized solar arrays, the regenerative fuel cell system has significantly lower mass than the battery system based on the requirements and assumptions made herein. The total operational time is estimated at about 10,000 hours in battery discharge/fuel cell mode and about 4,000 and 8,000 hours for the battery charge and electrolyzer modes, respectively. The estimated number of significant depth-of-discharge cycles for either energy storage system is less than 100 for the 10-year period.

Supporting Energy-Related Societal Applications Using NASA's Satellite and Modeling Data

NASA Technical Reports Server (NTRS)

Stackhouse, Paul W., Jr.; Whitlock, C. H.; Chandler, W. S.; Hoell, J. M.; Zhang, T.; Mikovitz, J. C.; Leng, G. S.; Lilienthal, P.

2006-01-01

Improvements to NASA Surface Meteorology and Solar Energy (SSE) web site are now being made through the Prediction of Worldwide Energy Resource (POWER) project under NASA Science Mission Directorate Applied Science Energy Management Program. The purpose of this project is to tailor NASA Science Mission results for energy sector applications and decision support systems. The current status of SSE and research towards upgrading estimates of total, direct and diffuse solar irradiance from NASA satellite measurements and analysis are discussed. Part of this work involves collaborating with partners such as the National Renewable Energy Laboratory (NREL) and the Natural Resources Canada (NRCan). Energy Management and POWER plans including historic, near-term and forecast datasets are also overviewed.

Optimization of Modeled Land-Atmosphere Exchanges of Water and Energy in an Isotopically-Enabled Land Surface Model by Bayesian Parameter Calibration

NASA Astrophysics Data System (ADS)

Wong, T. E.; Noone, D. C.; Kleiber, W.

2014-12-01

The single largest uncertainty in climate model energy balance is the surface latent heating over tropical land. Furthermore, the partitioning of the total latent heat flux into contributions from surface evaporation and plant transpiration is of great importance, but notoriously poorly constrained. Resolving these issues will require better exploiting information which lies at the interface between observations and advanced modeling tools, both of which are imperfect. There are remarkably few observations which can constrain these fluxes, placing strict requirements on developing statistical methods to maximize the use of limited information to best improve models. Previous work has demonstrated the power of incorporating stable water isotopes into land surface models for further constraining ecosystem processes. We present results from a stable water isotopically-enabled land surface model (iCLM4), including model experiments partitioning the latent heat flux into contributions from plant transpiration and surface evaporation. It is shown that the partitioning results are sensitive to the parameterization of kinetic fractionation used. We discuss and demonstrate an approach to calibrating select model parameters to observational data in a Bayesian estimation framework, requiring Markov Chain Monte Carlo sampling of the posterior distribution, which is shown to constrain uncertain parameters as well as inform relevant values for operational use. Finally, we discuss the application of the estimation scheme to iCLM4, including entropy as a measure of information content and specific challenges which arise in calibration models with a large number of parameters.

Analysis of group-velocity dispersion of high-frequency Rayleigh waves for near-surface applications

USGS Publications Warehouse

Luo, Y.; Xia, J.; Xu, Y.; Zeng, C.

2011-01-01

The Multichannel Analysis of Surface Waves (MASW) method is an efficient tool to obtain the vertical shear (S)-wave velocity profile using the dispersive characteristic of Rayleigh waves. Most MASW researchers mainly apply Rayleigh-wave phase-velocity dispersion for S-wave velocity estimation with a few exceptions applying Rayleigh-wave group-velocity dispersion. Herein, we first compare sensitivities of fundamental surface-wave phase velocities with group velocities with three four-layer models including a low-velocity layer or a high-velocity layer. Then synthetic data are simulated by a finite difference method. Images of group-velocity dispersive energy of the synthetic data are generated using the Multiple Filter Analysis (MFA) method. Finally we invert a high-frequency surface-wave group-velocity dispersion curve of a real-world example. Results demonstrate that (1) the sensitivities of group velocities are higher than those of phase velocities and usable frequency ranges are wider than that of phase velocities, which is very helpful in improving inversion stability because for a stable inversion system, small changes in phase velocities do not result in a large fluctuation in inverted S-wave velocities; (2) group-velocity dispersive energy can be measured using single-trace data if Rayleigh-wave fundamental-mode energy is dominant, which suggests that the number of shots required in data acquisition can be dramatically reduced and the horizontal resolution can be greatly improved using analysis of group-velocity dispersion; and (3) the suspension logging results of the real-world example demonstrate that inversion of group velocities generated by the MFA method can successfully estimate near-surface S-wave velocities. ?? 2011 Elsevier B.V.

Spatiotemporal motion boundary detection and motion boundary velocity estimation for tracking moving objects with a moving camera: a level sets PDEs approach with concurrent camera motion compensation.

PubMed

Feghali, Rosario; Mitiche, Amar

2004-11-01

The purpose of this study is to investigate a method of tracking moving objects with a moving camera. This method estimates simultaneously the motion induced by camera movement. The problem is formulated as a Bayesian motion-based partitioning problem in the spatiotemporal domain of the image quence. An energy functional is derived from the Bayesian formulation. The Euler-Lagrange descent equations determine imultaneously an estimate of the image motion field induced by camera motion and an estimate of the spatiotemporal motion undary surface. The Euler-Lagrange equation corresponding to the surface is expressed as a level-set partial differential equation for topology independence and numerically stable implementation. The method can be initialized simply and can track multiple objects with nonsimultaneous motions. Velocities on motion boundaries can be estimated from geometrical properties of the motion boundary. Several examples of experimental verification are given using synthetic and real-image sequences.

Molecular system identification for enzyme directed evolution and design

NASA Astrophysics Data System (ADS)

Guan, Xiangying; Chakrabarti, Raj

2017-09-01

The rational design of chemical catalysts requires methods for the measurement of free energy differences in the catalytic mechanism for any given catalyst Hamiltonian. The scope of experimental learning algorithms that can be applied to catalyst design would also be expanded by the availability of such methods. Methods for catalyst characterization typically either estimate apparent kinetic parameters that do not necessarily correspond to free energy differences in the catalytic mechanism or measure individual free energy differences that are not sufficient for establishing the relationship between the potential energy surface and catalytic activity. Moreover, in order to enhance the duty cycle of catalyst design, statistically efficient methods for the estimation of the complete set of free energy differences relevant to the catalytic activity based on high-throughput measurements are preferred. In this paper, we present a theoretical and algorithmic system identification framework for the optimal estimation of free energy differences in solution phase catalysts, with a focus on one- and two-substrate enzymes. This framework, which can be automated using programmable logic, prescribes a choice of feasible experimental measurements and manipulated input variables that identify the complete set of free energy differences relevant to the catalytic activity and minimize the uncertainty in these free energy estimates for each successive Hamiltonian design. The framework also employs decision-theoretic logic to determine when model reduction can be applied to improve the duty cycle of high-throughput catalyst design. Automation of the algorithm using fluidic control systems is proposed, and applications of the framework to the problem of enzyme design are discussed.

Skin Temperature Analysis and Bias Correction in a Coupled Land-Atmosphere Data Assimilation System

NASA Technical Reports Server (NTRS)

Bosilovich, Michael G.; Radakovich, Jon D.; daSilva, Arlindo; Todling, Ricardo; Verter, Frances

2006-01-01

In an initial investigation, remotely sensed surface temperature is assimilated into a coupled atmosphere/land global data assimilation system, with explicit accounting for biases in the model state. In this scheme, an incremental bias correction term is introduced in the model's surface energy budget. In its simplest form, the algorithm estimates and corrects a constant time mean bias for each gridpoint; additional benefits are attained with a refined version of the algorithm which allows for a correction of the mean diurnal cycle. The method is validated against the assimilated observations, as well as independent near-surface air temperature observations. In many regions, not accounting for the diurnal cycle of bias caused degradation of the diurnal amplitude of background model air temperature. Energy fluxes collected through the Coordinated Enhanced Observing Period (CEOP) are used to more closely inspect the surface energy budget. In general, sensible heat flux is improved with the surface temperature assimilation, and two stations show a reduction of bias by as much as 30 Wm(sup -2) Rondonia station in Amazonia, the Bowen ratio changes direction in an improvement related to the temperature assimilation. However, at many stations the monthly latent heat flux bias is slightly increased. These results show the impact of univariate assimilation of surface temperature observations on the surface energy budget, and suggest the need for multivariate land data assimilation. The results also show the need for independent validation data, especially flux stations in varied climate regimes.

Using microkinetic analysis to search for novel anhydrous formaldehyde production catalysts

NASA Astrophysics Data System (ADS)

Li, Han-Jung; Lausche, Adam C.; Peterson, Andrew A.; Hansen, Heine A.; Studt, Felix; Bligaard, Thomas

2015-11-01

Direct dehydrogenation of methanol to produce anhydrous formaldehyde is investigated using periodic density functional theory (DFT) and combining the microkinetic model to estimate rates and selectivities on stepped (211) surfaces under a desired reaction condition. Binding energies of reaction intermediates and transition state energies for each elementary reaction can be accurately scaled with CHO and OH binding energies as the only descriptors. Based on these two descriptors, a steady-state microkinetic model is constructed with a piecewise adsorbate-adsorbate interaction model that explicitly includes the effects of adsorbate coverage on the rates and selectivities as well as the volcano plots are obtained. Our results show that most of the stepped (211) pure-metallic surfaces such as Au, Pt, Pd, Rh, Ru, Ni, Fe, and Co are located in a region of low activity and selectivity toward CH2O production due to higher rate for CH2O dehydrogenation than CH2O desorption. The selectivities toward CH2O production on Zn, Cu, and Ag surfaces are located on the boundary between the high and low selectivity regions. To find suitable catalysts for anhydrous CH2O production, a large number of A3B-type transition metal alloys are screened based on their predicted rates and selectivities, as well as their estimated stabilities and prices. We finally propose several promising candidates for the dehydrogenation of CH3OH.

Assessing actual evapotranspiration via surface energy balance aiming to optimize water and energy consumption in large scale pressurized irrigation systems

NASA Astrophysics Data System (ADS)

Awada, H.; Ciraolo, G.; Maltese, A.; Moreno Hidalgo, M. A.; Provenzano, G.; Còrcoles, J. I.

2017-10-01

Satellite imagery provides a dependable basis for computational models that aimed to determine actual evapotranspiration (ET) by surface energy balance. Satellite-based models enables quantifying ET over large areas for a wide range of applications, such as monitoring water distribution, managing irrigation and assessing irrigation systems' performance. With the aim to evaluate the energy and water consumption of a large scale on-turn pressurized irrigation system in the district of Aguas Nuevas, Albacete, Spain, the satellite-based image-processing model SEBAL was used for calculating actual ET. The model has been applied to quantify instantaneous, daily, and seasonal actual ET over high- resolution Landsat images for the peak water demand season (May to September) and for the years 2006 - 2008. The model provided a direct estimation of the distribution of main energy fluxes, at the instant when the satellite overpassed over each field of the district. The image acquisition day Evapotranspiration (ET24) was obtained from instantaneous values by assuming a constant evaporative fraction (Λ) for the entire day of acquisition; then, monthly and seasonal ET were estimated from the daily evapotranspiration (ETdaily) assuming that ET24 varies in proportion to reference ET (ETr) at the meteorological station, thus accounting for day to day variation in meteorological forcing. The comparison between the hydrants water consumption and the actual evapotranspiration, considering an irrigation efficiency of 85%, showed that a considerable amount of water and energy can be saved at district level.

Quantifying How Observations Inform a Numerical Reanalysis of Hawaii

NASA Astrophysics Data System (ADS)

Powell, B. S.

2017-11-01

When assimilating observations into a model via state-estimation, it is possible to quantify how each observation changes the modeled estimate of a chosen oceanic metric. Using an existing 2 year reanalysis of Hawaii that includes more than 31 million observations from satellites, ships, SeaGliders, and autonomous floats, I assess which observations most improve the estimates of the transport and eddy kinetic energy. When the SeaGliders were in the water, they comprised less than 2.5% of the data, but accounted for 23% of the transport adjustment. Because the model physics constrains advanced state-estimation, the prescribed covariances are propagated in time to identify observation-model covariance. I find that observations that constrain the isopycnal tilt across the transport section provide the greatest impact in the analysis. In the case of eddy kinetic energy, observations that constrain the surface-driven upper ocean have more impact. This information can help to identify optimal sampling strategies to improve both state-estimates and forecasts.

Global Validation of MODIS Atmospheric Profile-Derived Near-Surface Air Temperature and Dew Point Estimates

NASA Astrophysics Data System (ADS)

Famiglietti, C.; Fisher, J.; Halverson, G. H.

2017-12-01

This study validates a method of remote sensing near-surface meteorology that vertically interpolates MODIS atmospheric profiles to surface pressure level. The extraction of air temperature and dew point observations at a two-meter reference height from 2001 to 2014 yields global moderate- to fine-resolution near-surface temperature distributions that are compared to geographically and temporally corresponding measurements from 114 ground meteorological stations distributed worldwide. This analysis is the first robust, large-scale validation of the MODIS-derived near-surface air temperature and dew point estimates, both of which serve as key inputs in models of energy, water, and carbon exchange between the land surface and the atmosphere. Results show strong linear correlations between remotely sensed and in-situ near-surface air temperature measurements (R2 = 0.89), as well as between dew point observations (R2 = 0.77). Performance is relatively uniform across climate zones. The extension of mean climate-wise percent errors to the entire remote sensing dataset allows for the determination of MODIS air temperature and dew point uncertainties on a global scale.

Estimation of Soil Moisture from Optical and Thermal Remote Sensing: A Review

PubMed Central

Zhang, Dianjun; Zhou, Guoqing

2016-01-01

As an important parameter in recent and numerous environmental studies, soil moisture (SM) influences the exchange of water and energy at the interface between the land surface and atmosphere. Accurate estimate of the spatio-temporal variations of SM is critical for numerous large-scale terrestrial studies. Although microwave remote sensing provides many algorithms to obtain SM at large scale, such as SMOS and SMAP etc., resulting in many data products, they are almost low resolution and not applicable in small catchment or field scale. Estimations of SM from optical and thermal remote sensing have been studied for many years and significant progress has been made. In contrast to previous reviews, this paper presents a new, comprehensive and systematic review of using optical and thermal remote sensing for estimating SM. The physical basis and status of the estimation methods are analyzed and summarized in detail. The most important and latest advances in soil moisture estimation using temporal information have been shown in this paper. SM estimation from optical and thermal remote sensing mainly depends on the relationship between SM and the surface reflectance or vegetation index. The thermal infrared remote sensing methods uses the relationship between SM and the surface temperature or variations of surface temperature/vegetation index. These approaches often have complex derivation processes and many approximations. Therefore, combinations of optical and thermal infrared remotely sensed data can provide more valuable information for SM estimation. Moreover, the advantages and weaknesses of different approaches are compared and applicable conditions as well as key issues in current soil moisture estimation algorithms are discussed. Finally, key problems and suggested solutions are proposed for future research. PMID:27548168

Estimation of Soil Moisture from Optical and Thermal Remote Sensing: A Review.

PubMed

Zhang, Dianjun; Zhou, Guoqing

2016-08-17

As an important parameter in recent and numerous environmental studies, soil moisture (SM) influences the exchange of water and energy at the interface between the land surface and atmosphere. Accurate estimate of the spatio-temporal variations of SM is critical for numerous large-scale terrestrial studies. Although microwave remote sensing provides many algorithms to obtain SM at large scale, such as SMOS and SMAP etc., resulting in many data products, they are almost low resolution and not applicable in small catchment or field scale. Estimations of SM from optical and thermal remote sensing have been studied for many years and significant progress has been made. In contrast to previous reviews, this paper presents a new, comprehensive and systematic review of using optical and thermal remote sensing for estimating SM. The physical basis and status of the estimation methods are analyzed and summarized in detail. The most important and latest advances in soil moisture estimation using temporal information have been shown in this paper. SM estimation from optical and thermal remote sensing mainly depends on the relationship between SM and the surface reflectance or vegetation index. The thermal infrared remote sensing methods uses the relationship between SM and the surface temperature or variations of surface temperature/vegetation index. These approaches often have complex derivation processes and many approximations. Therefore, combinations of optical and thermal infrared remotely sensed data can provide more valuable information for SM estimation. Moreover, the advantages and weaknesses of different approaches are compared and applicable conditions as well as key issues in current soil moisture estimation algorithms are discussed. Finally, key problems and suggested solutions are proposed for future research.

Signal Attenuation Curve for Different Surface Detector Arrays

NASA Astrophysics Data System (ADS)

Vicha, J.; Travnicek, P.; Nosek, D.; Ebr, J.

2014-06-01

Modern cosmic ray experiments consisting of large array of particle detectors measure the signals of electromagnetic or muon components or their combination. The correction for an amount of atmosphere passed is applied to the surface detector signal before its conversion to the shower energy. Either Monte Carlo based approach assuming certain composition of primaries or indirect estimation using real data and assuming isotropy of arrival directions can be used. Toy surface arrays of different sensitivities to electromagnetic and muon components are assumed in MC simulations to study effects imposed on attenuation curves for varying composition or possible high energy anisotropy. The possible sensitivity of the attenuation curve to the mass composition is also tested for different array types focusing on a future apparatus that can separate muon and electromagnetic component signals.

Desorption induced by electronic transitions of Na from SiO2: relevance to tenuous planetary atmospheres.

NASA Astrophysics Data System (ADS)

Yakshinskiy, B. V.; Madey, T. E.

2000-04-01

The authors have studied the desorption induced by electronic transitions (DIET) of Na adsorbed on model mineral surfaces, i.e. amorphous, stoichiometric SiO2 films. They find that electron stimulated desorption (ESD) of atomic Na occurs for electron energy thresholds as low as ≡4 eV, that desorption cross-sections are high (≡1×10-19cm2 at 11 eV), and that desorbing atoms are 'hot', with suprathermal velocities. The estimated Na desorption rate from the lunar surface via ESD by solar wind electrons is a small fraction of the rate needed to sustain the Na atmosphere. However, the solar photon flux at energies ≥5 eV exceeds the solar wind electron flux by orders of magnitude; there are sufficient ultraviolet photons incident on the lunar surface to contribute substantially to the lunar Na atmosphere via PSD of Na from the surface.

Influence of sub-surface damage evolution on low-energy-plasma-driven deuterium permeation through tungsten

NASA Astrophysics Data System (ADS)

Kapser, Stefan; Balden, Martin; Fiorini da Silva, Tiago; Elgeti, Stefan; Manhard, Armin; Schmid, Klaus; Schwarz-Selinger, Thomas; von Toussaint, Udo

2018-05-01

Low-energy-plasma-driven deuterium permeation through tungsten at 300 K and 450 K has been investigated. Microstructural analysis by scanning electron microscopy, assisted by focused ion beam, revealed sub-surface damage evolution only at 300 K. This damage evolution was correlated with a significant evolution of the deuterium amount retained below the plasma-exposed surface. Although both of these phenomena were observed for 300 K exposure temperature only, the deuterium permeation flux at both exposure temperatures was indistinguishable within the experimental uncertainty. The permeation flux was used to estimate the maximum ratio of solute-deuterium to tungsten atoms during deuterium-plasma exposure at both temperatures and thus in the presence and absence of damage evolution. Diffusion-trapping simulations revealed the proximity of damage evolution to the implantation surface as the reason for an only insignificant decrease of the permeation flux.

EFFECTS OF LASER RADIATION ON MATTER: Growth of periodic structures on the surface of germanium subjected to pulsed laser radiation

NASA Astrophysics Data System (ADS)

Barsukov, D. O.; Gusakov, G. M.; Frolov, A. I.

1991-12-01

An experimental investigation was made of the dynamics of growth of periodic surface structures due to the interaction with pulsed laser radiation. Samples of Ge were subjected to laser pulses (λ = 1.06 μm, τ = 70 ns) with energy densities in the range 0.5-5.5 J/cm2. An investigation was made of the dynamics of the first-order diffraction of probe (λ = 0.53 μm) laser pulses with a time resolution 4 ns when p- and s-polarized laser radiation was incident at angles close to normal. A strong nonlinearity of the growth of such periodic surface structures was observed. The energy density from which such growth began depended on the quality of the polished Ge surface. The parameters of the dynamics of the growth of these structures were estimated.

Impact of atmospheric effects on the energy reconstruction of air showers observed by the surface detectors of the Pierre Auger Observatory

NASA Astrophysics Data System (ADS)

Aab, A.; Abreu, P.; Aglietta, M.; Samarai, I. Al; Albuquerque, I. F. M.; Allekotte, I.; Almela, A.; Alvarez Castillo, J.; Alvarez-Muñiz, J.; Anastasi, G. A.; Anchordoqui, L.; Andrada, B.; Andringa, S.; Aramo, C.; Arqueros, F.; Arsene, N.; Asorey, H.; Assis, P.; Aublin, J.; Avila, G.; Badescu, A. M.; Balaceanu, A.; Barreira Luz, R. J.; Baus, C.; Beatty, J. J.; Becker, K. H.; Bellido, J. A.; Berat, C.; Bertaina, M. E.; Bertou, X.; Biermann, P. L.; Billoir, P.; Biteau, J.; Blaess, S. G.; Blanco, A.; Blazek, J.; Bleve, C.; Boháčová, M.; Boncioli, D.; Bonifazi, C.; Borodai, N.; Botti, A. M.; Brack, J.; Brancus, I.; Bretz, T.; Bridgeman, A.; Briechle, F. L.; Buchholz, P.; Bueno, A.; Buitink, S.; Buscemi, M.; Caballero-Mora, K. S.; Caccianiga, L.; Cancio, A.; Canfora, F.; Caramete, L.; Caruso, R.; Castellina, A.; Cataldi, G.; Cazon, L.; Chavez, A. G.; Chinellato, J. A.; Chudoba, J.; Clay, R. W.; Colalillo, R.; Coleman, A.; Collica, L.; Coluccia, M. R.; Conceição, R.; Contreras, F.; Cooper, M. J.; Coutu, S.; Covault, C. E.; Criss, A.; Cronin, J.; D'Amico, S.; Daniel, B.; Dasso, S.; Daumiller, K.; Dawson, B. R.; de Almeida, R. M.; de Jong, S. J.; De Mauro, G.; de Mello Neto, J. R. T.; De Mitri, I.; de Oliveira, J.; de Souza, V.; Debatin, J.; Deligny, O.; Di Giulio, C.; Di Matteo, A.; Díaz Castro, M. L.; Diogo, F.; Dobrigkeit, C.; D'Olivo, J. C.; dos Anjos, R. C.; Dova, M. T.; Dundovic, A.; Ebr, J.; Engel, R.; Erdmann, M.; Erfani, M.; Escobar, C. O.; Espadanal, J.; Etchegoyen, A.; Falcke, H.; Farrar, G.; Fauth, A. C.; Fazzini, N.; Fick, B.; Figueira, J. M.; Filipčič, A.; Fratu, O.; Freire, M. M.; Fujii, T.; Fuster, A.; Gaior, R.; García, B.; Garcia-Pinto, D.; Gaté, F.; Gemmeke, H.; Gherghel-Lascu, A.; Ghia, P. L.; Giaccari, U.; Giammarchi, M.; Giller, M.; Głas, D.; Glaser, C.; Glass, H.; Golup, G.; Gómez Berisso, M.; Gómez Vitale, P. F.; González, N.; Gorgi, A.; Gorham, P.; Gouffon, P.; Grillo, A. F.; Grubb, T. D.; Guarino, F.; Guedes, G. P.; Hampel, M. R.; Hansen, P.; Harari, D.; Harrison, T. A.; Harton, J. L.; Hasankiadeh, Q.; Haungs, A.; Hebbeker, T.; Heck, D.; Heimann, P.; Herve, A. E.; Hill, G. C.; Hojvat, C.; Holt, E.; Homola, P.; Hörandel, J. R.; Horvath, P.; Hrabovský, M.; Huege, T.; Hulsman, J.; Insolia, A.; Isar, P. G.; Jandt, I.; Jansen, S.; Johnsen, J. A.; Josebachuili, M.; Kääpä, A.; Kambeitz, O.; Kampert, K. H.; Kasper, P.; Katkov, I.; Keilhauer, B.; Kemp, E.; Kemp, J.; Kieckhafer, R. M.; Klages, H. O.; Kleifges, M.; Kleinfeller, J.; Krause, R.; Krohm, N.; Kuempel, D.; Kukec Mezek, G.; Kunka, N.; Kuotb Awad, A.; LaHurd, D.; Lauscher, M.; Lebrun, P.; Legumina, R.; Leigui de Oliveira, M. A.; Letessier-Selvon, A.; Lhenry-Yvon, I.; Link, K.; Lopes, L.; López, R.; López Casado, A.; Luce, Q.; Lucero, A.; Malacari, M.; Mallamaci, M.; Mandat, D.; Mantsch, P.; Mariazzi, A. G.; Mariš, I. C.; Marsella, G.; Martello, D.; Martinez, H.; Martínez Bravo, O.; Masías Meza, J. J.; Mathes, H. J.; Mathys, S.; Matthews, J.; Matthews, J. A. J.; Matthiae, G.; Mayotte, E.; Mazur, P. O.; Medina, C.; Medina-Tanco, G.; Melo, D.; Menshikov, A.; Messina, S.; Micheletti, M. I.; Middendorf, L.; Minaya, I. A.; Miramonti, L.; Mitrica, B.; Mockler, D.; Mollerach, S.; Montanet, F.; Morello, C.; Mostafá, M.; Müller, A. L.; Müller, G.; Muller, M. A.; Müller, S.; Mussa, R.; Naranjo, I.; Nellen, L.; Neuser, J.; Nguyen, P. H.; Niculescu-Oglinzanu, M.; Niechciol, M.; Niemietz, L.; Niggemann, T.; Nitz, D.; Nosek, D.; Novotny, V.; Nožka, H.; Núñez, L. A.; Ochilo, L.; Oikonomou, F.; Olinto, A.; Pakk Selmi-Dei, D.; Palatka, M.; Pallotta, J.; Papenbreer, P.; Parente, G.; Parra, A.; Paul, T.; Pech, M.; Pedreira, F.; Pȩkala, J.; Pelayo, R.; Peña-Rodriguez, J.; Pereira, L. A. S.; Perlín, M.; Perrone, L.; Peters, C.; Petrera, S.; Phuntsok, J.; Piegaia, R.; Pierog, T.; Pieroni, P.; Pimenta, M.; Pirronello, V.; Platino, M.; Plum, M.; Porowski, C.; Prado, R. R.; Privitera, P.; Prouza, M.; Quel, E. J.; Querchfeld, S.; Quinn, S.; Ramos-Pollan, R.; Rautenberg, J.; Ravignani, D.; Revenu, B.; Ridky, J.; Risse, M.; Ristori, P.; Rizi, V.; Rodrigues de Carvalho, W.; Rodriguez Fernandez, G.; Rodriguez Rojo, J.; Rogozin, D.; Roncoroni, M. J.; Roth, M.; Roulet, E.; Rovero, A. C.; Ruehl, P.; Saffi, S. J.; Saftoiu, A.; Salazar, H.; Saleh, A.; Salesa Greus, F.; Salina, G.; Sanabria Gomez, J. D.; Sánchez, F.; Sanchez-Lucas, P.; Santos, E. M.; Santos, E.; Sarazin, F.; Sarkar, B.; Sarmento, R.; Sarmiento, C. A.; Sato, R.; Schauer, M.; Scherini, V.; Schieler, H.; Schimp, M.; Schmidt, D.; Scholten, O.; Schovánek, P.; Schröder, F. G.; Schulz, A.; Schulz, J.; Schumacher, J.; Sciutto, S. J.; Segreto, A.; Settimo, M.; Shadkam, A.; Shellard, R. C.; Sigl, G.; Silli, G.; Sima, O.; Śmiałkowski, A.; Šmída, R.; Snow, G. R.; Sommers, P.; Sonntag, S.; Sorokin, J.; Squartini, R.; Stanca, D.; Stanič, S.; Stasielak, J.; Stassi, P.; Strafella, F.; Suarez, F.; Suarez Durán, M.; Sudholz, T.; Suomijärvi, T.; Supanitsky, A. D.; Swain, J.; Szadkowski, Z.; Taboada, A.; Taborda, O. A.; Tapia, A.; Theodoro, V. M.; Timmermans, C.; Todero Peixoto, C. J.; Tomankova, L.; Tomé, B.; Torralba Elipe, G.; Torres Machado, D.; Torri, M.; Travnicek, P.; Trini, M.; Ulrich, R.; Unger, M.; Urban, M.; Valdés Galicia, J. F.; Valiño, I.; Valore, L.; van Aar, G.; van Bodegom, P.; van den Berg, A. M.; van Vliet, A.; Varela, E.; Vargas Cárdenas, B.; Varner, G.; Vázquez, J. R.; Vázquez, R. A.; Veberič, D.; Vergara Quispe, I. D.; Verzi, V.; Vicha, J.; Villaseñor, L.; Vorobiov, S.; Wahlberg, H.; Wainberg, O.; Walz, D.; Watson, A. A.; Weber, M.; Weindl, A.; Wiencke, L.; Wilczyński, H.; Winchen, T.; Wittkowski, D.; Wundheiler, B.; Yang, L.; Yelos, D.; Yushkov, A.; Zas, E.; Zavrtanik, D.; Zavrtanik, M.; Zepeda, A.; Zimmermann, B.; Ziolkowski, M.; Zong, Z.; Zuccarello, F.

2017-02-01

Atmospheric conditions, such as the pressure (P), temperature (T) or air density (ρ propto P/T), affect the development of extended air showers initiated by energetic cosmic rays. We study the impact of the atmospheric variations on the reconstruction of air showers with data from the arrays of surface detectors of the Pierre Auger Observatory, considering separately the one with detector spacings of 1500 m and the one with 750 m spacing. We observe modulations in the event rates that are due to the influence of the air density and pressure variations on the measured signals, from which the energy estimators are obtained. We show how the energy assignment can be corrected to account for such atmospheric effects.

Surfacers change their dive tactics depending on the aim of the dive: evidence from simultaneous measurements of breaths and energy expenditure.

PubMed

Okuyama, Junichi; Tabata, Runa; Nakajima, Kana; Arai, Nobuaki; Kobayashi, Masato; Kagawa, Shiro

2014-11-22

Air-breathing divers are assumed to have evolved to apportion their time between surface and underwater periods to maximize the benefit gained from diving activities. However, whether they change their time allocation depending on the aim of the dive is still unknown. This may be particularly crucial for 'surfacers' because they dive for various purposes in addition to foraging. In this study, we counted breath events at the surface and estimated oxygen consumption during resting, foraging and other dives in 11 green turtles (Chelonia mydas) in the wild. Breath events were counted by a head-mounted acceleration logger or direct observation based on an animal-borne video logger, and oxygen consumption was estimated by measuring overall dynamic body acceleration. Our results indicate that green turtles maximized their submerged time, following this with five to seven breaths to replenish oxygen for resting dives. However, they changed their dive tactic during foraging and other dives; they surfaced without depleting their estimated stores of oxygen, followed by only a few breaths for effective foraging and locomotion. These dichotomous surfacing tactics would be the result of behavioural modifications by turtles depending on the aim of each dive. © 2014 The Author(s) Published by the Royal Society. All rights reserved.

Decisive role of nuclear quantum effects on surface mediated water dissociation at finite temperature.

PubMed

Litman, Yair; Donadio, Davide; Ceriotti, Michele; Rossi, Mariana

2018-03-14

Water molecules adsorbed on inorganic substrates play an important role in several technological applications. In the presence of light atoms in adsorbates, nuclear quantum effects (NQEs) influence the structural stability and the dynamical properties of these systems. In this work, we explore the impact of NQEs on the dissociation of water wires on stepped Pt(221) surfaces. By performing ab initio molecular dynamics simulations with van der Waals corrected density functional theory, we note that several competing minima for both intact and dissociated structures are accessible at finite temperatures, making it important to assess whether harmonic estimates of the quantum free energy are sufficient to determine the relative stability of the different states. We thus perform ab initio path integral molecular dynamics (PIMD) in order to calculate these contributions taking into account the conformational entropy and anharmonicities at finite temperatures. We propose that when adsorption is weak and NQEs on the substrate are negligible, PIMD simulations can be performed through a simple partition of the system, resulting in considerable computational savings. We then calculate the full contribution of NQEs to the free energies, including also anharmonic terms. We find that they result in an increase of up to 20% of the quantum contribution to the dissociation free energy compared with the harmonic estimates. We also find that the dissociation process has a negligible contribution from tunneling but is dominated by zero point energies, which can enhance the rate of dissociation by three orders of magnitude. Finally we highlight how both temperature and NQEs indirectly impact dipoles and the redistribution of electron density, causing work function changes of up to 0.4 eV with respect to static estimates. This quantitative determination of the change in the work function provides a possible approach to determine experimentally the most stable configurations of water oligomers on the stepped surfaces.

Decisive role of nuclear quantum effects on surface mediated water dissociation at finite temperature

NASA Astrophysics Data System (ADS)

Litman, Yair; Donadio, Davide; Ceriotti, Michele; Rossi, Mariana

2018-03-01

Water molecules adsorbed on inorganic substrates play an important role in several technological applications. In the presence of light atoms in adsorbates, nuclear quantum effects (NQEs) influence the structural stability and the dynamical properties of these systems. In this work, we explore the impact of NQEs on the dissociation of water wires on stepped Pt(221) surfaces. By performing ab initio molecular dynamics simulations with van der Waals corrected density functional theory, we note that several competing minima for both intact and dissociated structures are accessible at finite temperatures, making it important to assess whether harmonic estimates of the quantum free energy are sufficient to determine the relative stability of the different states. We thus perform ab initio path integral molecular dynamics (PIMD) in order to calculate these contributions taking into account the conformational entropy and anharmonicities at finite temperatures. We propose that when adsorption is weak and NQEs on the substrate are negligible, PIMD simulations can be performed through a simple partition of the system, resulting in considerable computational savings. We then calculate the full contribution of NQEs to the free energies, including also anharmonic terms. We find that they result in an increase of up to 20% of the quantum contribution to the dissociation free energy compared with the harmonic estimates. We also find that the dissociation process has a negligible contribution from tunneling but is dominated by zero point energies, which can enhance the rate of dissociation by three orders of magnitude. Finally we highlight how both temperature and NQEs indirectly impact dipoles and the redistribution of electron density, causing work function changes of up to 0.4 eV with respect to static estimates. This quantitative determination of the change in the work function provides a possible approach to determine experimentally the most stable configurations of water oligomers on the stepped surfaces.

How important is getting the land surface energy exchange correct in WRF for wind energy forecasting?

NASA Astrophysics Data System (ADS)

Wharton, S.; Simpson, M.; Osuna, J. L.; Newman, J. F.; Biraud, S.

2013-12-01

Wind power forecasting is plagued with difficulties in accurately predicting the occurrence and intensity of atmospheric conditions at the heights spanned by industrial-scale turbines (~ 40 to 200 m above ground level). Better simulation of the relevant physics would enable operational practices such as integration of large fractions of wind power into power grids, scheduling maintenance on wind energy facilities, and deciding design criteria based on complex loads for next-generation turbines and siting. Accurately simulating the surface energy processes in numerical models may be critically important for wind energy forecasting as energy exchange at the surface strongly drives atmospheric mixing (i.e., stability) in the lower layers of the planetary boundary layer (PBL), which in turn largely determines wind shear and turbulence at heights found in the turbine rotor-disk. We hypothesize that simulating accurate a surface-atmosphere energy coupling should lead to more accurate predictions of wind speed and turbulence at heights within the turbine rotor-disk. Here, we tested 10 different land surface model configurations in the Weather Research and Forecasting (WRF) model including Noah, Noah-MP, SSiB, Pleim-Xiu, RUC, and others to evaluate (1) the accuracy of simulated surface energy fluxes to flux tower measurements, (2) the accuracy of forecasted wind speeds to observations at rotor-disk heights, and (3) the sensitivity of forecasting hub-height rotor disk wind speed to the choice of land surface model. WRF was run for four, two-week periods covering both summer and winter periods over the Southern Great Plains ARM site in Oklahoma. Continuous measurements of surface energy fluxes and lidar-based wind speed, direction and turbulence were also available. The SGP ARM site provided an ideal location for this evaluation as it centrally located in the wind-rich Great Plains and multi-MW wind farms are rapidly expanding in the area. We found significant differences in simulated wind speeds at rotor-disk heights from WRF which indicated, in part, the sensitivity of lower PBL winds to surface energy exchange. We also found significant differences in energy partitioning between sensible heat and latent energy depending on choice of land surface model. Overall, the most consistent, accurate model results were produced using Noah-MP. Noah-MP was most accurate at simulating energy fluxes and wind shear. Hub-height wind speed, however, was predicted with most accuracy with Pleim-Xiu. This suggests that simulating wind shear in the surface layer is consistent with accurately simulating surface energy exchange while the exact magnitudes of wind speed may be more strongly influenced by the PBL dynamics. As the nation is working towards a 20% wind energy goal by 2030, increasing the accuracy of wind forecasting at rotor-disk heights becomes more important considering that utilities require wind farms to estimate their power generation 24 to 36 hours ahead and face penalties for inaccuracies in those forecasts.

Color and chemistry on Triton

NASA Technical Reports Server (NTRS)

Thompson, W. Reid; Sagan, Carl

1990-01-01

The surface of Triton is very bright but shows subtle yellow to peach hues which probably arise from the production of colored organic compounds from CH4 + N2 and other simple species. In order to investigate possible relationships between chemical processes and the observed surface distribution of chromophores, the surface units are classified according to color/albedo properties, the rates of production of organic chromophores by the action of ultraviolet light and high-energy charged particles is estimated, and rates, spectral properties, and expected seasonal redistribution processes are compared to suggest possible origins of the colors seen on Triton's surface.

Soil moisture status estimation over Three Gorges area with Landsat TM data based on temperature vegetation dryness index

NASA Astrophysics Data System (ADS)

Xu, Lina; Niu, Ruiqing; Li, Jiong; Dong, Yanfang

2011-12-01

Soil moisture is the important indicator of climate, hydrology, ecology, agriculture and other parameters of the land surface and atmospheric interface. Soil moisture plays an important role on the water and energy exchange at the land surface/atmosphere interface. Remote sensing can provide information on large area quickly and easily, so it is significant to do research on how to monitor soil moisture by remote sensing. This paper presents a method to assess soil moisture status using Landsat TM data over Three Gorges area in China based on TVDI. The potential of Temperature- Vegetation Dryness Index (TVDI) from Landsat TM data in assessing soil moisture was investigated in this region. After retrieving land surface temperature and vegetation index a TVDI model based on the features of Ts-NDVI space is established. And finally, soil moisture status is estimated according to TVDI. It shows that TVDI has the advantages of stability and high accuracy to estimating the soil moisture status.

Estimates of Sputter Yields of Solar-Wind Heavy Ions of Lunar Regolith Materials

NASA Technical Reports Server (NTRS)

Barghouty, Abdulmasser F.; Adams, James H., Jr.

2008-01-01

At energies of approximately 1 keV/amu, solar-wind protons and heavy ions interact with the lunar surface materials via a number of microscopic interactions that include sputtering. Solar-wind induced sputtering is a main mechanism by which the composition of the topmost layers of the lunar surface can change, dynamically and preferentially. This work concentrates on sputtering induced by solar-wind heavy ions. Sputtering associated with slow (speeds the electrons speed in its first Bohr orbit) and highly charged ions are known to include both kinetic and potential sputtering. Potential sputtering enjoys some unique characteristics that makes it of special interest to lunar science and exploration. Unlike the yield from kinetic sputtering where simulation and approximation schemes exist, the yield from potential sputtering is not as easy to estimate. This work will present a preliminary numerical scheme designed to estimate potential sputtering yields from reactions relevant to this aspect of solar-wind lunar-surface coupling.

Inference of Surface Chemical and Physical Properties Using Mid-Infrared (MIR) Spectral Observations

NASA Technical Reports Server (NTRS)

Roush, Ted L.

2016-01-01

Reflected or emitted energy from solid surfaces in the solar system can provide insight into thermo-physical and chemical properties of the surface materials. Measurements have been obtained from instruments located on Earth-based telescopes and carried on several space missions. The characteristic spectral features commonly observed in Mid-Infrared (MIR) spectra of minerals will be reviewed, along with methods used for compositional interpretations of MIR emission spectra. The influence of surface grain size, and space weathering processes on MIR emissivity spectra will also be discussed. Methods used for estimating surface temperature, emissivity, and thermal inertias from MIR spectral observations will be reviewed.

A surface plasmon model for laser ablation of Ag sup + ions from a roughened Ag surface

DOE Office of Scientific and Technical Information (OSTI.GOV)

Ritchie, R.H.; Manson, J.R.; Echenique, P.M.

1991-01-01

Experimental work by Shea and Compton suggests that Ag{sup +} ions emitted from a roughened Ag surface irradiated by a nanosecond or picosecond laser beam may absorb the full energy of the Ag surface plasmon. We have modeled this process under the assumption that it proceeds through an inverse bremsstrahlung-type absorption of the SP quantum by Ag{sup +} ion which also undergoes a small-impact parameter collision with another ion or atom in the vicinity of the surface. We give a quantitative estimate of the absorption probability and find reasonable agreement with the Shea-Compton results. 8 refs., 2 figs.

Ground-water and surface-water flow and estimated water budget for Lake Seminole, southwestern Georgia and northwestern Florida

USGS Publications Warehouse

Dalton, Melinda S.; Aulenbach, Brent T.; Torak, Lynn J.

2004-01-01

Lake Seminole is a 37,600-acre impoundment formed at the confluence of the Flint and Chattahoochee Rivers along the Georgia?Florida State line. Outflow from Lake Seminole through Jim Woodruff Lock and Dam provides headwater to the Apalachicola River, which is a major supply of freshwater, nutrients, and detritus to ecosystems downstream. These rivers,together with their tributaries, are hydraulically connected to karst limestone units that constitute most of the Upper Floridan aquifer and to a chemically weathered residuum of undifferentiated overburden. The ground-water flow system near Lake Seminole consists of the Upper Floridan aquifer and undifferentiated overburden. The aquifer is confined below by low-permeability sediments of the Lisbon Formation and, generally, is semiconfined above by undifferentiated overburden. Ground-water flow within the Upper Floridan aquifer is unconfined or semiconfined and discharges at discrete points by springflow or diffuse leakage into streams and other surface-water bodies. The high degree of connectivity between the Upper Floridan aquifer and surface-water bodies is limited to the upper Eocene Ocala Limestone and younger units that are in contact with streams in the Lake Seminole area. The impoundment of Lake Seminole inundated natural stream channels and other low-lying areas near streams and raised the water-level altitude of the Upper Floridan aquifer near the lake to nearly that of the lake, about 77 feet. Surface-water inflow from the Chattahoochee and Flint Rivers and Spring Creek and outflow to the Apalachicola River through Jim Woodruff Lock and Dam dominate the water budget for Lake Seminole. About 81 percent of the total water-budget inflow consists of surface water; about 18 percent is ground water, and the remaining 1 percent is lake precipitation. Similarly, lake outflow consists of about 89 percent surface water, as flow to the Apalachicola River through Jim Woodruff Lock and Dam, about 4 percent ground water, and about 2 percent lake evaporation. Measurement error and uncertainty in flux calculations cause a flow imbalance of about 4 percent between inflow and outflow water-budget components. Most of this error can be attributed to errors in estimating ground-water discharge from the lake, which was calculated using a ground-water model calibrated to October 1986 conditions for the entire Apalachicola?Chattahoochee?Flint River Basin and not just the area around Lake Seminole. Evaporation rates were determined using the preferred, but mathematically complex, energy budget and five empirical equations: Priestley-Taylor, Penman, DeBruin-Keijman, Papadakis, and the Priestley-Taylor used by the Georgia Automated Environmental Monitoring Network. Empirical equations require a significant amount of data but are relatively easy to calculate and compare well to long-term average annual (April 2000?March 2001) pan evaporation, which is 65 inches. Calculated annual lake evaporation, for the study period, using the energy-budget method was 67.2 inches, which overestimated long-term average annual pan evaporation by 2.2 inches. The empirical equations did not compare well with the energy-budget method during the 18-month study period, with average differences in computed evaporation using each equation ranging from 8 to 26 percent. The empirical equations also compared poorly with long-term average annual pan evaporation, with average differences in evaporation ranging from 3 to 23 percent. Energy budget and long-term average annual pan evaporation estimates did compare well, with only a 3-percent difference between estimates. Monthly evaporation estimates using all methods ranged from 0.7 to 9.5 inches and were lowest during December 2000 and highest during May 2000. Although the energy budget is generally the preferred method, the dominance of surface water in the Lake Seminole water budget makes the method inaccurate and difficult to use, because surface water makes up m

The influence of internal variability on Earth's energy balance framework and implications for estimating climate sensitivity

NASA Astrophysics Data System (ADS)

Dessler, Andrew E.; Mauritsen, Thorsten; Stevens, Bjorn

2018-04-01

Our climate is constrained by the balance between solar energy absorbed by the Earth and terrestrial energy radiated to space. This energy balance has been widely used to infer equilibrium climate sensitivity (ECS) from observations of 20th-century warming. Such estimates yield lower values than other methods, and these have been influential in pushing down the consensus ECS range in recent assessments. Here we test the method using a 100-member ensemble of the Max Planck Institute Earth System Model (MPI-ESM1.1) simulations of the period 1850-2005 with known forcing. We calculate ECS in each ensemble member using energy balance, yielding values ranging from 2.1 to 3.9 K. The spread in the ensemble is related to the central assumption in the energy budget framework: that global average surface temperature anomalies are indicative of anomalies in outgoing energy (either of terrestrial origin or reflected solar energy). We find that this assumption is not well supported over the historical temperature record in the model ensemble or more recent satellite observations. We find that framing energy balance in terms of 500 hPa tropical temperature better describes the planet's energy balance.

Simulation studies for surfaces and materials strength

NASA Technical Reports Server (NTRS)

Halicioglu, T.

1986-01-01

During this reporting period three investigations were carried out. The first area of research concerned the analysis of the structure-energy relationship in small clusters. This study is very closely related to the improvement of the potential energy functions which are suitable and simple enough to be used in atomistic simulation studies. Parameters obtained from ab initio calculations for dimers and trimers of Al were used to estimate energetics and global minimum energy structures of clusters continuing up to 15 Al atoms. The second research topic addressed modeling of the collision process for atoms impinging on surfaces. In this simulation study qualitative aspects of the O atom collision with a graphite surface were analyzed. Four different O/graphite systems were considered and the aftermath of the impact was analyzed. The final area of investigation was related to the simulation of thin amorphous Si films on crystalline Si substrates. Parameters obtained in an earlier study were used to model an exposed amorphous Si surface and an a-Si/c-Si interface. Structural details for various film thicknesses were investigated at an atomistic level.

Partitioning Evapotranspiration in Semiarid Grassland and Shrubland Ecosystems Using Diurnal Surface Temperature Variation

NASA Technical Reports Server (NTRS)

Moran, M. Susan; Scott, Russell L.; Keefer, Timothy O.; Paige, Ginger B.; Emmerich, William E.; Cosh, Michael H.; O'Neill, Peggy E.

2007-01-01

The encroachment of woody plants in grasslands across the Western U.S. will affect soil water availability by altering the contributions of evaporation (E) and transpiration (T) to total evapotranspiration (ET). To study this phenomenon, a network of flux stations is in place to measure ET in grass- and shrub-dominated ecosystems throughout the Western U.S. A method is described and tested here to partition the daily measurements of ET into E and T based on diurnal surface temperature variations of the soil and standard energy balance theory. The difference between the mid-afternoon and pre-dawn soil surface temperature, termed Apparent Thermal Inertia (I(sub A)), was used to identify days when E was negligible, and thus, ET=T. For other days, a three-step procedure based on energy balance equations was used to estimate Qe contributions of daily E and T to total daily ET. The method was tested at Walnut Gulch Experimental Watershed in southeast Arizona based on Bowen ratio estimates of ET and continuous measurements of surface temperature with an infrared thermometer (IRT) from 2004- 2005, and a second dataset of Bowen ratio, IRT and stem-flow gage measurements in 2003. Results showed that reasonable estimates of daily T were obtained for a multi-year period with ease of operation and minimal cost. With known season-long daily T, E and ET, it is possible to determine the soil water availability associated with grass- and shrub-dominated sites and better understand the hydrologic impact of regional woody plant encroachment.

Selective IR multiphoton dissociation of molecules in a pulsed gas-dynamically cooled molecular flow interacting with a solid surface as an alternative to low-energy methods of molecular laser isotope separation

DOE Office of Scientific and Technical Information (OSTI.GOV)

Makarov, G N; Petin, A N

2016-03-31

We report the results of studies on the isotope-selective infrared multiphoton dissociation (IR MFD) of SF{sub 6} and CF{sub 3}I molecules in a pulsed, gas-dynamically cooled molecular flow interacting with a solid surface. The productivity of this method in the conditions of a specific experiment (by the example of SF{sub 6} molecules) is evaluated. A number of low-energy methods of molecular laser isotope separation based on the use of infrared lasers for selective excitation of molecules are analysed and their productivity is estimated. The methods are compared with those of selective dissociation of molecules in the flow interacting with amore » surface. The advantages of this method compared to the low-energy methods of molecular laser isotope separation and the IR MPD method in the unperturbed jets and flows are shown. It is concluded that this method could be a promising alternative to the low-energy methods of molecular laser isotope separation. (laser separation of isotopes)« less

Quantitative Prediction of Stone Fragility From Routine Dual Energy CT: Ex vivo proof of Feasibility.

PubMed

Ferrero, Andrea; Montoya, Juan C; Vaughan, Lisa E; Huang, Alice E; McKeag, Ian O; Enders, Felicity T; Williams, James C; McCollough, Cynthia H

2016-12-01

Previous studies have demonstrated a qualitative relationship between stone fragility and internal stone morphology. The goal of this study was to quantify morphologic features from dual-energy computed tomography (CT) images and assess their relationship to stone fragility. Thirty-three calcified urinary stones were scanned with micro-CT. Next, they were placed within torso-shaped water phantoms and scanned with the dual-energy CT stone composition protocol in routine use at our institution. Mixed low- and high-energy images were used to measure volume, surface roughness, and 12 metrics describing internal morphology for each stone. The ratios of low- to high-energy CT numbers were also measured. Subsequent to imaging, stone fragility was measured by disintegrating each stone in a controlled ex vivo experiment using an ultrasonic lithotripter and recording the time to comminution. A multivariable linear regression model was developed to predict time to comminution. The average stone volume was 300 mm 3 (range: 134-674 mm 3 ). The average comminution time measured ex vivo was 32 seconds (range: 7-115 seconds). Stone volume, dual-energy CT number ratio, and surface roughness were found to have the best combined predictive ability to estimate comminution time (adjusted R 2  = 0.58). The predictive ability of mixed dual-energy CT images, without use of the dual-energy CT number ratio, to estimate comminution time was slightly inferior, with an adjusted R 2 of 0.54. Dual-energy CT number ratios, volume, and morphologic metrics may provide a method for predicting stone fragility, as measured by time to comminution from ultrasonic lithotripsy. Copyright © 2016 The Association of University Radiologists. Published by Elsevier Inc. All rights reserved.

Quantitative prediction of stone fragility from routine single and dual energy CT: proof of feasibility

PubMed Central

Ferrero, Andrea; Montoya, Juan C.; Vaughan, Lisa E.; Huang, Alice E.; McKeag, Ian O.; Enders, Felicity T.; Williams, James C.; McCollough, Cynthia H.

2016-01-01

Rationale and Objectives Previous studies have demonstrated a qualitative relationship between stone fragility and internal stone morphology. The goal of this study was to quantify morphological features from dual-energy CT images and assess their relationship to stone fragility. Materials and Methods Thirty-three calcified urinary stones were scanned with micro CT. Next, they were placed within torso-shaped water phantoms and scanned with the dual-energy CT stone composition protocol in routine use at our institution. Mixed low-and high-energy images were used to measure volume, surface roughness, and 12 metrics describing internal morphology for each stone. The ratios of low- to high-energy CT numbers were also measured. Subsequent to imaging, stone fragility was measured by disintegrating each stone in a controlled ex vivo experiment using an ultrasonic lithotripter and recording the time to comminution. A multivariable linear regression model was developed to predict time to comminution. Results The average stone volume was 300 mm3 (range 134–674 mm3). The average comminution time measured ex vivo was 32 s (range 7–115 s). Stone volume, dual-energy CT number ratio and surface roughness were found to have the best combined predictive ability to estimate comminution time (adjusted R2= 0.58). The predictive ability of mixed dual-energy CT images, without use of the dual-energy CT number ratio, to estimate comminution time was slightly inferior, with an adjusted R2 of 0.54. Conclusion Dual-energy CT number ratios, volume, and morphological metrics may provide a method for predicting stone fragility, as measured by time to comminution from ultrasonic lithotripsy. PMID:27717761

Surfaces of nanomaterials for sustainable energy applications: thin-film 2D-ACAR and PALS studies

NASA Astrophysics Data System (ADS)

Barbiellini, B.; Chai, L.; Al-Sawai, W.; Eijt, S. W. H.; Mijnarends, P. E.; Schut, H.; Gao, Y.; Houtepen, A. J.; Ravelli, L.; Egger, W.; van Huis, M. A.; Bansil, A.

2013-03-01

Positron (e+) annihilation spectroscopy is one of only a few techniques to probe the surfaces of nanoparticles. We investigated thin films of PbSe colloidal semiconductor nanocrystals (NCs) in the range 2-10 nm as prospective highly efficient absorbers for solar cells. We compare and contrast our findings with previous studies on CdSe NCs. Evidence obtained from our e+ lifetime spectroscopy study using the PLEPS spectrometer shows that 90-95% of the implanted positrons are effectively trapped and confined at the surfaces of these NCs. The remaining 5-10% of the e+ annihilate in the relatively large oleic acid ligands, in fair agreement with the estimated positron stopping power of the PbSe nanoparticle ``core'' relative to the ligand ``shell.'' 2D-ACAR measurements on the same set of films using the low-energy e+ beam POSH showed that the e+ wavefunction at the surfaces of the PbSe NCs is more localized than for the case of CdSe NCs. Comparison with calculated e+ - e- momentum densities indicates a Pb deficiency at the surfaces of the PbSe NCs, which correlates with e+ lifetime and the NCs morphology. Work supported in part by the US Department of Energy.

Segmentation and additive approach: A reliable technique to study noncovalent interactions of large molecules at the surface of single-wall carbon nanotubes.

PubMed

Torres, Ana M; Scheiner, Steve; Roy, Ajit K; Garay-Tapia, Andrés M; Bustamante, John; Kar, Tapas

2016-08-05

This investigation explores a new protocol, named Segmentation and Additive approach (SAA), to study exohedral noncovalent functionalization of single-walled carbon nanotubes with large molecules, such as polymers and biomolecules, by segmenting the entire system into smaller units to reduce computational cost. A key criterion of the segmentation process is the preservation of the molecular structure responsible for stabilization of the entire system in smaller segments. Noncovalent interaction of linoleic acid (LA, C18 H32 O2 ), a fatty acid, at the surface of a (10,0) zigzag nanotube is considered for test purposes. Three smaller segmented models have been created from the full (10,0)-LA system and interaction energies were calculated for these models and compared with the full system at different levels of theory, namely ωB97XD, LDA. The success of this SAA is confirmed as the sum of the interaction energies is in very good agreement with the total interaction energy. Besides reducing computational cost, another merit of SAA is an estimation of the contributions from different sections of the large system to the total interaction energy which can be studied in-depth using a higher level of theory to estimate several properties of each segment. On the negative side, bulk properties, such as HOMO-LUMO (highest occupied molecular orbital - lowest occupied molecular orbital) gap, of the entire system cannot be estimated by adding results from segment models. © 2016 Wiley Periodicals, Inc. © 2016 Wiley Periodicals, Inc.

Evaluation of Two Energy Balance Closure Parametrizations

NASA Astrophysics Data System (ADS)

Eder, Fabian; De Roo, Frederik; Kohnert, Katrin; Desjardins, Raymond L.; Schmid, Hans Peter; Mauder, Matthias

2014-05-01

A general lack of energy balance closure indicates that tower-based eddy-covariance (EC) measurements underestimate turbulent heat fluxes, which calls for robust correction schemes. Two parametrization approaches that can be found in the literature were tested using data from the Canadian Twin Otter research aircraft and from tower-based measurements of the German Terrestrial Environmental Observatories (TERENO) programme. Our analysis shows that the approach of Huang et al. (Boundary-Layer Meteorol 127:273-292, 2008), based on large-eddy simulation, is not applicable to typical near-surface flux measurements because it was developed for heights above the surface layer and over homogeneous terrain. The biggest shortcoming of this parametrization is that the grid resolution of the model was too coarse so that the surface layer, where EC measurements are usually made, is not properly resolved. The empirical approach of Panin and Bernhofer (Izvestiya Atmos Oceanic Phys 44:701-716, 2008) considers landscape-level roughness heterogeneities that induce secondary circulations and at least gives a qualitative estimate of the energy balance closure. However, it does not consider any feature of landscape-scale heterogeneity other than surface roughness, such as surface temperature, surface moisture or topography. The failures of both approaches might indicate that the influence of mesoscale structures is not a sufficient explanation for the energy balance closure problem. However, our analysis of different wind-direction sectors shows that the upwind landscape-scale heterogeneity indeed influences the energy balance closure determined from tower flux data. We also analyzed the aircraft measurements with respect to the partitioning of the "missing energy" between sensible and latent heat fluxes and we could confirm the assumption of scalar similarity only for Bowen ratios 1.

Thermal affected zone obtained in machining steel XC42 by high-power continuous CO 2 laser

NASA Astrophysics Data System (ADS)

Jebbari, Neila; Jebari, Mohamed Mondher; Saadallah, Faycal; Tarrats-Saugnac, Annie; Bennaceur, Raouf; Longuemard, Jean Paul

2008-09-01

A high-power continuous CO 2 laser (4 kW) can provide energy capable of causing melting or even, with a special treatment of the surface, vaporization of an XC42-steel sample. The laser-metal interaction causes an energetic machining mechanism, which takes place according to the assumption that the melting front precedes the laser beam, such that the laser beam interacts with a preheated surface whose temperature is near the melting point. The proposed model, obtained from the energy balance during the interaction time, concerns the case of machining with an inert gas jet and permits the calculation of the characteristic parameters of the groove according to the characteristic laser parameters (absorbed laser energy and impact diameter of the laser beam) and allows the estimation of the quantity of the energy causing the thermal affected zone (TAZ). This energy is equivalent to the heat quantity that must be injected in the heat propagation equation. In the case of a semi-infinite medium with fusion temperature at the surface, the resolution of the heat propagation equation gives access to the width of the TAZ.

Adhesion of protein residues to substituted (111) diamond surfaces: an insight from density functional theory and classical molecular dynamics simulations.

PubMed

Borisenko, Konstantin B; Reavy, Helen J; Zhao, Qi; Abel, Eric W

2008-09-15

Protein-repellent diamond coatings have great potential value for surface coatings on implants and surgical instruments. The design of these coatings relies on a fundamental understanding of the intermolecular interactions involved in the adhesion of proteins to surfaces. To get insight into these interactions, adhesion energies of glycine to pure and Si and N-doped (111) diamond surfaces represented as clusters were calculated in the gas phase, using density functional theory (DFT) at the B3LYP/6-31G* level. The computed adhesion energies indicated that adhesion of glycine to diamond surface may be modified by introducing additional elements into the surface. The adhesion was also found to induce considerable change in the conformation of glycine when compared with the lowest-energy conformer of the free molecule. In the Si and N-substituted diamond clusters, notable changes in the structures involving the substituents atoms when compared with smaller parent molecules, such as 1-methyl-1-silaadamantane and 1-azaadamantane, were detected. Adhesion free energy differences were estimated for a series of representative peptides (hydrophobic Phe-Gly-Phe, amphiphilic Arg-Gly-Phe, and hydrophilic Arg-Gly-Arg) to a (111) diamond surface substituted with different amounts of N, Si, or F, using molecular dynamics simulations in an explicit water environment employing a Dreiding force field. The calculations were in agreement with the DFT results in that adsorption of the studied peptides to diamond surface is influenced by introducing additional elements to the surface. It has been shown that, in general, substitution will enhance electrostatic interactions between a surface and surrounding water, leading to a weaker adhesion of the studied peptides.

Estimation of absorbed fraction to the anterior nose from inhaled beta emitters

NASA Astrophysics Data System (ADS)

Moussa, Hanna Moussa

2000-08-01

The main purpose of this research is to introduce a new and more realistic geometry for the anterior nose region (ET1) as an alternative to the one provided in ICRP Publication 66. For a more accurate estimation of electron absorbed fraction (AF) to the nuclei of basal cells in the ET 1 region, the proposed new geometry (frustum of a cone) replaces the cylinder geometry, which was used in ICRP 66. Since the electron absorbed fraction (AF) data in ICRP 66 are calculated based on the nose size for an adult Caucasian male, a second purpose of this research is to investigate how the nose size (different ethnic groups) and nose tissue composition (male, female and adolescent), affects the electron absorbed fraction values. The third aim of this research is to develop a Monte Carlo program to estimate the electron energies that emerge from the surface of spherical dust particles. Given that electrons can be located anywhere between the center and the surface of the sphere, we vary the sphere radius from 0.5 to 50 μm and investigate the effects of self-absorption on the emitted electron energies and absorbed fraction.

Comparison of Estimated Energy Requirements in Severely Burned Patients With Measurements by Using Indirect Calorimetry

PubMed Central

Tancheva, D.; Arabadziev, J.; Gergov, G.; Lachev, N.; Todorova, S.; Hristova, A.

2005-01-01

Summary Severe burn injuries give rise to an extreme state of physiological stress. No other trauma results in such an accelerated rate of tissue catabolism, loss of lean body mass, and depletion of energy and protein reserves. A heightened attention to energy needs is essential, and the significance of adequate nutritional support in the complex management of patients with major burns is very important. The purpose of this study is to compare the results obtained by three of the most popular methods of estimating energy requirements in severely burned adult patients with the measurements of resting energy (REE) expenditure by indirect calorimetry (IC). A prospective study was carried out of 20 patients (male/female ratio, 17/3; mean age, 37.83 ± 10.86 yr), without accompanying morbidities, with burn injuries covering a mean body surface area of 34.27 ± 11.55% and a mean abbreviated burn severity index of 7.44 ± 1.58. During the first 30 days after trauma, the energy requirements were estimated using the Curreri, Long, and Toronto formulas. Twice weekly measurements of REE by IC were obtained. It was found that the Curreri and Long formulas overestimated the energy requirements in severely burned patients, as found by other investigators. However, no significant difference was found between the daily energy requirements calculated by the Toronto formula and the measured REE values by IC. It is concluded that the Toronto formula can be used as an alternative method for estimating the energy requirements of patients with major burns in cases where IC is not available or not applicable. PMID:21990973

Utility of a thermal-based two-source energy balance model for estimating surface fluxes over complex landscapes

USDA-ARS?s Scientific Manuscript database

Many landscapes are comprised of a variety of vegetation types with different canopy structure, rooting depth, physiological characteristics, including response to environmental stressors, etc. Even in agricultural regions, different management practices, including crop rotations, irrigation schedu...

Unmanned airborne thermal and mutilspectral imagery for estimating evapotranspiration in irrigated vineyards

USDA-ARS?s Scientific Manuscript database

Thermal-infrared remote sensing of land surface temperature (LST) provides valuable information for quantifying rootzone water availability, evapotranspiration (ET) and crop condition. This paper describes the most recent modifications applied to the robust but relatively simple LST-based energy bal...

Evaluation of the relation between evapotranspiration and normalized difference vegetation index for downscaling the simplified surface energy balance model

USGS Publications Warehouse

Haynes, Jonathan V.; Senay, Gabriel B.

2012-01-01

The Simplified Surface Energy Balance (SSEB) model uses satellite imagery to estimate actual evapotranspiration (ETa) at 1-kilometer resolution. SSEB ETa is useful for estimating irrigation water use; however, resolution limitations restrict its use to regional scale applications. The U.S. Geological Survey investigated the downscaling potential of SSEB ETa from 1 kilometer to 250 meters by correlating ETa with the Normalized Difference Vegetation Index (NDVI) from the Moderate Resolution Imaging Spectroradiometer instrument (MODIS). Correlations were studied in three arid to semiarid irrigated landscapes of the Western United States (Escalante Valley near Enterprise, Utah; Palo Verde Valley near Blythe, California; and part of the Columbia Plateau near Quincy, Washington) during several periods from 2002 to 2008. Irrigation season ETa-NDVI correlations were lower than expected, ranging from R2 of 0.20 to 0.61 because of an eastward 2–3 kilometer shift in ETadata. The shift is due to a similar shift identified in the land-surface temperature (LST) data from the MODIS Terra satellite, which is used in the SSEB model. Further study is needed to delineate the Terra LST shift, its effect on SSEB ETa, and the relation between ETa and NDVI.

Topographic forcing and related uncertainties on glacier surface energy balance in High Mountain Asia

NASA Astrophysics Data System (ADS)

Olson, M.; Rupper, S.; Shean, D. E.

2017-12-01

Topography directly influences the amount of global radiation, as well as other key energy flux terms, arriving on a glacier surface. This is particularly important in regions of variable and complex topography such as High Mountain Asia (HMA). In this region surface energy and mass balance estimates often rely heavily on modeling, and thus require accurate accounting of topography through available remote sensing platforms. Our previous work shows that topographic shading from surrounding terrain can alter the mean daily potential direct shortwave radiation by upwards of 20% for some valley glaciers. In this work, we find in regions of high topographic relief that shading frequently dominates in the ablation zone rather than the accumulation zone, contrary to the findings of some previous studies. This however, is largely dependent on the valley aspect and relative relief of nearby terrain. In addition, we examine the impact of topography, primarily topographic shading, on components of surface energy balance for a large sample of glaciers across different regions in HMA. Our results show that while the impact of topographic shading is highly variable throughout HMA, the magnitude of influence can often be predicted based on simple characteristics such as latitude, valley aspect, and orientation of the immediate surrounding topography. We also explore the uncertainty in topographic shading and in calculated surface energy due to the spatial resolution and accuracy of DEMs. In particular, we compare the shading and energy balance results utilizing a suite of DEMs, including 2 m, 8 m, and 30 m World View DEMs, 30 m ASTER GDEM, 30 m SRTM DEM, and 30 m ALOS DEM. These results will help us improve glacier energy and mass balance modeling accuracy, and demonstrate limitations and uncertainties when modeling changes in surface energy fluxes due to surrounding topography for mountain glaciers.

A one-layer satellite surface energy balance for estimating evapotranspiration rates and crop water stress indexes.

PubMed

Barbagallo, Salvatore; Consoli, Simona; Russo, Alfonso

2009-01-01

Daily evapotranspiration fluxes over the semi-arid Catania Plain area (Eastern Sicily, Italy) were evaluated using remotely sensed data from Landsat Thematic Mapper TM5 images. A one-source parameterization of the surface sensible heat flux exchange using satellite surface temperature has been used. The transfer of sensible and latent heat is described by aerodynamic resistance and surface resistance. Required model inputs are brightness, temperature, fractional vegetation cover or leaf area index, albedo, crop height, roughness lengths, net radiation, air temperature, air humidity and wind speed. The aerodynamic resistance (r(ah)) is formulated on the basis of the Monin-Obukhov surface layer similarity theory and the surface resistance (r(s)) is evaluated from the energy balance equation. The instantaneous surface flux values were converted into evaporative fraction (EF) over the heterogeneous land surface to derive daily evapotranspiration values. Remote sensing-based assessments of crop water stress (CWSI) were also made in order to identify local irrigation requirements. Evapotranspiration data and crop coefficient values obtained from the approach were compared with: (i) data from the semi-empirical approach "K(c) reflectance-based", which integrates satellite data in the visible and NIR regions of the electromagnetic spectrum with ground-based measurements and (ii) surface energy flux measurements collected from a micrometeorological tower located in the experiment area. The expected variability associated with ET flux measurements suggests that the approach-derived surface fluxes were in acceptable agreement with the observations.

Lysimetric evaluation of simplified surface energy balance approach in the Texas high plains

USGS Publications Warehouse

Gowda, P.H.; Senay, G.B.; Howell, T.A.; Marek, T.H.

2009-01-01

Numerous energy balance (EB) algorithms have been developed to make use of remote sensing data to estimate evapotranspiration (ET) regionally. However, most EB models are complex to use and efforts are being made to simplify procedures mainly through the scaling of reference ET. The Simplified Surface Energy Balance (SSEB) is one such method. This approach has never been evaluated using measured ET data. In this study, the SSEB approach was applied to 14 Landsat TM images covering a major portion of the Southern High Plains that were acquired during 2006 and 2007 cropping seasons. Performance of the SSEB was evaluated by comparing estimated ET with measured daily ET from four large monolithic lysimeters at the USDA-ARS Conservation and Production Research Laboratory, Bushland, Texas. Statistical evaluation of results indicated that the SSEB accounted for 84% of the variability in the measured ET values with a slope and intercept of 0.75 and 1.1 mm d-1, respectively. Considering the minimal amount of ancillary data required and excellent performance in predicting daily ET, the SSEB approach is a promising tool for mapping ET in the semiarid Texas High Plains and in other parts of the world with similar hydro-climatic conditions.

Lysimetric Evaluation of Simplified Surface Energy Balance Approach in the Texas High Plains

USGS Publications Warehouse

Senay, Gabriel B.; Gowda, P.H.; Howell, T.A.; Marek, T.H.

2009-01-01

Numerous energy balance (EB) algorithms have been developed to make use of remote sensing data to estimate evapotranspiration (ET) regionally. However, most EB models are complex to use and efforts are being made to simplify procedures mainly through the scaling of reference ET. The Simplified Surface Energy Balance (SSEB) is one such method. This approach has never been evaluated using measured ET data. In this study, the SSEB approach was applied to fourteen Landsat TM images covering a major portion of the Southern High Plains that were acquired during 2006 and 2007 cropping seasons. Performance of the SSEB was evaluated by comparing estimated ET with measured daily ET from four large monolithic lysimeters at the USDA-ARS Conservation and Production Research Laboratory, Bushland, Texas. Statistical evaluation of results indicated that the SSEB accounted for 84% of the variability in the measured ET values with a slope and intercept of 0.75 and 1.1 mm d-1, respectively. Considering the minimal amount of ancillary data required and excellent performance in predicting daily ET, the SSEB approach is a promising tool for mapping ET in the semiarid Texas High Plains and in other parts of the world with similar hydro-climatic conditions.

Deriving global parameter estimates for the Noah land surface model using FLUXNET and machine learning

NASA Astrophysics Data System (ADS)

Chaney, Nathaniel W.; Herman, Jonathan D.; Ek, Michael B.; Wood, Eric F.

2016-11-01

With their origins in numerical weather prediction and climate modeling, land surface models aim to accurately partition the surface energy balance. An overlooked challenge in these schemes is the role of model parameter uncertainty, particularly at unmonitored sites. This study provides global parameter estimates for the Noah land surface model using 85 eddy covariance sites in the global FLUXNET network. The at-site parameters are first calibrated using a Latin Hypercube-based ensemble of the most sensitive parameters, determined by the Sobol method, to be the minimum stomatal resistance (rs,min), the Zilitinkevich empirical constant (Czil), and the bare soil evaporation exponent (fxexp). Calibration leads to an increase in the mean Kling-Gupta Efficiency performance metric from 0.54 to 0.71. These calibrated parameter sets are then related to local environmental characteristics using the Extra-Trees machine learning algorithm. The fitted Extra-Trees model is used to map the optimal parameter sets over the globe at a 5 km spatial resolution. The leave-one-out cross validation of the mapped parameters using the Noah land surface model suggests that there is the potential to skillfully relate calibrated model parameter sets to local environmental characteristics. The results demonstrate the potential to use FLUXNET to tune the parameterizations of surface fluxes in land surface models and to provide improved parameter estimates over the globe.

Estimating regional evapotranspiration from remotely sensed data by surface energy balance models

NASA Technical Reports Server (NTRS)

Asrar, Ghassem; Kanemasu, Edward; Myneni, R. B.; Lapitan, R. L.; Harris, T. R.; Killeen, J. M.; Cooper, D. I.; Hwang, C.

1987-01-01

Spatial and temporal variations of surface radiative temperatures of the burned and unburned areas of the Konza tallgrass prairie were studied. The role of management practices, topographic conditions and the uncertainties associated with in situ or airborne surface temperature measurements were assessed. Evaluation of diurnal and seasonal spectral characteristics of the burned and unburned areas of the prairie was also made. This was accomplished based on the analysis of measured spectral reflectance of the grass canopies under field conditions, and modelling their spectral behavior using a one dimensional radiative transfer model.

DFT studies of hydrocarbon combustion on metal surfaces.

PubMed

Arya, Mina; Mirzaei, Ali Akbar; Davarpanah, Abdol Mahmood; Barakati, Seyed Masoud; Atashi, Hossein; Mohsenzadeh, Abas; Bolton, Kim

2018-02-02

Catalytic combustion of hydrocarbons is an important technology to produce energy. Compared to conventional flame combustion, the catalyst enables this process to operate at lower temperatures; hence, reducing the energy required for efficient combustion. The reaction and activation energies of direct combustion of hydrocarbons (CH → C + H) on a series of metal surfaces were investigated using density functional theory (DFT). The data obtained for the Ag, Au, Al, Cu, Rh, Pt, and Pd surfaces were used to investigate the validity of the Brønsted-Evans-Polanyi (BEP) and transition state scaling (TSS) relations for this reaction on these surfaces. These relations were found to be valid (R 2  = 0.94 for the BEP correlation and R 2  = 1.0 for the TSS correlation) and were therefore used to estimate the energetics of the combustion reaction on Ni, Co, and Fe surfaces. It was found that the estimated transition state and activation energies (E TS  = -69.70 eV and E a  = 1.20 eV for Ni, E TS  = -87.93 eV and E a  = 1.08 eV for Co and E TS  = -92.45 eV and E a  = 0.83 eV for Fe) are in agreement with those obtained by DFT calculations (E TS  = -69.98 eV and E a  = 1.23 eV for Ni, E TS  = -87.88 eV and E a  = 1.08 eV for Co and E TS  = -92.57 eV and E a  = 0.79 eV for Fe). Therefore, these relations can be used to predict energetics of this reaction on these surfaces without doing the time consuming transition state calculations. Also, the calculations show that the activation barrier for CH dissociation decreases in the order Ag ˃ Au ˃ Al ˃ Cu ˃ Pt ˃ Pd ˃ Ni > Co > Rh > Fe.

Photospheric Observations of Surface and Body Modes in Solar Magnetic Pores

NASA Astrophysics Data System (ADS)

Keys, Peter H.; Morton, Richard J.; Jess, David B.; Verth, Gary; Grant, Samuel D. T.; Mathioudakis, Mihalis; Mackay, Duncan H.; Doyle, John G.; Christian, Damian J.; Keenan, Francis P.; Erdélyi, Robertus

2018-04-01

Over the past number of years, great strides have been made in identifying the various low-order magnetohydrodynamic wave modes observable in a number of magnetic structures found within the solar atmosphere. However, one aspect of these modes that has remained elusive, until now, is their designation as either surface or body modes. This property has significant implications for how these modes transfer energy from the waveguide to the surrounding plasma. Here, for the first time to our knowledge, we present conclusive, direct evidence of these wave characteristics in numerous pores that were observed to support sausage modes. As well as outlining methods to detect these modes in observations, we make estimates of the energies associated with each mode. We find surface modes more frequently in the data, as well as that surface modes appear to carry more energy than those displaying signatures of body modes. We find frequencies in the range of ∼2–12 mHz, with body modes as high as 11 mHz, but we do not find surface modes above 10 mHz. It is expected that the techniques we have applied will help researchers search for surface and body signatures in other modes and in differing structures from those presented here.

Quantum chemical investigation on the role of Li adsorbed on anatase (101) surface nano-materials on the storage of molecular hydrogen.

PubMed

Srinivasadesikan, V; Raghunath, P; Lin, M C

2015-06-01

Lithiation of TiO2 has been shown to enhance the storage of hydrogen up to 5.6 wt% (Hu et al. J Am Chem Soc 128:11740-11741, 2006). The mechanism for the process is still unknown. In this work we have carried out a study on the adsorption and diffusion of Li atoms on the surface and migration into subsurface layers of anatase (101) by periodic density functional theory calculations implementing on-site Coulomb interactions (DFT+U). The model consists of 24 [TiO2] units with 11.097 × 7.655 Å(2) surface area. Adsorption energies have been calculated for different Li atoms (1-14) on the surface. A maximum of 13 Li atoms can be accommodated on the surface at two bridged O, Ti-O, and Ti atom adsorption sites, with 83 kcal mol(-1) adsorption energy for a single Li atom adsorbed between two bridged O atoms from where it can migrate into the subsurface layer with 27 kcal mol(-1) energy barrier. The predicted adsorption energies for H2 on the lithiated TiO2 (101) surface with 1-10 Li atoms revealed that the highest adsorption energies occurred on 1-Li, 5-Li, and 9-Li surfaces with 3.5, 4.4, and 7.6 kcal mol(-1), respectively. The values decrease rapidly with additional H2 co-adsorbed on the lithiated surfaces; the maximum H2 adsorption on the 9Li-TiO2(a) surface was estimated to be only 0.32 wt% under 100 atm H2 pressure at 77 K. The result of Bader charge analysis indicated that the reduction of Ti occurred depending on the Li atoms covered on the TiO2 surface.

An Ab Initio Based Potential Energy Surface for Water

NASA Technical Reports Server (NTRS)

Partridge, Harry; Schwenke, David W.; Langhoff, Stephen R. (Technical Monitor)

1996-01-01

We report a new determination of the water potential energy surface. A high quality ab initio potential energy surface (PES) and dipole moment function of water have been computed. This PES is empirically adjusted to improve the agreement between the computed line positions and those from the HITRAN 92 data base. The adjustment is small, nonetheless including an estimate of core (oxygen 1s) electron correlation greatly improves the agreement with experiment. Of the 27,245 assigned transitions in the HITRAN 92 data base for H2(O-16), the overall root mean square (rms) deviation between the computed and observed line positions is 0.125/cm. However the deviations do not correspond to a normal distribution: 69% of the lines have errors less than 0.05/cm. Overall, the agreement between the line intensities computed in the present work and those contained in the data base is quite good, however there are a significant number of line strengths which differ greatly.

Commensurate comparisons of models with energy budget observations reveal consistent climate sensitivities

NASA Astrophysics Data System (ADS)

Armour, K.

2017-12-01

Global energy budget observations have been widely used to constrain the effective, or instantaneous climate sensitivity (ICS), producing median estimates around 2°C (Otto et al. 2013; Lewis & Curry 2015). A key question is whether the comprehensive climate models used to project future warming are consistent with these energy budget estimates of ICS. Yet, performing such comparisons has proven challenging. Within models, values of ICS robustly vary over time, as surface temperature patterns evolve with transient warming, and are generally smaller than the values of equilibrium climate sensitivity (ECS). Naively comparing values of ECS in CMIP5 models (median of about 3.4°C) to observation-based values of ICS has led to the suggestion that models are overly sensitive. This apparent discrepancy can partially be resolved by (i) comparing observation-based values of ICS to model values of ICS relevant for historical warming (Armour 2017; Proistosescu & Huybers 2017); (ii) taking into account the "efficacies" of non-CO2 radiative forcing agents (Marvel et al. 2015); and (iii) accounting for the sparseness of historical temperature observations and differences in sea-surface temperature and near-surface air temperature over the oceans (Richardson et al. 2016). Another potential source of discrepancy is a mismatch between observed and simulated surface temperature patterns over recent decades, due to either natural variability or model deficiencies in simulating historical warming patterns. The nature of the mismatch is such that simulated patterns can lead to more positive radiative feedbacks (higher ICS) relative to those engendered by observed patterns. The magnitude of this effect has not yet been addressed. Here we outline an approach to perform fully commensurate comparisons of climate models with global energy budget observations that take all of the above effects into account. We find that when apples-to-apples comparisons are made, values of ICS in models are consistently in good agreement with values of ICS inferred from global energy budget constraints. This suggests that the current generation of coupled climate models are not overly sensitive. However, since global energy budget observations do not constrain ECS, it is less certain whether model ECS values are realistic.

Direct measurement of exciton dissociation energy in polymers

NASA Astrophysics Data System (ADS)

Toušek, J.; Toušková, J.; Chomutová, R.; Paruzel, B.; Pfleger, J.

2017-01-01

Exciton dissociation energy was obtained based on the comparison of thickness of the space charge region estimated from the measurement of capacitance of prepared Schottky diode and from the measurement of photovoltage spectra. While the capacitance measurements provide information about the total width of the space charge region (SCR) the surface photovoltaic effect brings information only about the part of the SCR where electric field is sufficiently high to cause dissociation. For determination of the dissociation energy it is sufficient to find the electric potential in the SCR where the process starts.

DOE Office of Scientific and Technical Information (OSTI.GOV)

Yamashita, G.; Nagai, M., E-mail: mnagai@mp.es.osaka-u.ac.jp, E-mail: ashida@mp.es.osaka-u.ac.jp; Ashida, M., E-mail: mnagai@mp.es.osaka-u.ac.jp, E-mail: ashida@mp.es.osaka-u.ac.jp

We estimated the carrier multiplication efficiency in the most common solar-cell material, Si, by using optical-pump/terahertz-probe spectroscopy. Through close analysis of time-resolved data, we extracted the exact number of photoexcited carriers from the sheet carrier density 10 ps after photoexcitation, excluding the influences of spatial diffusion and surface recombination in the time domain. For incident photon energies greater than 4.0 eV, we observed enhanced internal quantum efficiency due to carrier multiplication. The evaluated value of internal quantum efficiency agrees well with the results of photocurrent measurements. This optical method allows us to estimate the carrier multiplication and surface recombination of carriersmore » quantitatively, which are crucial for the design of the solar cells.« less

A review of models and micrometeorological methods used to estimate wetland evapotranspiration

USGS Publications Warehouse

Drexler, J.Z.; Snyder, R.L.; Spano, D.; Paw, U.K.T.

2004-01-01

Within the past decade or so, the accuracy of evapotranspiration (ET) estimates has improved due to new and increasingly sophisticated methods. Yet despite a plethora of choices concerning methods, estimation of wetland ET remains insufficiently characterized due to the complexity of surface characteristics and the diversity of wetland types. In this review, we present models and micrometeorological methods that have been used to estimate wetland ET and discuss their suitability for particular wetland types. Hydrological, soil monitoring and lysimetric methods to determine ET are not discussed. Our review shows that, due to the variability and complexity of wetlands, there is no single approach that is the best for estimating wetland ET. Furthermore, there is no single foolproof method to obtain an accurate, independent measure of wetland ET. Because all of the methods reviewed, with the exception of eddy covariance and LIDAR, require measurements of net radiation (Rn) and soil heat flux (G), highly accurate measurements of these energy components are key to improving measurements of wetland ET. Many of the major methods used to determine ET can be applied successfully to wetlands of uniform vegetation and adequate fetch, however, certain caveats apply. For example, with accurate Rn and G data and small Bowen ratio (??) values, the Bowen ratio energy balance method can give accurate estimates of wetland ET. However, large errors in latent heat flux density can occur near sunrise and sunset when the Bowen ratio ?? ??? - 1??0. The eddy covariance method provides a direct measurement of latent heat flux density (??E) and sensible heat flux density (II), yet this method requires considerable expertise and expensive instrumentation to implement. A clear advantage of using the eddy covariance method is that ??E can be compared with Rn-G H, thereby allowing for an independent test of accuracy. The surface renewal method is inexpensive to replicate and, therefore, shows particular promise for characterizing variability in ET as a result of spatial heterogeneity. LIDAR is another method that has special utility in a heterogeneous wetland environment, because it provides an integrated value for ET from a surface. The main drawback of LIDAR is the high cost of equipment and the need for an independent ET measure to assess accuracy. If Rn and G are measured accurately, the Priestley-Taylor equation can be used successfully with site-specific calibration factors to estimate wetland ET. The 'crop' cover coefficient (Kc) method can provide accurate wetland ET estimates if calibrated for the environmental and climatic characteristics of a particular area. More complicated equations such as the Penman and Penman-Monteith equations also can be used to estimate wetland ET, but surface variability and lack of information on aerodynamic and surface resistances make use of such equations somewhat questionable. ?? 2004 John Wiley and Sons, Ltd.

Free energy of adhesion of lipid bilayers on silica surfaces

NASA Astrophysics Data System (ADS)

Schneemilch, M.; Quirke, N.

2018-05-01

The free energy of adhesion per unit area (hereafter referred to as the adhesion strength) of lipid arrays on surfaces is a key parameter that determines the nature of the interaction between materials and biological systems. Here we report classical molecular simulations of water and 1,2-dimyristoyl-sn-glycero-3-phosphocholine (DMPC) lipid bilayers at model silica surfaces with a range of silanol densities and structures. We employ a novel technique that enables us to estimate the adhesion strength of supported lipid bilayers in the presence of water. We find that silanols on the silica surface form hydrogen bonds with water molecules and that the water immersion enthalpy for all surfaces varies linearly with the surface density of these hydrogen bonds. The adhesion strength of lipid bilayers is a linear function of the surface density of hydrogen bonds formed between silanols and the lipid molecules on crystalline surfaces. Approximately 20% of isolated silanols form such bonds but more than 99% of mutually interacting geminal silanols do not engage in hydrogen bonding with water. On amorphous silica, the bilayer displays much stronger adhesion than expected from the crystalline surface data. We discuss the implications of these results for nanoparticle toxicity.

Improving Evapotranspiration Estimates Using Multi-Platform Remote Sensing

NASA Astrophysics Data System (ADS)

Knipper, Kyle; Hogue, Terri; Franz, Kristie; Scott, Russell

2016-04-01

Understanding the linkages between energy and water cycles through evapotranspiration (ET) is uniquely challenging given its dependence on a range of climatological parameters and surface/atmospheric heterogeneity. A number of methods have been developed to estimate ET either from primarily remote-sensing observations, in-situ measurements, or a combination of the two. However, the scale of many of these methods may be too large to provide needed information about the spatial and temporal variability of ET that can occur over regions with acute or chronic land cover change and precipitation driven fluxes. The current study aims to improve the spatial and temporal variability of ET utilizing only satellite-based observations by incorporating a potential evapotranspiration (PET) methodology with satellite-based down-scaled soil moisture estimates in southern Arizona, USA. Initially, soil moisture estimates from AMSR2 and SMOS are downscaled to 1km through a triangular relationship between MODIS land surface temperature (MYD11A1), vegetation indices (MOD13Q1/MYD13Q1), and brightness temperature. Downscaled soil moisture values are then used to scale PET to actual ET (AET) at a daily, 1km resolution. Derived AET estimates are compared to observed flux tower estimates, the North American Land Data Assimilation System (NLDAS) model output (i.e. Variable Infiltration Capacity (VIC) Macroscale Hydrologic Model, Mosiac Model, and Noah Model simulations), the Operational Simplified Surface Energy Balance Model (SSEBop), and a calibrated empirical ET model created specifically for the region. Preliminary results indicate a strong increase in correlation when incorporating the downscaling technique to original AMSR2 and SMOS soil moisture values, with the added benefit of being able to decipher small scale heterogeneity in soil moisture (riparian versus desert grassland). AET results show strong correlations with relatively low error and bias when compared to flux tower estimates. In addition, AET results show improved bias to those reported by SSEBop, with similar correlations and errors when compared to the empirical ET model. Spatial patterns of estimated AET display patterns representative of the basin's elevation and vegetation characteristics, with improved spatial resolution and temporal heterogeneity when compared to previous models.

Urban Surface Radiative Energy Budgets Determined Using Aircraft Scanner Data

NASA Technical Reports Server (NTRS)

Luvall, Jeffrey C.; Quattrochi, Dale A.; Rickman, Doug L.; Estes, Maury G.; Arnold, James E. (Technical Monitor)

2002-01-01

It is estimated that by the year 2025, 80% of the world's population will live in cities. The extent of these urban areas across the world can be seen in an image of city lights from the Defense Meteorological Satellite Program. In many areas of North America and Europe, it is difficult to separate individual cities because of the dramatic growth and sprawl of urbanized areas. This conversion of the natural landscape vegetation into man-made urban structures such as roads and buildings drastically alter the regional surface energy budgets, hydrology, precipitation patterns, and meteorology. One of the earliest recognized and measured phenomena of urbanization is the urban heat island (UHI) which was reported as early as 1833 for London and 1862 for Paris. The urban heat island results from the energy that is absorbed by man-made materials during the day and is released at night resulting in the heating of the air within the urban area. The magnitude of the air temperature difference between the urban and surrounding countryside is highly dependent on the structure of the urban area, amount of solar immolation received during the day, and atmospheric conditions during the night. These night time air temperature differences can be in the range of 2 to 5 C. or greater. Although day time air temperature differences between urban areas and the countryside exists during the day, atmospheric mixing and stability reduce the magnitude. This phenomena is not limited to large urban areas, but also occurs in smaller metropolitan areas. The UHI has significant impacts on the urban air quality, meteorology, energy use, and human health. The UPI can be mitigated through increasing the amount of vegetation and modification of urban surfaces using high albedo materials for roofs and paved surfaces. To understand why the urban heat island phenomenon exists it is useful to define the surface in terms of the surface energy budget. Surface temperature and albedo is a major component of the surface energy budget. Knowledge of it is important in any attempt to describe the radiative and mass fluxes which occur at the surface. Use of energy terms in modeling surface energy budgets allows the direct comparison of various land surfaces encountered in a urban landscape, from vegetated (forest and herbaceous) to non-vegetated (bare soil, roads, and buildings). These terms are also easily measured using remote sensing from aircraft or satellite platforms allowing one to examine the spacial variability. The partitioning of energy budget terms depends on the surface type. In natural landscapes, the partitioning is dependent on canopy biomass, leaf area index, aerodynamic roughness, and moisture status, all of which are influenced by the development stage of the ecosystem. In urban landscapes, coverage by man-made materials substantially alters the surface face energy budget. The remotely sensed data obtained from aircraft and satellites, when properly calibrated allows the measurement of important terms in the radiative surface energy budget a urban landscape scale.

Magnetospheric ion sputtering and water ice grain size at Europa

NASA Astrophysics Data System (ADS)

Cassidy, T. A.; Paranicas, C. P.; Shirley, J. H.; Dalton, J. B., III; Teolis, B. D.; Johnson, R. E.; Kamp, L.; Hendrix, A. R.

2013-03-01

We present the first calculation of Europa's sputtering (ion erosion) rate as a function of position on Europa's surface. We find a global sputtering rate of 2×1027 H2O s-1, some of which leaves the surface in the form of O2 and H2. The calculated O2 production rate is 1×1026 O2 s-1, H2 production is twice that value. The total sputtering rate (including all species) peaks at the trailing hemisphere apex and decreases to about 1/3rd of the peak value at the leading hemisphere apex. O2 and H2 sputtering, by contrast, is confined almost entirely to the trailing hemisphere. Most sputtering is done by energetic sulfur ions (100s of keV to MeV), but most of the O2 and H2 production is done by cold oxygen ions (temperature ∼ 100 eV, total energy ∼ 500 eV). As a part of the sputtering rate calculation we compared experimental sputtering yields with analytic estimates. We found that the experimental data are well approximated by the expressions of Famá et al. for ions with energies less than 100 keV (Famá, M., Shi, J., Baragiola, R.A., 2008. Sputtering of ice by low-energy ions. Surf. Sci. 602, 156-161), while the expressions from Johnson et al. fit the data best at higher energies (Johnson, R.E., Burger, M.H., Cassidy, T.A., Leblanc, F., Marconi, M., Smyth, W.H., 2009. Composition and Detection of Europa's Sputter-Induced Atmosphere, in: Pappalardo, R.T., McKinnon, W.B., Khurana, K.K. (Eds.), Europa. University of Arizona Press, Tucson.). We compare the calculated sputtering rate with estimates of water ice regolith grain size as estimated from Galileo Near-Infrared Mapping Spectrometer (NIMS) data, and find that they are strongly correlated as previously suggested by Clark et al. (Clark, R.N., Fanale, F.P., Zent, A.P., 1983. Frost grain size metamorphism: Implications for remote sensing of planetary surfaces. Icarus 56, 233-245.). The mechanism responsible for the sputtering rate/grain size link is uncertain. We also report a surface composition estimate using NIMS data from an area on the trailing hemisphere apex. We find a high abundance of sulfuric acid hydrate and radiation-resistant hydrated salts along with large water ice regolith grains, all of which are consistent with the high levels of magnetospheric bombardment at the trailing apex.

Impact of fire on global land surface air temperature and energy budget for the 20th century due to changes within ecosystems

NASA Astrophysics Data System (ADS)

Li, Fang; Lawrence, David M.; Bond-Lamberty, Ben

2017-04-01

Fire is a global phenomenon and tightly interacts with the biosphere and climate. This study provides the first quantitative assessment and understanding of fire’s influence on the global annual land surface air temperature and energy budget through its impact on terrestrial ecosystems. Fire impacts are quantified by comparing fire-on and fire-off simulations with the Community Earth System Model (CESM). Results show that, for the 20th century average, fire-induced changes in terrestrial ecosystems significantly increase global land annual mean surface air temperature by 0.18 °C, decrease surface net radiation and latent heat flux by 1.08 W m-2 and 0.99 W m-2, respectively, and have limited influence on sensible heat flux (-0.11 W m-2) and ground heat flux (+0.02 W m-2). Fire impacts are most clearly seen in the tropical savannas. Our analyses suggest that fire increases surface air temperature predominantly by reducing latent heat flux, mainly due to fire-induced damage to the vegetation canopy, and decreases net radiation primarily because fire-induced surface warming significantly increases upward surface longwave radiation. This study provides an integrated estimate of fire and induced changes in ecosystems, climate, and energy budget at a global scale, and emphasizes the importance of a consistent and integrated understanding of fire effects.

Estimation of critical thickness of Stranski-Krastanow transition in GeSi/Sn/Si system

NASA Astrophysics Data System (ADS)

Lozovoy, K. A.; Pishchagin, A. A.; Kokhanenko, A. P.; Voitsekhovskii, A. V.

2017-11-01

In this paper Stranski-Krastanow growth of Ge x Si1-x epitaxial layers on the Si(001) surface with pre-deposited tin layer with the thickness less than 1 ML is considered. For the calculations of critical thickness of transition from 2D to 3D growth in this paper a theoretical model based on general nucleation theory is used. This model is specified by taking into account dependencies of elastic modulus, lattices mismatch and surface energy of side facet on the composition x, as well as change in the adatoms diffusion coefficient and surface energy of the substrate in the presence of tin. As a result, dependencies of critical thickness of Stranski-Krastanow transition on compositon x and temperature are obtained. The simulated results are in a good agreement with experimentally observed results.

An Improved Approach for Estimating Daily Net Radiation over the Heihe River Basin

PubMed Central

Wu, Bingfang; Liu, Shufu; Zhu, Weiwei; Yan, Nana; Xing, Qiang; Tan, Shen

2017-01-01

Net radiation plays an essential role in determining the thermal conditions of the Earth’s surface and is an important parameter for the study of land-surface processes and global climate change. In this paper, an improved satellite-based approach to estimate the daily net radiation is presented, in which sunshine duration were derived from the geostationary meteorological satellite (FY-2D) cloud classification product, the monthly empirical as and bs Angstrom coefficients for net shortwave radiation were calibrated by spatial fitting of the ground data from 1997 to 2006, and the daily net longwave radiation was calibrated with ground data from 2007 to 2010 over the Heihe River Basin in China. The estimated daily net radiation values were validated against ground data for 12 months in 2008 at four stations with different underlying surface types. The average coefficient of determination (R2) was 0.8489, and the averaged Nash-Sutcliffe equation (NSE) was 0.8356. The close agreement between the estimated daily net radiation and observations indicates that the proposed method is promising, especially given the comparison between the spatial distribution and the interpolation of sunshine duration. Potential applications include climate research, energy balance studies and the estimation of global evapotranspiration. PMID:28054976

An Improved Approach for Estimating Daily Net Radiation over the Heihe River Basin.

PubMed

Wu, Bingfang; Liu, Shufu; Zhu, Weiwei; Yan, Nana; Xing, Qiang; Tan, Shen

2017-01-04

Net radiation plays an essential role in determining the thermal conditions of the Earth's surface and is an important parameter for the study of land-surface processes and global climate change. In this paper, an improved satellite-based approach to estimate the daily net radiation is presented, in which sunshine duration were derived from the geostationary meteorological satellite (FY-2D) cloud classification product, the monthly empirical a s and b s Angstrom coefficients for net shortwave radiation were calibrated by spatial fitting of the ground data from 1997 to 2006, and the daily net longwave radiation was calibrated with ground data from 2007 to 2010 over the Heihe River Basin in China. The estimated daily net radiation values were validated against ground data for 12 months in 2008 at four stations with different underlying surface types. The average coefficient of determination ( R ²) was 0.8489, and the averaged Nash-Sutcliffe equation ( NSE ) was 0.8356. The close agreement between the estimated daily net radiation and observations indicates that the proposed method is promising, especially given the comparison between the spatial distribution and the interpolation of sunshine duration. Potential applications include climate research, energy balance studies and the estimation of global evapotranspiration.

mBEEF-vdW: Robust fitting of error estimation density functionals

NASA Astrophysics Data System (ADS)

Lundgaard, Keld T.; Wellendorff, Jess; Voss, Johannes; Jacobsen, Karsten W.; Bligaard, Thomas

2016-06-01

We propose a general-purpose semilocal/nonlocal exchange-correlation functional approximation, named mBEEF-vdW. The exchange is a meta generalized gradient approximation, and the correlation is a semilocal and nonlocal mixture, with the Rutgers-Chalmers approximation for van der Waals (vdW) forces. The functional is fitted within the Bayesian error estimation functional (BEEF) framework [J. Wellendorff et al., Phys. Rev. B 85, 235149 (2012), 10.1103/PhysRevB.85.235149; J. Wellendorff et al., J. Chem. Phys. 140, 144107 (2014), 10.1063/1.4870397]. We improve the previously used fitting procedures by introducing a robust MM-estimator based loss function, reducing the sensitivity to outliers in the datasets. To more reliably determine the optimal model complexity, we furthermore introduce a generalization of the bootstrap 0.632 estimator with hierarchical bootstrap sampling and geometric mean estimator over the training datasets. Using this estimator, we show that the robust loss function leads to a 10 % improvement in the estimated prediction error over the previously used least-squares loss function. The mBEEF-vdW functional is benchmarked against popular density functional approximations over a wide range of datasets relevant for heterogeneous catalysis, including datasets that were not used for its training. Overall, we find that mBEEF-vdW has a higher general accuracy than competing popular functionals, and it is one of the best performing functionals on chemisorption systems, surface energies, lattice constants, and dispersion. We also show the potential-energy curve of graphene on the nickel(111) surface, where mBEEF-vdW matches the experimental binding length. mBEEF-vdW is currently available in gpaw and other density functional theory codes through Libxc, version 3.0.0.

Impact of atmospheric effects on the energy reconstruction of air showers observed by the surface detectors of the Pierre Auger Observatory

DOE PAGES

Aab, A.; Abreu, P.; Aglietta, M.; ...

2017-02-07

Atmospheric conditions, such as the pressure (P), temperature (T) or air density (more » $$\\rho \\propto P/T$$), affect the development of extended air showers initiated by energetic cosmic rays. We study the impact of the atmospheric variations on the reconstruction of air showers with data from the arrays of surface detectors of the Pierre Auger Observatory, considering separately the one with detector spacings of 1500 m and the one with 750 m spacing. We observe modulations in the event rates that are due to the influence of the air density and pressure variations on the measured signals, from which the energy estimators are obtained. Lastly, we show how the energy assignment can be corrected to account for such atmospheric effects.« less

Ensemble Monte Carlo particle investigation of hot electron induced source-drain burnout characteristics of GaAs field-effect transistors

NASA Astrophysics Data System (ADS)

Moglestue, C.; Buot, F. A.; Anderson, W. T.

1995-08-01

The lattice heating rate has been calculated for GaAs field-effect transistors of different source-drain channel design by means of the ensemble Monte Carlo particle model. Transport of carriers in the substrate and the presence of free surface charges are also included in our simulation. The actual heat generation was obtained by accounting for the energy exchanged with the lattice of the semiconductor during phonon scattering. It was found that the maximum heating rate takes place below the surface near the drain end of the gate. The results correlate well with a previous hydrodynamic energy transport estimate of the electronic energy density, but shifted slightly more towards the drain. These results further emphasize the adverse effects of hot electrons on the Ohmic contacts.

Impact of atmospheric effects on the energy reconstruction of air showers observed by the surface detectors of the Pierre Auger Observatory

DOE Office of Scientific and Technical Information (OSTI.GOV)

Aab, A.; Abreu, P.; Aglietta, M.

Atmospheric conditions, such as the pressure (P), temperature (T) or air density (more » $$\\rho \\propto P/T$$), affect the development of extended air showers initiated by energetic cosmic rays. We study the impact of the atmospheric variations on the reconstruction of air showers with data from the arrays of surface detectors of the Pierre Auger Observatory, considering separately the one with detector spacings of 1500 m and the one with 750 m spacing. We observe modulations in the event rates that are due to the influence of the air density and pressure variations on the measured signals, from which the energy estimators are obtained. Lastly, we show how the energy assignment can be corrected to account for such atmospheric effects.« less

Atomic and molecular adsorption on Fe(110)

DOE PAGES

Xu, Lang; Kirvassilis, Demetrios; Bai, Yunhai; ...

2017-09-12

Iron is the principal catalyst for the ammonia synthesis process and the Fischer–Tropsch process, as well as many other heterogeneously catalyzed reactions. It is thus of fundamental importance to understand the interactions between the iron surface and various reaction intermediates. Here in this paper, we present a systematic study of atomic and molecular adsorption behavior over Fe(110) using periodic, self-consistent density functional theory (DFT-GGA) calculations. The preferred binding sites, binding energies, and the corresponding surface deformation energies of five atomic species (H, C, N, O, and S), six molecular species (NH 3, CH 4, N 2, CO, HCN, and NO),more » and eleven molecular fragments (CH, CH 2, CH 3, NH, NH 2, OH, CN, COH, HCO, NOH, and HNO) were determined on the Fe(110) surface at a coverage of 0.25 monolayer. The binding strengths calculated using the PW91 functional decreased in the following order: C> CH > N > O > S > NH > COH > CN > CH2 > NOH > OH > HNO > HCO > NH2 > H > NO > HCN > CH 3 > CO > N 2 > NH 3. No stable binding structures were observed for CH 4. The estimated diffusion barriers and pathways, as well as the adsorbate-surface and intramolecular vibrational modes of all the adsorbates at their preferred binding sites, were identified. Using the calculated adsorption energetics, we constructed the potential energy surfaces for a few surface reactions including the decomposition of methane, ammonia, dinitrogen, carbon monoxide, and nitric oxide. These potential energy surfaces provide valuable insight into the ability of Fe(110) to catalyze common elementary steps.« less

Surface spectral emissivity derived from MODIS data

NASA Astrophysics Data System (ADS)

Chen, Yan; Sun-Mack, Sunny; Minnis, Patrick; Smith, William L.; Young, David F.

2003-04-01

Surface emissivity is essential for many remote sensing applications including the retrieval of the surface skin temperature from satellite-based infrared measurements, determining thresholds for cloud detection and for estimating the emission of longwave radiation from the surface, an important component of the energy budget of the surface-atmosphere interface. In this paper, data from the Terra MODIS (MODerate-resolution Imaging Spectroradiometer) taken at 3.7, 8.5, 10.8, 12.0 micron are used to simultaneously derive the skin temperature and the surface emissivities at the same wavelengths. The methodology uses separate measurements of the clear-sky temperatures that are determined by the CERES (Clouds and Earth's Radiant Energy System) scene classification in each channel during the daytime and at night. The relationships between the various channels at night are used during the day when solar reflectance affects the 3.7 micron data. A set of simultaneous equations is then solved to derive the emissivities. Global results are derived from MODIS. Numerical weather analyses are used to provide soundings for correcting the observed radiances for atmospheric absorption. These results are verified and will be available for remote sensing applications.

Renewable energy rebound effect?: Estimating the impact of state renewable energy financial incentives on residential electricity consumption

NASA Astrophysics Data System (ADS)

Stephenson, Beth A.

Climate change is a well-documented phenomenon. If left unchecked greenhouse gas emissions will continue global surface warming, likely leading to severe and irreversible impacts. Generating renewable energy has become an increasingly salient topic in energy policy as it may mitigate the impact of climate change. State renewable energy financial incentives have been in place since the mid-1970s in some states and over 40 states have adopted one or more incentives at some point since then. Using multivariate linear and fixed effects regression for the years 2002 through 2012, I estimate the relationship between state renewable energy financial incentives and residential electricity consumption, along with the associated policy implications. My hypothesis is that a renewable energy rebound effect is present; therefore, states with renewable energy financial incentives have a higher rate of residential electricity consumption. I find a renewable energy rebound effect is present in varying degrees for each model, but the results do not definitively indicate how particular incentives influence consumer behavior. States should use caution when adopting and keeping renewable energy financial incentives as this may increase consumption in the short-term. The long-term impact is unclear, making it worthwhile for policymakers to continue studying the potential for renewable energy financial incentives to alter consumer behavior.

Estimation of height-dependent solar irradiation and application to the solar climate of Iran

DOE Office of Scientific and Technical Information (OSTI.GOV)

Samimi, J.

1994-05-01

An explicitly height-dependent model has been used to estimate the solar irradiation over Iran which has a vast range of altitudes. The parameters of the model have been chosen on general grounds and not by parameters best fitting to any of the available measured irradiation data in Iran. The estimated global solar irradiation on the horizontal surface shows a very good agreement (4.1% deviation) with the 17-year long pyranometric measurements in Tehran, and also, is in good agreement with other, shorter available measured data. The entire data base of the Iranian meteorological stations have been used to establish a simplemore » relation between the sunshine duration records and the cloud cover reports which can be utilized in solar energy estimations for sites with no sunshine duration recorders. Clear sky maps of Iran for direct solar irradiation on tracking, horizontal, and south-facing vertical planes are presented. The global solar irradiation map for horizontal surface with cloudiness is zoned into four irradiation zones. In about four-fifths of the land in Iran, the annual-mean daily global solar irradiation on horizontal surface ranges from 4.5 to 5.4 kWh/m[sup 2].« less

Moderate pressure plasma source of nonthermal electrons

NASA Astrophysics Data System (ADS)

Gershman, S.; Raitses, Y.

2018-06-01

Plasma sources of electrons offer control of gas and surface chemistry without the need for complex vacuum systems. The plasma electron source presented here is based on a cold cathode glow discharge (GD) operating in a dc steady state mode in a moderate pressure range of 2–10 torr. Ion-induced secondary electron emission is the source of electrons accelerated to high energies in the cathode sheath potential. The source geometry is a key to the availability and the extraction of the nonthermal portion of the electron population. The source consists of a flat and a cylindrical electrode, 1 mm apart. Our estimates show that the length of the cathode sheath in the plasma source is commensurate (~0.5–1 mm) with the inter-electrode distance so the GD operates in an obstructed regime without a positive column. Estimations of the electron energy relaxation confirm the non-local nature of this GD, hence the nonthermal portion of the electron population is available for extraction outside of the source. The use of a cylindrical anode presents a simple and promising method of extracting the high energy portion of the electron population. Langmuir probe measurements and optical emission spectroscopy confirm the presence of electrons with energies ~15 eV outside of the source. These electrons become available for surface modification and radical production outside of the source. The extraction of the electrons of specific energies by varying the anode geometry opens exciting opportunities for future exploration.

Surfacers change their dive tactics depending on the aim of the dive: evidence from simultaneous measurements of breaths and energy expenditure

PubMed Central

Okuyama, Junichi; Tabata, Runa; Nakajima, Kana; Arai, Nobuaki; Kobayashi, Masato; Kagawa, Shiro

2014-01-01

Air-breathing divers are assumed to have evolved to apportion their time between surface and underwater periods to maximize the benefit gained from diving activities. However, whether they change their time allocation depending on the aim of the dive is still unknown. This may be particularly crucial for ‘surfacers’ because they dive for various purposes in addition to foraging. In this study, we counted breath events at the surface and estimated oxygen consumption during resting, foraging and other dives in 11 green turtles (Chelonia mydas) in the wild. Breath events were counted by a head-mounted acceleration logger or direct observation based on an animal-borne video logger, and oxygen consumption was estimated by measuring overall dynamic body acceleration. Our results indicate that green turtles maximized their submerged time, following this with five to seven breaths to replenish oxygen for resting dives. However, they changed their dive tactic during foraging and other dives; they surfaced without depleting their estimated stores of oxygen, followed by only a few breaths for effective foraging and locomotion. These dichotomous surfacing tactics would be the result of behavioural modifications by turtles depending on the aim of each dive. PMID:25297856

Molecular dynamics analysis of a equilibrium nanoscale droplet on a solid surface with periodic roughness

NASA Astrophysics Data System (ADS)

Furuta, Yuma; Surblys, Donatas; Yamaguchi, Yastaka

2016-11-01

Molecular dynamics simulations of the equilibrium wetting behavior of hemi-cylindrical argon droplets on solid surfaces with a periodic roughness were carried out. The rough solid surface is located at the bottom of the calculation cell with periodic boundary conditions in surface lateral directions and mirror boundary condition at the top boundary. Similar to on a smooth surface, the change of the cosine of the droplet contact angle was linearly correlated to the potential well depth of the inter-atomic interaction between liquid and solid on a surface with a short roughness period while the correlation was deviated on one with a long roughness period. To further investigate this feature, solid-liquid, solid-vapor interfacial free energies per unit projected area of solid surface were evaluated by using the thermodynamic integration method in independent quasi-one-dimensional simulation systems with a liquid-solid interface or vapor-solid interface on various rough solid surfaces at a constant pressure. The cosine of the apparent contact angles estimated from the density profile of the droplet systems corresponded well with ones calculated from Young's equation using the interfacial energies evaluated in the quasi-one dimensional systems.

Hierarchical Coupling of First-Principles Molecular Dynamics with Advanced Sampling Methods.

PubMed

Sevgen, Emre; Giberti, Federico; Sidky, Hythem; Whitmer, Jonathan K; Galli, Giulia; Gygi, Francois; de Pablo, Juan J

2018-05-14

We present a seamless coupling of a suite of codes designed to perform advanced sampling simulations, with a first-principles molecular dynamics (MD) engine. As an illustrative example, we discuss results for the free energy and potential surfaces of the alanine dipeptide obtained using both local and hybrid density functionals (DFT), and we compare them with those of a widely used classical force field, Amber99sb. In our calculations, the efficiency of first-principles MD using hybrid functionals is augmented by hierarchical sampling, where hybrid free energy calculations are initiated using estimates obtained with local functionals. We find that the free energy surfaces obtained from classical and first-principles calculations differ. Compared to DFT results, the classical force field overestimates the internal energy contribution of high free energy states, and it underestimates the entropic contribution along the entire free energy profile. Using the string method, we illustrate how these differences lead to different transition pathways connecting the metastable minima of the alanine dipeptide. In larger peptides, those differences would lead to qualitatively different results for the equilibrium structure and conformation of these molecules.

Preliminary Analysis of a Submerged Wave Energy Device

NASA Astrophysics Data System (ADS)

Wagner, J. R.; Wagner, J. J.; Hayatdavoodi, M.; Ertekin, R. C.

2016-02-01

Preliminary analysis of a submerged wave energy harvesting device is presented. The device is composed of a thin, horizontally submerged plate that is restricted to heave oscillations under the influence of surface waves. The submerged plate is oscillating, and it can be attached to a fixed rotor, or a piston, to harvest the wave energy. A fully submerged wave energy converter is preferred over a surface energy convertor due to its durability and less visual and physical distractions it presents. In this study, the device is subject to nonlinear shallow-water waves. Wave loads on the submerged oscillating plate are obtained via the Level I Green-Naghdi equations. The unsteady motion of the plate is obtained by solving the nonlinear equations of motion. The results are obtained for a range of waves with varying heights and periods. The amplitude and period of plate oscillations are analyzed as functions of the wave parameters and plate width. Particular attention is given to the selection of the site of desired wave field. Initial estimation on the amount of energy extraction from the device, located near shore at a given site, is provided.

Effects of vegetation types on soil moisture estimation from the normalized land surface temperature versus vegetation index space

NASA Astrophysics Data System (ADS)

Zhang, Dianjun; Zhou, Guoqing

2015-12-01

Soil moisture (SM) is a key variable that has been widely used in many environmental studies. Land surface temperature versus vegetation index (LST-VI) space becomes a common way to estimate SM in optical remote sensing applications. Normalized LST-VI space is established by the normalized LST and VI to obtain the comparable SM in Zhang et al. (Validation of a practical normalized soil moisture model with in situ measurements in humid and semiarid regions [J]. International Journal of Remote Sensing, DOI: 10.1080/01431161.2015.1055610). The boundary conditions in the study were set to limit the point A (the driest bare soil) and B (the wettest bare soil) for surface energy closure. However, no limitation was installed for point D (the full vegetation cover). In this paper, many vegetation types are simulated by the land surface model - Noah LSM 3.2 to analyze the effects on soil moisture estimation, such as crop, grass and mixed forest. The locations of point D are changed with vegetation types. The normalized LST of point D for forest is much lower than crop and grass. The location of point D is basically unchanged for crop and grass.

A revised surface resistance parameterisation for estimating latent heat flux from remotely sensed data

NASA Astrophysics Data System (ADS)

Song, Yi; Wang, Jiemin; Yang, Kun; Ma, Mingguo; Li, Xin; Zhang, Zhihui; Wang, Xufeng

2012-07-01

Estimating evapotranspiration (ET) is required for many environmental studies. Remote sensing provides the ability to spatially map latent heat flux. Many studies have developed approaches to derive spatially distributed surface energy fluxes from various satellite sensors with the help of field observations. In this study, remote-sensing-based λE mapping was conducted using a Landsat Thematic Mapper (TM) image and an Enhanced Thematic Mapper Plus (ETM+) image. The remotely sensed data and field observations employed in this study were obtained from Watershed Allied Telemetry Experimental Research (WATER). A biophysics-based surface resistance model was revised to account for water stress and temperature constraints. The precision of the results was validated using 'ground truth' data obtained by eddy covariance (EC) system. Scale effects play an important role, especially for parameter optimisation and validation of the latent heat flux (λE). After considering the footprint of EC, the λE derived from the remote sensing data was comparable to the EC measured value during the satellite's passage. The results showed that the revised surface resistance parameterisation scheme was useful for estimating the latent heat flux over cropland in arid regions.

Reaction and relaxation at surface hotspots: using molecular dynamics and the energy-grained master equation to describe diamond etching.

PubMed

Glowacki, David R; Rodgers, W J; Shannon, Robin; Robertson, Struan H; Harvey, Jeremy N

2017-04-28

The extent to which vibrational energy transfer dynamics can impact reaction outcomes beyond the gas phase remains an active research question. Molecular dynamics (MD) simulations are the method of choice for investigating such questions; however, they can be extremely expensive, and therefore it is worth developing cheaper models that are capable of furnishing reasonable results. This paper has two primary aims. First, we investigate the competition between energy relaxation and reaction at 'hotspots' that form on the surface of diamond during the chemical vapour deposition process. To explore this, we developed an efficient reactive potential energy surface by fitting an empirical valence bond model to higher-level ab initio electronic structure theory. We then ran 160 000 NVE trajectories on a large slab of diamond, and the results are in reasonable agreement with experiment: they suggest that energy dissipation from surface hotspots is complete within a few hundred femtoseconds, but that a small fraction of CH 3 does in fact undergo dissociation prior to the onset of thermal equilibrium. Second, we developed and tested a general procedure to formulate and solve the energy-grained master equation (EGME) for surface chemistry problems. The procedure we outline splits the diamond slab into system and bath components, and then evaluates microcanonical transition-state theory rate coefficients in the configuration space of the system atoms. Energy transfer from the system to the bath is estimated using linear response theory from a single long MD trajectory, and used to parametrize an energy transfer function which can be input into the EGME. Despite the number of approximations involved, the surface EGME results are in reasonable agreement with the NVE MD simulations, but considerably cheaper. The results are encouraging, because they offer a computationally tractable strategy for investigating non-equilibrium reaction dynamics at surfaces for a broader range of systems.This article is part of the themed issue 'Theoretical and computational studies of non-equilibrium and non-statistical dynamics in the gas phase, in the condensed phase and at interfaces'. © 2017 The Authors.

Reaction and relaxation at surface hotspots: using molecular dynamics and the energy-grained master equation to describe diamond etching

PubMed Central

Rodgers, W. J.; Shannon, Robin; Robertson, Struan H.; Harvey, Jeremy N.

2017-01-01

The extent to which vibrational energy transfer dynamics can impact reaction outcomes beyond the gas phase remains an active research question. Molecular dynamics (MD) simulations are the method of choice for investigating such questions; however, they can be extremely expensive, and therefore it is worth developing cheaper models that are capable of furnishing reasonable results. This paper has two primary aims. First, we investigate the competition between energy relaxation and reaction at ‘hotspots’ that form on the surface of diamond during the chemical vapour deposition process. To explore this, we developed an efficient reactive potential energy surface by fitting an empirical valence bond model to higher-level ab initio electronic structure theory. We then ran 160 000 NVE trajectories on a large slab of diamond, and the results are in reasonable agreement with experiment: they suggest that energy dissipation from surface hotspots is complete within a few hundred femtoseconds, but that a small fraction of CH3 does in fact undergo dissociation prior to the onset of thermal equilibrium. Second, we developed and tested a general procedure to formulate and solve the energy-grained master equation (EGME) for surface chemistry problems. The procedure we outline splits the diamond slab into system and bath components, and then evaluates microcanonical transition-state theory rate coefficients in the configuration space of the system atoms. Energy transfer from the system to the bath is estimated using linear response theory from a single long MD trajectory, and used to parametrize an energy transfer function which can be input into the EGME. Despite the number of approximations involved, the surface EGME results are in reasonable agreement with the NVE MD simulations, but considerably cheaper. The results are encouraging, because they offer a computationally tractable strategy for investigating non-equilibrium reaction dynamics at surfaces for a broader range of systems. This article is part of the themed issue ‘Theoretical and computational studies of non-equilibrium and non-statistical dynamics in the gas phase, in the condensed phase and at interfaces’. PMID:28320908

Soil moisture and properties estimation by assimilating soil temperatures using particle batch smoother: A new perspective for DTS

NASA Astrophysics Data System (ADS)

Dong, J.; Steele-Dunne, S. C.; Ochsner, T. E.; Van De Giesen, N.

2015-12-01

Soil moisture, hydraulic and thermal properties are critical for understanding the soil surface energy balance and hydrological processes. Here, we will discuss the potential of using soil temperature observations from Distributed Temperature Sensing (DTS) to investigate the spatial variability of soil moisture and soil properties. With DTS soil temperature can be measured with high resolution (spatial <1m, and temporal < 1min) in cables up to kilometers in length. Soil temperature evolution is primarily controlled by the soil thermal properties, and the energy balance at the soil surface. Hence, soil moisture, which affects both soil thermal properties and the energy that participates the evaporation process, is strongly correlated to the soil temperatures. In addition, the dynamics of the soil moisture is determined by the soil hydraulic properties.Here we will demonstrate that soil moisture, hydraulic and thermal properties can be estimated by assimilating observed soil temperature at shallow depths using the Particle Batch Smoother (PBS). The PBS can be considered as an extension of the particle filter, which allows us to infer soil moisture and soil properties using the dynamics of soil temperature within a batch window. Both synthetic and real field data will be used to demonstrate the robustness of this approach. We will show that the proposed method is shown to be able to handle different sources of uncertainties, which may provide a new view of using DTS observations to estimate sub-meter resolution soil moisture and properties for remote sensing product validation.

A reexamination of the emergy input to a system from the wind ...

EPA Pesticide Factsheets

With the establishment of a new, rigorously-determined, solar equivalence baseline for the geobiosphere, 12.0E+24 seJ y-1, it is now appropriate to reexamine the calculation of the emergy delivered by the major secondary products of the geobiosphere, e.g., wind and rainfall, which are derived from the transformation of the solar equivalent joules supplied through the baseline. In this study, the methods for calculating the available energy of the wind dissipated in the planetary boundary layer are revisited and further elucidated. Particular consideration is given to the method used to estimate the geostrophic and gradient wind from measurements of surface wind and to the role of the drag coefficient in determining the available wind energy dissipated in the boundary layer (900 to 1000 mb or the lower 1000 m of the atmosphere) as it passes over various surfaces. In addition, we made a more rigorous estimate of the transformity of the available wind energy dissipated in the planetary boundary layer based on a synthesis of the results from three evaluations of a model of the general circulation of the atmosphere. The rounded estimate of the transformity of the wind from these combined studies was 1230 sej J-1. We consider the variability of the transformity of the wind dissipated in the boundary layer between summer and winter and between the Northern and Southern hemispheres. We conclude that the properties of the system and its spatial and temporal boundarie