Science.gov

Sample records for design parameter calculations

  1. Calculation of Design Parameters for an Equilibrium LEU Core in the NBSR

    SciTech Connect

    Hanson, A.L.; Diamond, D.

    2011-09-30

    A plan is being developed for the conversion of the NIST research reactor (NBSR) from high-enriched uranium (HEU) fuel to low-enriched uranium (LEU) fuel. Previously, the design of the LEU fuel had been determined in order to provide the users of the NBSR with the same cycle length as exists for the current HEU fueled reactor. The fuel composition at different points within an equilibrium fuel cycle had also been determined. In the present study, neutronics parameters have been calculated for these times in the fuel cycle for both the existing HEU and the proposed LEU equilibrium cores. The results showed differences between the HEU and LEU cores that would not lead to any significant changes in the safety analysis for the converted core. In general the changes were reasonable except that the figure-of-merit for neutrons that can be used by experimentalists shows there will be a 10% reduction in performance. The calculations included kinetics parameters, reactivity coefficients, reactivity worths of control elements and abnormal configurations, and power distributions.

  2. Loss parameter calculations

    SciTech Connect

    Cook, J.M.

    1995-07-01

    Sands and Rees propose an electronic bench measurement of the impulse energy loss of a stored particle bunch to vacuum-chamber components. The components act as the outer conductor of a coaxial line with a thin wire as center conductor. Short pulses are then transmitted through this coaxial system to simulate relativistic particle bunches. Their proposal has since been implemented by several investigators and has become a well-known technique. They derive a first-order approximation to the loss parameter {kappa} for use in these measurements. The purpose of this note is to point out that exact expression for {kappa} is as simple as its first-order approximation and to recommend its use even when {kappa} is small.

  3. The influence of dynamic chamber design and operating parameters on calculated surface-to-air mercury fluxes

    NASA Astrophysics Data System (ADS)

    Eckley, C. S.; Gustin, M.; Lin, C.-J.; Li, X.; Miller, M. B.

    2010-01-01

    Dynamic Flux Chambers (DFCs) are commonly applied for the measurement of non-point source mercury (Hg) emissions from a wide range of surfaces. A standard operating protocol and design for DFCs does not exist, and as a result there is a large diversity in methods described in the literature. Because natural and anthropogenic non-point sources are thought to contribute significantly to the atmosphere Hg pool, development of accurate fluxes during field campaigns is essential. The objective of this research was to determine how differences in chamber material, sample port placement, vertical cross sectional area/volume, and flushing flow rate influence the Hg flux from geologic materials. Hg fluxes measured with a Teflon chamber were higher than those obtained using a polycarbonate chamber, with differences related to light transmission and substrate type. Differences in sample port placement (side versus top) did not have an influence on Hg fluxes. When the same flushing flow rate was applied to two chambers of different volumes, higher fluxes were calculated for the chamber with the smaller volume. Conversely, when two chambers with different volumes were maintained at similar turnover times, the larger volume chamber yielded higher Hg fluxes. Overall, the flushing flow rate and associated chamber turnover time had the largest influence on Hg flux relative to the other parameters tested. Results from computational fluid dynamic (CFD) modeling inside a DFC confirm that the smaller diffusion resistance at higher flushing flows contributes to the higher measured flux. These results clearly illustrate that differences in chamber design and operation can significantly influence the resulting calculated Hg flux, and thus impact the comparability of results obtained using DFC designs and/or operating parameters. A protocol for determining a flushing flow rate that results in fluxes less affected by chamber operating conditions and design is proposed. Application of this

  4. Calculation of Design Parameters for an Equilibrium LEU Core in the NBSR using a U7Mo Dispersion Fuel

    SciTech Connect

    Hanson A. L.; Diamond D.

    2014-06-30

    A plan is being developed for the conversion of the NIST research reactor (NBSR) from high-enriched uranium (HEU) fuel to low-enriched uranium (LEU) fuel. The LEU fuel may be a monolithic foil (LEUm) of U10Mo (10% molybdenum by weight in an alloy with uranium) or a dispersion of U7Mo in aluminum (LEUd). A previous report provided neutronic calculations for the LEUm fuel and this report presents the neutronics parameters for the LEUd fuel. The neutronics parameters for the LEUd fuel are compared to those previously obtained for the present HEU fuel and the proposed LEUm fuel. The results show no significant differences between the LEUm and the LEUd other than the LEUd fuel requires slightly less uranium than the LEUm fuel due to less molybdenum being present. The calculations include kinetics parameters, reactivity coefficients, reactivity worths of control elements and abnormal configurations, and power distributions under normal operation and with misloaded fuel elements.

  5. Parameter Plane Design Method

    DTIC Science & Technology

    1989-03-01

    Th usr a toente aninteer a thca sms b esta 1 Fp-ocsing 2. Enter P1 values, lwgt, ldig - > 9 Table I give us proper values. Table 1. PARAMETER TABLE...necessary and identify by block number) In this thesis a control systems analysis package is developed using parameter plane methods. It is an interactive...designer is able to choose values of the parameters which provide a good compromise between cost and dynamic behavior. 20 Distribution Availability of

  6. Geoengineering design parameters workshop

    SciTech Connect

    St. John, C.M. and Associates, Grand Junction, CO ); Kim, Kunsoo . Rockwell Hanford Operations)

    1985-12-12

    A one-day workshop on the subject of the geotechnical design parameters, in situ stress and rock mass strength, for a nuclear waste repository in basalt was held in Rapid City, South Dakota, on June 25, 1989. A panel comprised of five widely recognized experts in the field of rock mechanics, met to discuss the state of stress at the Hanford Site and the strength of a basalt rock mass. This report summarizes the discussions that took place and presents a set of final position statements developed collaboratively by the panel and the workshop moderator. The report concludes with a set of specific recommendations for future actions considered necessary to adequately define the in situ stress and the rock mass strength at the Hanford Site and to document the position of the Basalt Waste Isolation Project in respect to these two critical design parameters.

  7. Design Optimization Programmable Calculators versus Campus Computers.

    ERIC Educational Resources Information Center

    Savage, Michael

    1982-01-01

    A hypothetical design optimization problem and technical information on the three design parameters are presented. Although this nested iteration problem can be solved on a computer (flow diagram provided), this article suggests that several hand held calculators can be used to perform the same design iteration. (SK)

  8. Calculation and Updating of Reliability Parameters in Probabilistic Safety Assessment

    NASA Astrophysics Data System (ADS)

    Zubair, Muhammad; Zhang, Zhijian; Khan, Salah Ud Din

    2011-02-01

    The internal events of nuclear power plant are complex and include equipment maintenance, equipment damage etc. These events will affect the probability of the current risk level of the system as well as the reliability of the equipment parameter values so such kind of events will serve as an important basis for systematic analysis and calculation. This paper presents a method for reliability parameters calculation and their updating. The method is based on binomial likelihood function and its conjugate beta distribution. For update parameters Bayes' theorem has been selected. To implement proposed method a computer base program is designed which provide help to estimate reliability parameters.

  9. Closure and Sealing Design Calculation

    SciTech Connect

    T. Lahnalampi; J. Case

    2005-08-26

    The purpose of the ''Closure and Sealing Design Calculation'' is to illustrate closure and sealing methods for sealing shafts, ramps, and identify boreholes that require sealing in order to limit the potential of water infiltration. In addition, this calculation will provide a description of the magma that can reduce the consequences of an igneous event intersecting the repository. This calculation will also include a listing of the project requirements related to closure and sealing. The scope of this calculation is to: summarize applicable project requirements and codes relating to backfilling nonemplacement openings, removal of uncommitted materials from the subsurface, installation of drip shields, and erecting monuments; compile an inventory of boreholes that are found in the area of the subsurface repository; describe the magma bulkhead feature and location; and include figures for the proposed shaft and ramp seals. The objective of this calculation is to: categorize the boreholes for sealing by depth and proximity to the subsurface repository; develop drawing figures which show the location and geometry for the magma bulkhead; include the shaft seal figures and a proposed construction sequence; and include the ramp seal figure and a proposed construction sequence. The intent of this closure and sealing calculation is to support the License Application by providing a description of the closure and sealing methods for the Safety Analysis Report. The closure and sealing calculation will also provide input for Post Closure Activities by describing the location of the magma bulkhead. This calculation is limited to describing the final configuration of the sealing and backfill systems for the underground area. The methods and procedures used to place the backfill and remove uncommitted materials (such as concrete) from the repository and detailed design of the magma bulkhead will be the subject of separate analyses or calculations. Post-closure monitoring will not

  10. Design Calculations for NIF Convergent Ablator Experiments

    NASA Astrophysics Data System (ADS)

    Olson, R. E.; Callahan, D. A.; Hicks, D. G.; Landen, O. L.; Langer, S. H.; Meezan, N. B.; Spears, B. K.; Widmann, K.; Kline, J. L.; Wilson, D. C.; Petrasso, R. D.; Leeper, R. J.

    2010-11-01

    Design calculations for NIF convergent ablator experiments will be described. The convergent ablator experiments measure the implosion trajectory, velocity, and ablation rate of an x-ray driven capsule and are a important component of the U. S. National Ignition Campaign at NIF. The design calculations are post-processed to provide simulations of the key diagnostics -- 1) Dante measurements of hohlraum x-ray flux and spectrum, 2) streaked radiographs of the imploding ablator shell, 3) wedge range filter measurements of D-He3 proton output spectra, and 4) GXD measurements of the imploded core. The simulated diagnostics will be compared to the experimental measurements to provide an assessment of the accuracy of the design code predictions of hohlraum radiation temperature, capsule ablation rate, implosion velocity, shock flash areal density, and x-ray bang time. Post-shot versions of the design calculations are used to enhance the understanding of the experimental measurements and will assist in choosing parameters for subsequent shots and the path towards optimal ignition capsule tuning. *SNL, LLNL, and LANL are operated under US DOE contracts DE-AC04-94AL85000. DE-AC52-07NA27344, and DE-AC04-94AL85000.

  11. Image Texture Dependence Upon Sensing and Calculation Parameters

    NASA Astrophysics Data System (ADS)

    Rodionova, N. V.

    2013-08-01

    This paper analyzes various parameters influence on the textural properties of digital remote sensing images using the statistical method of texture description (grey-level co-occurrence matrix (GLCM)). The parameters may be grouped to external (primary) parameters determined by surface and sensor characteristics (radar frequency, polarization, speckle filtering, spatial and radiometric resolution of the sensor, multispectral (MS) band, etc.), and internal (secondary) parameters determined by the texture calculation algorithm.SAR, MS and panchromatic images are used for illustration.

  12. Structural Design Parameters for Germanium

    NASA Technical Reports Server (NTRS)

    Salem, Jon; Rogers, Richard; Baker, Eric

    2017-01-01

    The fracture toughness and slow crack growth parameters of germanium supplied as single crystal beams and coarse grain disks were measured. Although germanium is anisotropic (A* 1.7), it is not as anisotropic as SiC, NiAl, or Cu. Thus the fracture toughness was similar on the 100, 110, and 111 planes, however, measurements associated with randomly oriented grinding cracks were 6 to 30 higher. Crack extension in ring loaded disks occurred on the 111 planes due to both the lower fracture energy and the higher stresses on stiff 111 planes. Germanium exhibits a Weibull scale effect, but does not exhibit significant slow crack growth in distilled water. (n 100), implying that design for quasi static loading can be performed with scaled strength statistics. Practical values for engineering design are a fracture toughness of 0.69 0.02 MPam (megapascals per square root meter) and a Weibull modulus of m 6 2. For well ground and reasonable handled coupons, average fracture strength should be greater than 40 megapascals. Aggregate, polycrystalline elastic constants are Epoly 131 gigapascals, vpoly 0.22.

  13. Design calculations for the ANS (Advanced Neutron Source) cold source

    SciTech Connect

    Lillie, R.A.; Alsmiller, R.G. Jr.

    1988-01-01

    The calculation procedure, based on discrete ordinates transport methods, that is being used to carry out design calculations for the Advanced Neutron Source cold source is described. Calculated results on the gain in cold neutron flux produced by a liquid deuterium cold source are compared with experimental data and with calculated data previously obtained by P. Ageron et al., at the Institute Max von Laue-Paul Langevin in Grenoble, France. Calculated results are also presented that indicated how the flux of cold neutrons vary with cold source parameters. 23 refs., 5 figs., 3 tabs.

  14. Dissipative Particle Dynamics interaction parameters from ab initio calculations

    NASA Astrophysics Data System (ADS)

    Sepehr, Fatemeh; Paddison, Stephen J.

    2016-02-01

    Dissipative Particle Dynamics (DPD) is a commonly employed coarse-grained method to model complex systems. Presented here is a pragmatic approach to connect atomic-scale information to the meso-scale interactions defined between the DPD particles or beads. Specifically, electronic structure calculations were utilized for the calculation of the DPD pair-wise interaction parameters. An implicit treatment of the electrostatic interactions for charged beads is introduced. The method is successfully applied to derive the parameters for a hydrated perfluorosulfonic acid ionomer with absorbed vanadium cations.

  15. Calculator program speeds rod pump design

    SciTech Connect

    Engineer, R.; Davis, C.L.

    1984-02-01

    Matching sucker rod pump characteristics to a specific application is greatly simplified with this program, intended for use with an HP-41CV hand-held computer. The user inputs application data and the program calculates all necessary design criteria, including Mill's acceleration factor, peak and minimum polish rod loads and horsepower required. Sample calculations are provided, together with a thorough discussion of special design considerations involved in huff-and-puff applications.

  16. Extended Hansen approach: calculating partial solubility parameters of solid solutes.

    PubMed

    Wu, P L; Beerbower, A; Martin, A

    1982-11-01

    A multiple linear regression method, known as the extended Hansen solubility approach, was used to estimate the partial solubility parameters, delta d, delta p, and delta h for crystalline solutes. The method is useful, since organic compounds may decompose near their melting points, and it is not possible, to determine solubility parameters for these solid compounds by the methods used for liquid solvents. The method gives good partial and total solubility parameters for naphthalene; with related compounds, less satisfactory results were obtained. At least three conditions, pertaining to the regression equation and the solvent systems, must be met in order to obtain reasonable solute solubility parameters. In addition to providing partial solubility parameters, the regression equations afford a calculation of solute solubility in both polar and nonpolar solvents.

  17. Heat Exchanger Support Bracket Design Calculations

    SciTech Connect

    Rucinski, Russ; /Fermilab

    1995-01-12

    This engineering note documents the design of the heat exchanger support brackets. The heat exchanger is roughly 40 feet long, 22 inches in diameter and weighs 6750 pounds. It will be mounted on two identical support brackets that are anchored to a concrete wall. The design calculations were done for one bracket supporting the full weight of the heat exchanger, rounded up to 6800 pounds. The design follows the American Institute of Steel Construction (AISC) Manual of steel construction, Eighth edition. All calculated stresses and loads on welds were below allowables.

  18. Calculations enable optimum design of magnetic brake

    NASA Technical Reports Server (NTRS)

    Kosmahl, H. G.

    1966-01-01

    Mathematical analysis and computations determine optimum magnetic coil configurations for a magnetic brake which controllably decelerates a free falling load to a soft stop. Calculations on unconventionally wound coils determine the required parameters for the desired deceleration with minimum electrical energy supplied to the stationary coil.

  19. Theoretical calculations of EPR parameters of gas phase hydracrylonitrile radical

    NASA Astrophysics Data System (ADS)

    Sarikaya, Ebru Karakaş; Dereli, Ömer

    2017-02-01

    As a result of detailed conformational search of the hydracrylonitrile, four different conformers of molecule have been obtained. For these conformations, eleven possible radicals were modelled by using density functional theory (DFT) computations with respect to molecular structure. Electron Paramagnetic Resonance parameters of these model radicals were calculated and then they were compared with the experimental ones. Geometry optimizations of the molecule and modeled radicals were calculated by B3LYP method using 6-311++G(d,p) basis sets in gas phase.

  20. Program Calculates Power Demands Of Electronic Designs

    NASA Technical Reports Server (NTRS)

    Cox, Brian

    1995-01-01

    CURRENT computer program calculates power requirements of electronic designs. For given design, CURRENT reads in applicable parts-list file and file containing current required for each part. Program also calculates power required for circuit at supply potentials of 5.5, 5.0, and 4.5 volts. Written by use of AWK utility for Sun4-series computers running SunOS 4.x and IBM PC-series and compatible computers running MS-DOS. Sun version of program (NPO-19590). PC version of program (NPO-19111).

  1. Calculator program helps set offshore design criteria

    SciTech Connect

    Tran, V.B.

    1983-01-10

    Describes a new program for the Hewlett-Packard HP 41C (or HP-41C) hand-held programmable calculator which predicts the design criteria for building offshore facilities. Points out that the ''wind and wave'' (WIWA) program can quickly provide the calculations necessary for proper design involving wind forces, wave forces, and stress acting on the hydrostatic pressure case of a submerged system. Presents a flow diagram of the program and the program listing. Explains the equations used as the basis of the program.

  2. Calculations of high-frequency parameters of disc-loaded waveguides

    NASA Astrophysics Data System (ADS)

    Kaschiev, M. S.; Mamonov, V. N.; Obukhov, Yu. L.; Reshetnikova, K. A.; Rubin, S. B.

    1987-12-01

    Radio-technical parameters of a disc-loaded waveguide suitable for modeling two-beam acceleration are designed. Two series of calculations using the finite element method (MULTIMODE program) and restricted region method (ALF program) lead to coinciding resonance frequencies for rectangular-disc waveguide. The MULTIMODE program package is also used for the numerical simulation of the rounded-edge-disc waveguide, the field distribution picture and several energy parameters of the designed system.

  3. Star Tracker/Mapper: System Design Parameters

    DTIC Science & Technology

    1974-09-01

    AD-A008 554 STAR TRACKER/MAPPER: SYSTEM’DESIGN PARAMETERS F. W. Schenkel Johns Hopkins University Prepared for: Naval Plant Representative Office...APLIJHU TG 1256 4. TITLE (andSubritle) 5. TYPE OF REPORT & PERIOD COVERED Star Tracker/Mapper: System Design Parameters 6. PERFORMING ORG. REPORT...identify by block number) Design parameters Star tracker/mapper Optical sensors Optical trackers Spectral characteristics 20. ABSTRACT (Continue on

  4. Calculating small interchain exchange parameters in Copper Pyrazine Dinitrate

    NASA Astrophysics Data System (ADS)

    Thomas, Iorwerth; Clark, Stewart; Lancaster, Tom

    The coordination polymer copper pyrazine dinitrate (Cu(pyz)(NO3)2) is a one-dimensional antiferromagnet that undergoes a magnetic phase transition to a state of long-range three dimensional magnetic order (LRO) below a temperature of 110 mK. The precise nature of the LRO is dependent on the strength of interchain interactions, which are very weak compared to the dominant superexchange interaction along the chain. It is therefore possible that different approaches to ab initio calculations of exchange interaction parameters may be subject to small systematic effects that would lead to erroneous results. In order to investigate whether such a problem arises in this case, we use the GGA+U approach to Density Functional Theory to compare the results obtained by two methods of calculating these parameters: the dimer fragment approach and the periodic method, and relate them to both experiment and previous calculations performed using the hybrid approach. Supported by the Templeton Foundation as part of the Durham Emergence Project.

  5. Design Criteria for Low Profile Flange Calculations

    NASA Technical Reports Server (NTRS)

    Leimbach, K. R.

    1973-01-01

    An analytical method and a design procedure to develop flanged separable pipe connectors are discussed. A previously established algorithm is the basis for calculating low profile flanges. The characteristics and advantages of the low profile flange are analyzed. The use of aluminum, titanium, and plastics for flange materials is described. Mathematical models are developed to show the mechanical properties of various flange configurations. A computer program for determining the structural stability of the flanges is described.

  6. Computer program for calculating flow parameters and power requirements for cryogenic wind tunnels

    NASA Technical Reports Server (NTRS)

    Dress, D. A.

    1985-01-01

    A computer program has been written that performs the flow parameter calculations for cryogenic wind tunnels which use nitrogen as a test gas. The flow parameters calculated include static pressure, static temperature, compressibility factor, ratio of specific heats, dynamic viscosity, total and static density, velocity, dynamic pressure, mass-flow rate, and Reynolds number. Simplifying assumptions have been made so that the calculations of Reynolds number, as well as the other flow parameters can be made on relatively small desktop digital computers. The program, which also includes various power calculations, has been developed to the point where it has become a very useful tool for the users and possible future designers of fan-driven continuous-flow cryogenic wind tunnels.

  7. WIPP shaft seal system parameters recommended to support compliance calculations

    SciTech Connect

    Hurtado, L.D.; Knowles, M.K.; Kelley, V.A.; Jones, T.L.; Ogintz, J.B.; Pfeifle, T.W.

    1997-12-01

    The US Department of Energy plans to dispose of transuranic waste at the Waste Isolation Pilot Plant (WIPP), which is sited in southeastern New Mexico. The WIPP disposal facility is located approximately 2,150 feet (650 m) below surface in the bedded halite of the Salado Formation. Prior to initiation of disposal activities, the Department of Energy must demonstrate that the WIPP will comply with all regulatory requirements. Applicable regulations require that contaminant releases from the WIPP remain below specified levels for a period of 10,000 years. To demonstrate that the WIPP will comply with these regulations, the Department of Energy has requested that Sandia National Laboratories develop and implement a comprehensive performance assessment of the WIPP repository for the regulatory period. This document presents the conceptual model of the shaft sealing system to be implemented in performance assessment calculations conducted in support of the Compliance Certification Application for the WIPP. The model was developed for use in repository-scale calculations and includes the seal system geometry and materials to be used in grid development as well as all parameters needed to describe the seal materials. These calculations predict the hydrologic behavior of the system. Hence conceptual model development is limited to those processes that could impact the fluid flow through the seal system.

  8. Calculational methodology and associated uncertainties: Sensitivity and uncertainty analysis of reactor performance parameters

    SciTech Connect

    Kujawski, E.; Weisbin, C.R.

    1982-01-01

    This chapter considers the calculational methodology and associated uncertainties both for the design of large LMFBR's and the analysis of critical assemblies (fast critical experiments) as performed by several groups within the US. Discusses cross-section processing; calculational methodology for the design problem; core physics computations; design-oriented approximations; benchmark analyses; and determination of calculational corrections and associated uncertainties for a critical assembly. Presents a detailed analysis of the sources of calculational uncertainties for the critical assembly ZPR-6/7 to illustrate the quantitative assessment of calculational correction factors and uncertainties. Examines calculational uncertainties that arise from many different sources including intrinsic limitations of computational methods; design-oriented approximations related to reactor modeling; computational capability and code availability; economic limitations; and the skill of the reactor analyst. Emphasizes that the actual design uncertainties in most of the parameters, with the possible exception of burnup, are likely to be less than might be indicated by the results presented in this chapter because reactor designers routinely apply bias factors (usually derived from critical experiments) to their calculated results.

  9. A Multi-Parameter Approach for Calculating Crack Instability

    NASA Technical Reports Server (NTRS)

    Zanganeh, M.; Forman, R. G.

    2014-01-01

    An accurate fracture control analysis of spacecraft pressure systems, boosters, rocket hardware and other critical low-cycle fatigue cases where the fracture toughness highly impacts cycles to failure requires accurate knowledge of the material fracture toughness. However, applicability of the measured fracture toughness values using standard specimens and transferability of the values to crack instability analysis of the realistically complex structures is refutable. The commonly used single parameter Linear Elastic Fracture Mechanics (LEFM) approach which relies on the key assumption that the fracture toughness is a material property would result in inaccurate crack instability predictions. In the past years extensive studies have been conducted to improve the single parameter (K-controlled) LEFM by introducing parameters accounting for the geometry or in-plane constraint effects]. Despite the importance of the thickness (out-of-plane constraint) effects in fracture control problems, the literature is mainly limited to some empirical equations for scaling the fracture toughness data] and only few theoretically based developments can be found. In aerospace hardware where the structure might have only one life cycle and weight reduction is crucial, reducing the design margin of safety by decreasing the uncertainty involved in fracture toughness evaluations would result in lighter hardware. In such conditions LEFM would not suffice and an elastic-plastic analysis would be vital. Multi-parameter elastic plastic crack tip field quantifying developments combined with statistical methods] have been shown to have the potential to be used as a powerful tool for tackling such problems. However, these approaches have not been comprehensively scrutinized using experimental tests. Therefore, in this paper a multi-parameter elastic-plastic approach has been used to study the crack instability problem and the transferability issue by considering the effects of geometrical

  10. Electronic structure calculations of ESR parameters of melanin units.

    PubMed

    Batagin-Neto, Augusto; Bronze-Uhle, Erika Soares; Graeff, Carlos Frederico de Oliveira

    2015-03-21

    Melanins represent an important class of natural pigments present in plants and animals that are currently considered to be promising materials for applications in optic and electronic devices. Despite their interesting properties, some of the basic features of melanins are not satisfactorily understood, including the origin of their intrinsic paramagnetism. A number of experiments have been performed to investigate the electron spin resonance (ESR) response of melanin derivatives, but until now, there has been no consensus regarding the real structure of the paramagnetic centers involved. In this work, we have employed electronic structure calculations to evaluate the ESR parameters of distinct melanin monomers and dimers in order to identify the possible structures associated with unpaired spins in this biopolymer. The g-factors and hyperfine constants of the cationic, anionic and radicalar structures were investigated. The results confirm the existence of at least two distinct paramagnetic centers in melanin structure, identifying the chemical species associated with them and their roles in electrical conductivity.

  11. Brachytherapy dosimetry parameters calculated for a 131Cs source.

    PubMed

    Rivard, Mark J

    2007-02-01

    A comprehensive analysis of the IsoRay Medical model CS-1 Rev2 131Cs brachytherapy source was performed. Dose distributions were simulated using Monte Carlo methods (MCNP5) in liquid water, Solid Water, and Virtual Water spherical phantoms. From these results, the in-water brachytherapy dosimetry parameters have been determined, and were compared with those of Murphy et al. [Med. Phys. 31, 1529-1538 (2004)] using measurements and simulations. Our results suggest that calculations obtained using erroneous cross-section libraries should be discarded as recommended by the 2004 AAPM TG-43U1 report. Our Mclambda value of 1.046+/-0.019 cGy h(-1) U(-1) is within 1.3% of that measured by Chen et al. [Med. Phys. 32, 3279-3285 (2005)] using TLDs and the calculated results of Wittman and Fisher [Med. Phys. 34, 49-54 (2007)] using MCNP5. Using the discretized energy approach of Rivard [Appl. Radiat. Isot. 55, 775-782 (2001)] to ascertain the impact of individual 131Cs photons on radial dose function and anisotropy functions, there was virtual equivalence of results for 29.461< or =Egamma< or = 34.419 keV and for a mono-energetic 30.384 keV photon source. Comparisons of radial dose function and 2D anisotropy function data are also included, and an analysis of material composition and cross-section libraries was performed.

  12. Design parameters of toroidal and bobbin magnetics

    NASA Technical Reports Server (NTRS)

    Mclyman, W. T.

    1973-01-01

    The adoption by NASA of the metric system for dimensioning to replace the long-used English units imposes a requirement on the U.S. transformer designer to convert from the familiar units to the less familiar metric equivalents. Material is presented to assist in that transition in the field of transformer design and fabrication. The conversion data makes it possible for the designer to obtain a fast and close approximation of significant parameters such as size, weight, and temperature rise. Nomographs are included to provide a close approximation for breadboarding purposes. For greater convenience, derivations of some of the parameters are also presented.

  13. Design Parameters in Multimodal Games for Rehabilitation

    PubMed Central

    Basteris, Angelo; Amirabdollahian, Farshid

    2014-01-01

    Abstract Objectives: The repetitive and sometimes mundane nature of conventional rehabilitation therapy provides an ideal opportunity for development of interactive and challenging therapeutic games that have the potential to engage and motivate the players. Certain game design parameters that may encourage patients to actively participate by making the games more enjoyable have been identified. In this article, we describe a formative study in which we designed and evaluated some of these parameters with healthy subjects. Materials and Methods: The “operant conditioning” and “scoring” design parameters were incorporated in a remake of a classic labyrinth game, “Marble Maze.” A group of participants (n=37) played the game twice: Once in the control condition without both modalities and then with either one of the parameters or with both. Measures of game duration and number of fails in the game were recorded along with survey questionnaires to measure player perceptions of intrinsic motivation on the game. Results: Longer playtimes, higher levels of interest/enjoyment, and effort to play the game were recorded with the introduction of these parameters. Conclusions: This study provides an understanding on how game design parameters can be used to motivate and encourage people to play longer. With these positive results, future aims are to test the parameters with stroke patients, providing much clearer insight as to what influences these parameters have on patients undergoing therapy. The ultimate goal is to utilize game design in order to maintain longer therapeutic interaction between a patient and his or her therapy medium. PMID:24761328

  14. Optimal design criteria - prediction vs. parameter estimation

    NASA Astrophysics Data System (ADS)

    Waldl, Helmut

    2014-05-01

    G-optimality is a popular design criterion for optimal prediction, it tries to minimize the kriging variance over the whole design region. A G-optimal design minimizes the maximum variance of all predicted values. If we use kriging methods for prediction it is self-evident to use the kriging variance as a measure of uncertainty for the estimates. Though the computation of the kriging variance and even more the computation of the empirical kriging variance is computationally very costly and finding the maximum kriging variance in high-dimensional regions can be time demanding such that we cannot really find the G-optimal design with nowadays available computer equipment in practice. We cannot always avoid this problem by using space-filling designs because small designs that minimize the empirical kriging variance are often non-space-filling. D-optimality is the design criterion related to parameter estimation. A D-optimal design maximizes the determinant of the information matrix of the estimates. D-optimality in terms of trend parameter estimation and D-optimality in terms of covariance parameter estimation yield basically different designs. The Pareto frontier of these two competing determinant criteria corresponds with designs that perform well under both criteria. Under certain conditions searching the G-optimal design on the above Pareto frontier yields almost as good results as searching the G-optimal design in the whole design region. In doing so the maximum of the empirical kriging variance has to be computed only a few times though. The method is demonstrated by means of a computer simulation experiment based on data provided by the Belgian institute Management Unit of the North Sea Mathematical Models (MUMM) that describe the evolution of inorganic and organic carbon and nutrients, phytoplankton, bacteria and zooplankton in the Southern Bight of the North Sea.

  15. Two space scatterer formalism calculation of bulk parameters of thunderclouds

    NASA Technical Reports Server (NTRS)

    Phanord, Dieudonne D.

    1994-01-01

    In a previous study, we used a modified two-space scatterer formalism of Twersky to establish for a cloud modeled as a statistically homogeneous distribution of spherical water droplets, the dispersion relations that determine its bulk propagation numbers and bulk indexes of refraction in terms of the vector equivalent scattering amplitude and the dyadic scattering amplitude of the single water droplet in isolation. The results were specialized to the forward direction of scattering while demanding that the scatterers preserve the incident polarization. We apply this approach to obtain specific numerical values for the macroscopic parameters of the cloud. We work with a cloud of density rho = 100 cm(exp -3), a wavelength lambda = 0.7774 microns, and with spherical water droplets of common radius alpha = 10 microns. In addition, the scattering medium is divided into three parts, the medium outside the cloud, moist air (the medium inside the cloud but outside the droplets), and the medium inside the spherical water droplets. The results of this report are applicable to a cloud of any geometry since the boundary does not interfere with the calculations. Also, it is important to notice the plane wave nature of the incidence wave in the moist atmosphere.

  16. Bedside calculation of hemodynamic parameters with a hand held programmable calculator. Part II: Programs for hemodynamic and oxygen transport parameters computation.

    PubMed

    Laurent, M

    1980-01-01

    Two programs calculating oxygen transport parameters and hemodynamic values respectively are described. They may be used indifferently with HP 67 or HP 97 Hewlett Packard calculators. (Acta anaesth. belg., 1980, 31, 53-59).

  17. Code System to Calculate Integral Parameters with Reaction Rates from WIMS Output.

    SciTech Connect

    LESZCZYNSKI, FRANCISCO

    1994-10-25

    Version 00 REACTION calculates different integral parameters related to neutron reactions on reactor lattices, from reaction rates calculated with WIMSD4 code, and comparisons with experimental values.

  18. Design parameters for wearable optical imagers

    NASA Astrophysics Data System (ADS)

    Akin, Ata; Kim, Sanghyun; Pourrezaei, Kambiz; Chance, Britton; Nioka, Shoko

    2001-06-01

    This paper summarizes the design steps that are followed during the development of the portable optical imager for breast cancer screening. The design steps considered the parameters such as total power consumption versus battery weight and size, speed of data acquisition versus cost and complexity of the design (functionality), graphical display versus operating system choice. We have used a single board computer system that uses Windows CE as the real time operating system. This choice was preferred since our graphical display requirements can only be carried out with the CE environment's GUI kernels.

  19. Aerodynamics as a subway design parameter

    NASA Technical Reports Server (NTRS)

    Kurtz, D. W.

    1976-01-01

    A parametric sensitivity study has been performed on the system operational energy requirement in order to guide subway design strategy. Aerodynamics can play a dominant or trivial role, depending upon the system characteristics. Optimization of the aerodynamic parameters may not minimize the total operational energy. Isolation of the station box from the tunnel and reduction of the inertial power requirements pay the largest dividends in terms of the operational energy requirement.

  20. Continuous damage parameter calculation under thermo-mechanical random loading.

    PubMed

    Nagode, Marko

    2014-01-01

    The paper presents a method on how the mean stress effect on fatigue damage can be taken into account under an arbitrary low cycle thermo-mechanical loading. From known stress, elastoplastic strain and temperature histories the cycle amplitudes and cycle mean values are extracted and the damage parameter is computed. In contrast to the existing methods the proposed method enables continuous damage parameter computation without the need of waiting for the cycles to close. The limitations of the standardized damage parameters are thus surpassed. The damage parameters derived initially for closed and isothermal cycles assuming that the elastoplastic stress-strain response follows the Masing and memory rules can now be used to take the mean stress effect into account under an arbitrary low cycle thermo-mechanical loading. The method includes:•stress and elastoplastic strain history transformation into the corresponding amplitude and mean values;•stress and elastoplastic strain amplitude and mean value transformation into the damage parameter amplitude history;•damage parameter amplitude history transformation into the damage parameter history.

  1. Continuous damage parameter calculation under thermo-mechanical random loading

    PubMed Central

    Nagode, Marko

    2014-01-01

    The paper presents a method on how the mean stress effect on fatigue damage can be taken into account under an arbitrary low cycle thermo-mechanical loading. From known stress, elastoplastic strain and temperature histories the cycle amplitudes and cycle mean values are extracted and the damage parameter is computed. In contrast to the existing methods the proposed method enables continuous damage parameter computation without the need of waiting for the cycles to close. The limitations of the standardized damage parameters are thus surpassed. The damage parameters derived initially for closed and isothermal cycles assuming that the elastoplastic stress–strain response follows the Masing and memory rules can now be used to take the mean stress effect into account under an arbitrary low cycle thermo-mechanical loading. The method includes:•stress and elastoplastic strain history transformation into the corresponding amplitude and mean values;•stress and elastoplastic strain amplitude and mean value transformation into the damage parameter amplitude history;•damage parameter amplitude history transformation into the damage parameter history. PMID:26150939

  2. Seismic design parameters - A user guide

    USGS Publications Warehouse

    Leyendecker, E.V.; Frankel, A.D.; Rukstales, K.S.

    2001-01-01

    The 1997 NEHRP Recommended Provisions for Seismic Regulations for New Buildings (1997 NEHRP Provisions) introduced seismic design procedure that is based on the explicit use of spectral response acceleration rather than the traditional peak ground acceleration and/or peak ground velocity or zone factors. The spectral response accelerations are obtained from spectral response acceleration maps accompanying the report. Maps are available for the United States and a number of U.S. territories. Since 1997 additional codes and standards have also adopted seismic design approaches based on the same procedure used in the NEHRP Provisions and the accompanying maps. The design documents using the 1997 NEHRP Provisions procedure may be divided into three categories -(1) Design of New Construction, (2) Design and Evaluation of Existing Construction, and (3) Design of Residential Construction. A CD-ROM has been prepared for use in conjunction with the design documents in each of these three categories. The spectral accelerations obtained using the software on the CD are the same as those that would be obtained by using the maps accompanying the design documents. The software has been prepared to operate on a personal computer using a Windows (Microsoft Corporation) operating environment and a point and click type of interface. The user can obtain the spectral acceleration values that would be obtained by use of the maps accompanying the design documents, include site factors appropriate for the Site Class provided by the user, calculate a response spectrum that includes the site factor, and plot a response spectrum. Sites may be located by providing the latitude-longitude or zip code for all areas covered by the maps. All of the maps used in the various documents are also included on the CDROM

  3. Microcomputer Calculation of Thermodynamic Properties from Molecular Parameters of Gases.

    ERIC Educational Resources Information Center

    Venugopalan, Mundiyath

    1990-01-01

    Described in this article is a problem-solving activity which integrates the application of microcomputers with the learning of physical chemistry. Students use the program with spectroscopic data to calculate the thermodynamic properties and compare them with the values from the thermochemical tables. (Author/KR)

  4. Design parameters for rotating cylindrical filtration

    NASA Technical Reports Server (NTRS)

    Schwille, John A.; Mitra, Deepanjan; Lueptow, Richard M.

    2002-01-01

    Rotating cylindrical filtration displays significantly reduced plugging of filter pores and build-up of a cake layer, but the number and range of parameters that can be adjusted complicates the design of these devices. Twelve individual parameters were investigated experimentally by measuring the build-up of particles on the rotating cylindrical filter after a fixed time of operation. The build-up of particles on the filter depends on the rotational speed, the radial filtrate flow, the particle size and the gap width. Other parameters, such as suspension concentration and total flow rate are less important. Of the four mechanisms present in rotating filters to reduce pore plugging and cake build-up, axial shear, rotational shear, centrifugal sedimentation and vortical motion, the evidence suggests rotational shear is the dominant mechanism, although the other mechanisms still play minor roles. The ratio of the shear force acting parallel to the filter surface on a particle to the Stokes drag acting normal to the filter surface on the particle due to the difference between particle motion and filtrate flow can be used as a non-dimensional parameter that predicts the degree of particle build-up on the filter surface for a wide variety of filtration conditions. c2002 Elsevier Science B.V. All rights reserved.

  5. Calculation and optimization of parameters in low-flow pumps

    NASA Astrophysics Data System (ADS)

    Kraeva, E. M.; Masich, I. S.

    2016-04-01

    The materials on balance tests of high-speed centrifugal pumps with low flow rate are presented. On the bases of analysis and research synthesis, we demonstrate the rational use of impellers of semi-open and open types providing high values for energy parameters of feed system of low-flow pumps.

  6. Recursive least squares approach to calculate motion parameters for a moving camera

    NASA Astrophysics Data System (ADS)

    Chang, Samuel H.; Fuller, Joseph; Farsaie, Ali; Elkins, Les

    2003-10-01

    The increase in quality and the decrease in price of digital camera equipment have led to growing interest in reconstructing 3-dimensional objects from sequences of 2-dimensional images. The accuracy of the models obtained depends on two sets of parameter estimates. The first is the set of lens parameters - focal length, principal point, and distortion parameters. The second is the set of motion parameters that allows the comparison of a moving camera"s desired location to a theoretical location. In this paper, we address the latter problem, i.e. the estimation of the set of 3-D motion parameters from data obtained with a moving camera. We propose a method that uses Recursive Least Squares for camera motion parameter estimation with observation noise. We accomplish this by calculation of hidden information through camera projection and minimization of the estimation error. We then show how a filter based on the motion parameters estimates may be designed to correct for the errors in the camera motion. The validity of the approach is illustrated by the presentation of experimental results obtained using the methods described in the paper.

  7. Machine Learning of Parameters for Accurate Semiempirical Quantum Chemical Calculations

    PubMed Central

    2015-01-01

    We investigate possible improvements in the accuracy of semiempirical quantum chemistry (SQC) methods through the use of machine learning (ML) models for the parameters. For a given class of compounds, ML techniques require sufficiently large training sets to develop ML models that can be used for adapting SQC parameters to reflect changes in molecular composition and geometry. The ML-SQC approach allows the automatic tuning of SQC parameters for individual molecules, thereby improving the accuracy without deteriorating transferability to molecules with molecular descriptors very different from those in the training set. The performance of this approach is demonstrated for the semiempirical OM2 method using a set of 6095 constitutional isomers C7H10O2, for which accurate ab initio atomization enthalpies are available. The ML-OM2 results show improved average accuracy and a much reduced error range compared with those of standard OM2 results, with mean absolute errors in atomization enthalpies dropping from 6.3 to 1.7 kcal/mol. They are also found to be superior to the results from specific OM2 reparameterizations (rOM2) for the same set of isomers. The ML-SQC approach thus holds promise for fast and reasonably accurate high-throughput screening of materials and molecules. PMID:26146493

  8. Machine learning of parameters for accurate semiempirical quantum chemical calculations

    DOE PAGES

    Dral, Pavlo O.; von Lilienfeld, O. Anatole; Thiel, Walter

    2015-04-14

    We investigate possible improvements in the accuracy of semiempirical quantum chemistry (SQC) methods through the use of machine learning (ML) models for the parameters. For a given class of compounds, ML techniques require sufficiently large training sets to develop ML models that can be used for adapting SQC parameters to reflect changes in molecular composition and geometry. The ML-SQC approach allows the automatic tuning of SQC parameters for individual molecules, thereby improving the accuracy without deteriorating transferability to molecules with molecular descriptors very different from those in the training set. The performance of this approach is demonstrated for the semiempiricalmore » OM2 method using a set of 6095 constitutional isomers C7H10O2, for which accurate ab initio atomization enthalpies are available. The ML-OM2 results show improved average accuracy and a much reduced error range compared with those of standard OM2 results, with mean absolute errors in atomization enthalpies dropping from 6.3 to 1.7 kcal/mol. They are also found to be superior to the results from specific OM2 reparameterizations (rOM2) for the same set of isomers. The ML-SQC approach thus holds promise for fast and reasonably accurate high-throughput screening of materials and molecules.« less

  9. Machine learning of parameters for accurate semiempirical quantum chemical calculations

    SciTech Connect

    Dral, Pavlo O.; von Lilienfeld, O. Anatole; Thiel, Walter

    2015-04-14

    We investigate possible improvements in the accuracy of semiempirical quantum chemistry (SQC) methods through the use of machine learning (ML) models for the parameters. For a given class of compounds, ML techniques require sufficiently large training sets to develop ML models that can be used for adapting SQC parameters to reflect changes in molecular composition and geometry. The ML-SQC approach allows the automatic tuning of SQC parameters for individual molecules, thereby improving the accuracy without deteriorating transferability to molecules with molecular descriptors very different from those in the training set. The performance of this approach is demonstrated for the semiempirical OM2 method using a set of 6095 constitutional isomers C7H10O2, for which accurate ab initio atomization enthalpies are available. The ML-OM2 results show improved average accuracy and a much reduced error range compared with those of standard OM2 results, with mean absolute errors in atomization enthalpies dropping from 6.3 to 1.7 kcal/mol. They are also found to be superior to the results from specific OM2 reparameterizations (rOM2) for the same set of isomers. The ML-SQC approach thus holds promise for fast and reasonably accurate high-throughput screening of materials and molecules.

  10. Machine Learning of Parameters for Accurate Semiempirical Quantum Chemical Calculations.

    PubMed

    Dral, Pavlo O; von Lilienfeld, O Anatole; Thiel, Walter

    2015-05-12

    We investigate possible improvements in the accuracy of semiempirical quantum chemistry (SQC) methods through the use of machine learning (ML) models for the parameters. For a given class of compounds, ML techniques require sufficiently large training sets to develop ML models that can be used for adapting SQC parameters to reflect changes in molecular composition and geometry. The ML-SQC approach allows the automatic tuning of SQC parameters for individual molecules, thereby improving the accuracy without deteriorating transferability to molecules with molecular descriptors very different from those in the training set. The performance of this approach is demonstrated for the semiempirical OM2 method using a set of 6095 constitutional isomers C7H10O2, for which accurate ab initio atomization enthalpies are available. The ML-OM2 results show improved average accuracy and a much reduced error range compared with those of standard OM2 results, with mean absolute errors in atomization enthalpies dropping from 6.3 to 1.7 kcal/mol. They are also found to be superior to the results from specific OM2 reparameterizations (rOM2) for the same set of isomers. The ML-SQC approach thus holds promise for fast and reasonably accurate high-throughput screening of materials and molecules.

  11. Preliminary results of the calculated and experimental studies of the basic aerothermodynamic parameters of the ExoMars landing module

    NASA Astrophysics Data System (ADS)

    Finchenko, V. S.; Ivankov, A. A.; Shmatov, S. I.; Mordvinkin, A. S.

    2015-12-01

    The article presents the initial data for the ExoMars landing module aerothermodynamic calculations, used calculation methods, the calculation results of aerodynamic characteristics of the landing module shape and structural parameters of thermal protection selected during the conceptual design phase. Also, the test results of the destruction of the thermal protection material and comparison of the basic characteristics of the landing module with a front shield in the form of a cone and a spherical segment are presented.

  12. Design parameters and source terms: Volume 1, Design parameters: Revision 0

    SciTech Connect

    Not Available

    1987-10-01

    The Design Parameters and Source Terms Document was prepared in accordance with DOE request and to provide data for the environmental impact study to be performed in the future for the Deaf Smith County, Texas site for a nuclear waste repository in salt. This document updates a previous unpublished report by Stearns Catalytic Corporation (SCC), entitled ''Design Parameters and Source Terms for a Two-Phase Repository in Salt,'' 1985, to the level of the Site Characterization Plan - Conceptual Design Report. The previous unpublished SCC Study identifies the data needs for the Environmental Assessment effort for seven possible Salt Repository sites.

  13. Design sensitivity analysis using EAL. Part 1: Conventional design parameters

    NASA Technical Reports Server (NTRS)

    Dopker, B.; Choi, Kyung K.; Lee, J.

    1986-01-01

    A numerical implementation of design sensitivity analysis of builtup structures is presented, using the versatility and convenience of an existing finite element structural analysis code and its database management system. The finite element code used in the implemenatation presented is the Engineering Analysis Language (EAL), which is based on a hybrid method of analysis. It was shown that design sensitivity computations can be carried out using the database management system of EAL, without writing a separate program and a separate database. Conventional (sizing) design parameters such as cross-sectional area of beams or thickness of plates and plane elastic solid components are considered. Compliance, displacement, and stress functionals are considered as performance criteria. The method presented is being extended to implement shape design sensitivity analysis using a domain method and a design component method.

  14. Calculation of RIXS spectra of cuprates using band structure parameters

    NASA Astrophysics Data System (ADS)

    Shi, Yifei; Klich, Israel; Benjamin, David; Demler, Eugene

    2015-03-01

    We explore the quasi particle theory to study the Resonant Inelastic X-ray Scattering(RIXS) by using the band structure parameters. We use both the determinant method(D. Benjamin, I. Klich and E. Demler, Phys. Rev. Lett. 112, 247002(2014)) and the expansion in the core-hole potential. The methods are applied to the (CaxLa1?x)(Ba1 . 75 - xLa0 . 25 + x)Cu3Oy, (x= 0 . 1 and 0 . 4). We find that by using the band structure alone we can obtain quantitative agreement with the experimental data, especially for the position of the peak.

  15. Methods of calculating engineering parameters for gas separations

    NASA Technical Reports Server (NTRS)

    Lawson, D. D.

    1980-01-01

    A group additivity method has been generated which makes it possible to estimate, from the structural formulas alone, the energy of vaporization and the molar volume at 25 C of many nonpolar organic liquids. From these two parameters and appropriate thermodynamic relationships it is then possible to predict the vapor pressure of the liquid phase and the solubility of various gases in nonpolar organic liquids. The data are then used to evaluate organic and some inorganic liquids for use in gas separation stages or as heat exchange fluids in prospective thermochemical cycles for hydrogen production.

  16. Computing tools for accelerator design calculations

    SciTech Connect

    Fischler, M.; Nash, T.

    1984-01-01

    This note is intended as a brief, summary guide for accelerator designers to the new generation of commercial and special processors that allow great increases in computing cost effectiveness. New thinking is required to take best advantage of these computing opportunities, in particular, when moving from analytical approaches to tracking simulations. In this paper, we outline the relevant considerations.

  17. Design Calculations For NIF Convergent Ablator Experiments

    SciTech Connect

    Olson, R E; Hicks, D G; Meezan, N B; Callahan, D A; Landen, O L; Jones, O S; Langer, S H; Kline, J L; Wilson, D C; Rinderknecht, H; Zylstra, A; Petrasso, R D

    2011-10-25

    The NIF convergent ablation tuning effort is underway. In the early experiments, we have discovered that the design code simulations over-predict the capsule implosion velocity and shock flash rhor, but under-predict the hohlraum x-ray flux measurements. The apparent inconsistency between the x-ray flux and radiography data implies that there are important unexplained aspects of the hohlraum and/or capsule behavior.

  18. Diffraction performance calculations in lens design.

    NASA Astrophysics Data System (ADS)

    Malacara, D.

    A review of the methods employed to compute the wavefront shape, the point spread function and the optical transfer function in lens evaluation programs is presented. One of the simplest methods to perform numerical calculations of the diffraction performance of optical systems is to divide the aperture in small squares, and then to consider the wavefront in each of these small squares to be flat and perpendicular to the ray direction in that region. This method however, presents some limitations, since the wavefront has to be flat within a fraction of the wavelength in that small square. This might not be the case if the wavefront is either too aberrated, or the defocusing is too large.

  19. Recommended environmental dose calculation methods and Hanford-specific parameters

    SciTech Connect

    Schreckhise, R.G.; Rhoads, K.; Napier, B.A.; Ramsdell, J.V. ); Davis, J.S. )

    1993-03-01

    This document was developed to support the Hanford Environmental Dose overview Panel (HEDOP). The Panel is responsible for reviewing all assessments of potential doses received by humans and other biota resulting from the actual or possible environmental releases of radioactive and other hazardous materials from facilities and/or operations belonging to the US Department of Energy on the Hanford Site in south-central Washington. This document serves as a guide to be used for developing estimates of potential radiation doses, or other measures of risk or health impacts, to people and other biota in the environs on and around the Hanford Site. It provides information to develop technically sound estimates of exposure (i.e., potential or actual) to humans or other biotic receptors that could result from the environmental transport of potentially harmful materials that have been, or could be, released from Hanford operations or facilities. Parameter values and information that are specific to the Hanford environs as well as other supporting material are included in this document.

  20. Cryogenic masers. [frequency stability and design parameters

    NASA Technical Reports Server (NTRS)

    Berlinsky, A. J.; Hardy, W. N.

    1982-01-01

    Various factors affecting the frequency stability of hydrogen masers are described and related to maser design parameters. The long-term frequency stability of a hydrogen maser is limited by the mechanical stability of the cavity, and the magnitudes of the wall relaxation, spin exchange, and recombination rates which affect the Q of the line. Magnetic resonance studies of hydrogen atoms at temperatures below 1 K and in containers coated with liquid helium films demonstrated that cryogenic masers may allow substantial improvements in all of these parameters. In particular the thermal expansion coefficients of most materials are negligible at 1 K. Spin exchange broadening is three orders of magnitude smaller at 1 K than at room temperature, and the recombination and wall relaxation rates are negligible at 0.52 K where the frequency shift due to the 4 He-coated walls of the container has a broad minimum as a function of temperature. Other advantages of the helium-cooled maser result from the high purity, homogeneity, and resilence of helium-film-coated walls and the natural compatibility of the apparatus with helium-cooled amplifiers.

  1. Design of initial dosage regimen using a programmable calculator.

    PubMed

    Ritschel, W A; Eldon, M A

    1985-07-01

    A programmable calculator procedure for the determination of dosage regimens to achieve desired steady state concentrations is described. The dosage regimen prediction is based on data from the literature on pharmacokinetic parameters of drugs and correction factors specific for the patient's condition, such as renal failure, geriatric patient and congestive heart failure. The program is designed to generate dosage regimens based on desired steady state trough level, desired steady state peak level, desired mean steady state level, or to fluctuate between desired steady state peak and trough levels. The program can be used for I.V. and extravascular route of administration. A detailed program description and user instructions are presented and illustrated by three examples.

  2. Calculating Balanced Incomplete Block Design for Educational Assessments.

    ERIC Educational Resources Information Center

    van der Linden, Wim J.; Carlson, James E.

    A popular design in large-scale educational assessments is the balanced incomplete block design. The design assumes that the item pool is split into a set of blocks of items that are assigned to assessment booklets. This paper shows how the technique of 0-1 linear programming can be used to calculate a balanced incomplete block design. Several…

  3. Calculating background levels for ecological risk parameters in toxic harbor sediment

    USGS Publications Warehouse

    Leadon, C.J.; McDonnell, T.R.; Lear, J.; Barclift, D.

    2007-01-01

    Establishing background levels for biological parameters is necessary in assessing the ecological risks from harbor sediment contaminated with toxic chemicals. For chemicals in sediment, the term contaminated is defined as having concentrations above background and significant human health or ecological risk levels. For biological parameters, a site could be considered contaminated if levels of the parameter are either more or less than the background level, depending on the specific parameter. Biological parameters can include tissue chemical concentrations in ecological receptors, bioassay responses, bioaccumulation levels, and benthic community metrics. Chemical parameters can include sediment concentrations of a variety of potentially toxic chemicals. Indirectly, contaminated harbor sediment can impact shellfish, fish, birds, and marine mammals, and human populations. This paper summarizes the methods used to define background levels for chemical and biological parameters from a survey of ecological risk investigations of marine harbor sediment at California Navy bases. Background levels for regional biological indices used to quantify ecological risks for benthic communities are also described. Generally, background stations are positioned in relatively clean areas exhibiting the same physical and general chemical characteristics as nearby areas with contaminated harbor sediment. The number of background stations and the number of sample replicates per background station depend on the statistical design of the sediment ecological risk investigation, developed through the data quality objective (DQO) process. Biological data from the background stations can be compared to data from a contaminated site by using minimum or maximum background levels or comparative statistics. In Navy ecological risk assessments (ERA's), calculated background levels and appropriate ecological risk screening criteria are used to identify sampling stations and sites with contaminated

  4. Net thrust calculation sensitivity of an afterburning turbofan engine to variations in input parameters

    NASA Technical Reports Server (NTRS)

    Hughes, D. L.; Ray, R. J.; Walton, J. T.

    1985-01-01

    The calculated value of net thrust of an aircraft powered by a General Electric F404-GE-400 afterburning turbofan engine was evaluated for its sensitivity to various input parameters. The effects of a 1.0-percent change in each input parameter on the calculated value of net thrust with two calculation methods are compared. This paper presents the results of these comparisons and also gives the estimated accuracy of the overall net thrust calculation as determined from the influence coefficients and estimated parameter measurement accuracies.

  5. Sampling of Stochastic Input Parameters for Rockfall Calculations and for Structural Response Calculations Under Vibratory Ground Motion

    SciTech Connect

    M. Gross

    2004-09-01

    The purpose of this scientific analysis is to define the sampled values of stochastic (random) input parameters for (1) rockfall calculations in the lithophysal and nonlithophysal zones under vibratory ground motions, and (2) structural response calculations for the drip shield and waste package under vibratory ground motions. This analysis supplies: (1) Sampled values of ground motion time history and synthetic fracture pattern for analysis of rockfall in emplacement drifts in nonlithophysal rock (Section 6.3 of ''Drift Degradation Analysis'', BSC 2004 [DIRS 166107]); (2) Sampled values of ground motion time history and rock mechanical properties category for analysis of rockfall in emplacement drifts in lithophysal rock (Section 6.4 of ''Drift Degradation Analysis'', BSC 2004 [DIRS 166107]); (3) Sampled values of ground motion time history and metal to metal and metal to rock friction coefficient for analysis of waste package and drip shield damage to vibratory motion in ''Structural Calculations of Waste Package Exposed to Vibratory Ground Motion'' (BSC 2004 [DIRS 167083]) and in ''Structural Calculations of Drip Shield Exposed to Vibratory Ground Motion'' (BSC 2003 [DIRS 163425]). The sampled values are indices representing the number of ground motion time histories, number of fracture patterns and rock mass properties categories. These indices are translated into actual values within the respective analysis and model reports or calculations. This report identifies the uncertain parameters and documents the sampled values for these parameters. The sampled values are determined by GoldSim V6.04.007 [DIRS 151202] calculations using appropriate distribution types and parameter ranges. No software development or model development was required for these calculations. The calculation of the sampled values allows parameter uncertainty to be incorporated into the rockfall and structural response calculations that support development of the seismic scenario for the

  6. SAMDIST: A Computer Code for Calculating Statistical Distributions for R-Matrix Resonance Parameters

    SciTech Connect

    Leal, L.C.

    1995-01-01

    The: SAMDIST computer code has been developed to calculate distribution of resonance parameters of the Reich-Moore R-matrix type. The program assumes the parameters are in the format compatible with that of the multilevel R-matrix code SAMMY. SAMDIST calculates the energy-level spacing distribution, the resonance width distribution, and the long-range correlation of the energy levels. Results of these calculations are presented in both graphic and tabular forms.

  7. Phase equilibrium calculations of ternary liquid mixtures with binary interaction parameters and molecular size parameters determined from molecular dynamics.

    PubMed

    Oh, Suk Yung; Bae, Young Chan

    2010-07-15

    The method presented in this paper was developed to predict liquid-liquid equilibria in ternary liquid mixtures by using a combination of a thermodynamic model and molecular dynamics simulations. In general, common classical thermodynamic models have many parameters which are determined by fitting a model with experimental data. This proposed method, however, provides a simple procedure for calculating liquid-liquid equilibria utilizing binary interaction parameters and molecular size parameters determined from molecular dynamics simulations. This method was applied to mixtures containing water, hydrocarbons, alcohols, chlorides, ketones, acids, and other organic liquids over various temperature ranges. The predicted results agree well with the experimental data without the use of adjustable parameters.

  8. Optimizing the Yb:YAG thin disc laser design parameters

    NASA Astrophysics Data System (ADS)

    Javadi-Dashcasan, M.; Hajiesmaeilbaigi, F.; Razzaghi, H.; Mahdizadeh, M.; Moghadam, M.

    2008-09-01

    Based on quasi-three-level system, a numerical model of continuous wave thin disc laser is proposed. The fluorescence concentration quenching (FCQ), refractive index depending concentration effects and temperature distribution in the gain medium have been taken into account in the model. The first and second phenomena are not included in previously models. The model is used to determine optimum design parameters and to calculate the influence of various parameters like temperature, number of pump beam passes, active ions concentration and the crystal thickness on the operational efficiency of the laser. This model shows that for higher doping concentrations (>15%) the optical efficiency is decreased due to fluorescence concentration quenching. Our results are excellently in agreement with experimental results.

  9. Design parameters and source terms: Volume 1, Design parameters: Revision 0

    SciTech Connect

    Not Available

    1987-09-01

    The Design Parameters and Source Terms Document was prepared in accordance with DOE request and to provide data for the environmental impact study to be performed in the future for the Deaf Smith County, Texas site for a nuclear waste repository in salt. This document updates a previous unpublished report to the level of the Site Characterization Plan - Conceptual Design Report, SCP-CDR. The previous unpublished SCC Study identified the data needs for the Environmental Assessment effort for seven possible salt repository sites.

  10. Calculating the mounting parameters for Taylor Spatial Frame correction using computed tomography.

    PubMed

    Kucukkaya, Metin; Karakoyun, Ozgur; Armagan, Raffi; Kuzgun, Unal

    2011-07-01

    The Taylor Spatial Frame uses a computer program-based six-axis deformity analysis. However, there is often a residual deformity after the initial correction, especially in deformities with a rotational component. This problem can be resolved by recalculating the parameters and inputting all new deformity and mounting parameters. However, this may necessitate repeated x-rays and delay treatment. We believe that error in the mounting parameters is the main reason for most residual deformities. To prevent these problems, we describe a new calculation technique for determining the mounting parameters that uses computed tomography. This technique is especially advantageous for deformities with a rotational component. Using this technique, exact calculation of the mounting parameters is possible and the residual deformity and number of repeated x-rays can be minimized. This new technique is an alternative method to accurately calculating the mounting parameters.

  11. Auxiliary subprograms for calculating the navigational parameters of artificial Earth satellites. FORTRAN IV

    NASA Technical Reports Server (NTRS)

    Prokhorenko, V. I.

    1981-01-01

    Subprograms for transforming coordinates and time, for determining the position of the Moon and Sun, and for calculating the atmosphere and disturbances, which are specified by anomalies of the Earth's gravitational field are described. The subprograms are written in FORTRAN IV and form a major part of the package of applied programs for calculating the navigational parameters of artificial Earth satellites.

  12. Tuning of fault tolerant control design parameters.

    PubMed

    DeLima, Pedro G; Yen, Gary G

    2008-01-01

    This paper presents two major contributions in the field of fault tolerant control. First, it gathers points of concern typical to most fault tolerant control applications and translates the chosen performance metrics into a set of six practical design specifications. Second, it proposes initialization and tuning procedures through which a particular fault tolerant control architecture not only can be set to comply with the required specifications, but also can be tuned online to compensate for a total of twelve properties, such as the noise rejection levels for fault detection and diagnosis signals. The proposed design is realized over a powerful architecture that combines the flexibility of adaptive critic designs with the long term memory and learning capabilities of a supervisor. This paper presents a practical design procedure to facilitate the applications of a fundamentally sound fault tolerant control architecture in real-world problems.

  13. On the Calculation of Uncertainty Statistics with Error Bounds for CFD Calculations Containing Random Parameters and Fields

    NASA Technical Reports Server (NTRS)

    Barth, Timothy J.

    2016-01-01

    This chapter discusses the ongoing development of combined uncertainty and error bound estimates for computational fluid dynamics (CFD) calculations subject to imposed random parameters and random fields. An objective of this work is the construction of computable error bound formulas for output uncertainty statistics that guide CFD practitioners in systematically determining how accurately CFD realizations should be approximated and how accurately uncertainty statistics should be approximated for output quantities of interest. Formal error bounds formulas for moment statistics that properly account for the presence of numerical errors in CFD calculations and numerical quadrature errors in the calculation of moment statistics have been previously presented in [8]. In this past work, hierarchical node-nested dense and sparse tensor product quadratures are used to calculate moment statistics integrals. In the present work, a framework has been developed that exploits the hierarchical structure of these quadratures in order to simplify the calculation of an estimate of the quadrature error needed in error bound formulas. When signed estimates of realization error are available, this signed error may also be used to estimate output quantity of interest probability densities as a means to assess the impact of realization error on these density estimates. Numerical results are presented for CFD problems with uncertainty to demonstrate the capabilities of this framework.

  14. Calculation of statistic estimates of kinetic parameters from substrate uncompetitive inhibition equation using the median method.

    PubMed

    Valencia, Pedro L; Astudillo-Castro, Carolina; Gajardo, Diego; Flores, Sebastián

    2017-04-01

    We provide initial rate data from enzymatic reaction experiments and tis processing to estimate the kinetic parameters from the substrate uncompetitive inhibition equation using the median method published by Eisenthal and Cornish-Bowden (Cornish-Bowden and Eisenthal, 1974; Eisenthal and Cornish-Bowden, 1974). The method was denominated the direct linear plot and consists in the calculation of the median from a dataset of kinetic parameters Vmax and Km from the Michaelis-Menten equation. In this opportunity we present the procedure to applicate the direct linear plot to the substrate uncompetitive inhibition equation; a three-parameter equation. The median method is characterized for its robustness and its insensibility to outlier. The calculations are presented in an Excel datasheet and a computational algorithm was developed in the free software Python. The kinetic parameters of the substrate uncompetitive inhibition equation Vmax , Km and Ks were calculated using three experimental points from the dataset formed by 13 experimental points. All the 286 combinations were calculated. The dataset of kinetic parameters resulting from this combinatorial was used to calculate the median which corresponds to the statistic estimator of the real kinetic parameters. A comparative statistical analyses between the median method and the least squares was published in Valencia et al. [3].

  15. Propagation of Uncertainty in System Parameters of a LWR Model by Sampling MCNPX Calculations - Burnup Analysis

    NASA Astrophysics Data System (ADS)

    Campolina, Daniel de A. M.; Lima, Claubia P. B.; Veloso, Maria Auxiliadora F.

    2014-06-01

    For all the physical components that comprise a nuclear system there is an uncertainty. Assessing the impact of uncertainties in the simulation of fissionable material systems is essential for a best estimate calculation that has been replacing the conservative model calculations as the computational power increases. The propagation of uncertainty in a simulation using a Monte Carlo code by sampling the input parameters is recent because of the huge computational effort required. In this work a sample space of MCNPX calculations was used to propagate the uncertainty. The sample size was optimized using the Wilks formula for a 95th percentile and a two-sided statistical tolerance interval of 95%. Uncertainties in input parameters of the reactor considered included geometry dimensions and densities. It was showed the capacity of the sampling-based method for burnup when the calculations sample size is optimized and many parameter uncertainties are investigated together, in the same input.

  16. Experimental Design and Power Calculation for RNA-seq Experiments.

    PubMed

    Wu, Zhijin; Wu, Hao

    2016-01-01

    Power calculation is a critical component of RNA-seq experimental design. The flexibility of RNA-seq experiment and the wide dynamic range of transcription it measures make it an attractive technology for whole transcriptome analysis. These features, in addition to the high dimensionality of RNA-seq data, bring complexity in experimental design, making an analytical power calculation no longer realistic. In this chapter we review the major factors that influence the statistical power of detecting differential expression, and give examples of power assessment using the R package PROPER.

  17. Robust design of configurations and parameters of adaptable products

    NASA Astrophysics Data System (ADS)

    Zhang, Jian; Chen, Yongliang; Xue, Deyi; Gu, Peihua

    2014-03-01

    An adaptable product can satisfy different customer requirements by changing its configuration and parameter values during the operation stage. Design of adaptable products aims at reducing the environment impact through replacement of multiple different products with single adaptable ones. Due to the complex architecture, multiple functional requirements, and changes of product configurations and parameter values in operation, impact of uncertainties to the functional performance measures needs to be considered in design of adaptable products. In this paper, a robust design approach is introduced to identify the optimal design configuration and parameters of an adaptable product whose functional performance measures are the least sensitive to uncertainties. An adaptable product in this paper is modeled by both configurations and parameters. At the configuration level, methods to model different product configuration candidates in design and different product configuration states in operation to satisfy design requirements are introduced. At the parameter level, four types of product/operating parameters and relations among these parameters are discussed. A two-level optimization approach is developed to identify the optimal design configuration and its parameter values of the adaptable product. A case study is implemented to illustrate the effectiveness of the newly developed robust adaptable design method.

  18. The effect of different calculation methods of flywheel parameters on the Wingate Anaerobic Test.

    PubMed

    Coleman, S G; Hale, T

    1998-08-01

    Researchers compared different methods of calculating kinetic parameters of friction-braked cycle ergometers, and the subsequent effects on calculating power outputs in the Wingate Anaerobic Test (WAnT). Three methods of determining flywheel moment of inertia and frictional torque were investigated, requiring "run-down" tests and segmental geometry. Parameters were used to calculate corrected power outputs from 10 males in a 30-s WAnT against a load related to body mass (0.075 kg.kg-1). Wingate Indices of maximum (5 s) power, work, and fatigue index were also compared. Significant differences were found between uncorrected and corrected power outputs and between correction methods (p < .05). The same finding was evident for all Wingate Indices (p < .05). Results suggest that WAnT must be corrected to give true power outputs and that choosing an appropriate correction calculation is important. Determining flywheel moment of inertia and frictional torque using unloaded run-down tests is recommended.

  19. Multiobjective insensitive design of airplane control systems with uncertain parameters

    NASA Technical Reports Server (NTRS)

    Schy, A. A.; Giesy, D. P.

    1981-01-01

    A multiobjective computer-aided design algorithm has been developed which minimizes the sensitivity of the design objectives to uncertainties in system parameters. The more important uncertain parameters are described by a gaussian random vector with known covariance matrix, and a vector sensitivity objective function is defined as the probabilities that the design objectives will violate specified requirements constraints. Control system parameters are found which minimize the sensitivity vector in a Pareto-optimal sense, using constrained minimization algorithms. Example results are shown for lateral stability augmentation system (SAS) design for three Shuttle flight conditions.

  20. Method for calculating the parameters of formation of hydrates from multicomponent gases

    NASA Astrophysics Data System (ADS)

    Zaporozhets, E. P.; Shostak, N. A.

    2016-09-01

    A model of hydrate formation in multicomponent gas-liquid water or ice systems including the exo- and endothermic processes has been suggested. Based on this model, a method for calculating the molecular and energy parameters such as the hydration number, amount of moles of hydrate, amount of gas and water in it, its density and molar mass, and the energy and rate of hydrate formation was developed. A comparison of the calculated and experimental values of the parameters revealed that the difference between them varied from 0 to 5.46%.

  1. Tuning Parameters in Heuristics by Using Design of Experiments Methods

    NASA Technical Reports Server (NTRS)

    Arin, Arif; Rabadi, Ghaith; Unal, Resit

    2010-01-01

    With the growing complexity of today's large scale problems, it has become more difficult to find optimal solutions by using exact mathematical methods. The need to find near-optimal solutions in an acceptable time frame requires heuristic approaches. In many cases, however, most heuristics have several parameters that need to be "tuned" before they can reach good results. The problem then turns into "finding best parameter setting" for the heuristics to solve the problems efficiently and timely. One-Factor-At-a-Time (OFAT) approach for parameter tuning neglects the interactions between parameters. Design of Experiments (DOE) tools can be instead employed to tune the parameters more effectively. In this paper, we seek the best parameter setting for a Genetic Algorithm (GA) to solve the single machine total weighted tardiness problem in which n jobs must be scheduled on a single machine without preemption, and the objective is to minimize the total weighted tardiness. Benchmark instances for the problem are available in the literature. To fine tune the GA parameters in the most efficient way, we compare multiple DOE models including 2-level (2k ) full factorial design, orthogonal array design, central composite design, D-optimal design and signal-to-noise (SIN) ratios. In each DOE method, a mathematical model is created using regression analysis, and solved to obtain the best parameter setting. After verification runs using the tuned parameter setting, the preliminary results for optimal solutions of multiple instances were found efficiently.

  2. Novel parameter-based flexure bearing design method

    NASA Astrophysics Data System (ADS)

    Amoedo, Simon; Thebaud, Edouard; Gschwendtner, Michael; White, David

    2016-06-01

    A parameter study was carried out on the design variables of a flexure bearing to be used in a Stirling engine with a fixed axial displacement and a fixed outer diameter. A design method was developed in order to assist identification of the optimum bearing configuration. This was achieved through a parameter study of the bearing carried out with ANSYS®. The parameters varied were the number and the width of the arms, the thickness of the bearing, the eccentricity, the size of the starting and ending holes, and the turn angle of the spiral. Comparison was made between the different designs in terms of axial and radial stiffness, the natural frequency, and the maximum induced stresses. Moreover, the Finite Element Analysis (FEA) was compared to theoretical results for a given design. The results led to a graphical design method which assists the selection of flexure bearing geometrical parameters based on pre-determined geometric and material constraints.

  3. Calculation of electron-beam induced displacement in thin films by using parameter-reduced formulas

    NASA Astrophysics Data System (ADS)

    Yan, Qiang; Chen, Di; Wang, Qingyu; Li, Zhongyu; Shao, Lin

    2017-03-01

    Based on the Mott cross sections of relativistic electron collisions with atoms, we calculate displacement creation by electron beams of arbitrary energies (up to 100 MeV) in thin films of arbitrary atomic numbers (up to Z = 90). In a comparison with Mont Carlo full damage cascade simulations, we find that total number of displacements in a film can be accurately estimated as the product of average displacements created per collision and average collision numbers in the film. To calculate average displacements per electron-atom collision, energy transfer from Mott cross section is combined with NRT model. To calculate collision numbers, mean deflection angles and multi-scattering theory are combined to extract collision number dependence on film thickness. For each key parameter, parameter-reduced formulas are obtained from data fitting. The fitting formulas provide a quick and accurate method to estimate radiation damage caused by electron beams.

  4. Improved Coefficient Calculator for the California Energy Commission 6 Parameter Photovoltaic Module Model

    SciTech Connect

    Dobos, A. P.

    2012-05-01

    This paper describes an improved algorithm for calculating the six parameters required by the California Energy Commission (CEC) photovoltaic (PV) Calculator module model. Rebate applications in California require results from the CEC PV model, and thus depend on an up-to-date database of module characteristics. Currently, adding new modules to the database requires calculating operational coefficients using a general purpose equation solver - a cumbersome process for the 300+ modules added on average every month. The combination of empirical regressions and heuristic methods presented herein achieve automated convergence for 99.87% of the 5487 modules in the CEC database and greatly enhance the accuracy and efficiency by which new modules can be characterized and approved for use. The added robustness also permits general purpose use of the CEC/6 parameter module model by modelers and system analysts when standard module specifications are known, even if the module does not exist in a preprocessed database.

  5. Mission design applications of QUICK. [software for interactive trajectory calculation

    NASA Technical Reports Server (NTRS)

    Skinner, David L.; Bass, Laura E.; Byrnes, Dennis V.; Cheng, Jeannie T.; Fordyce, Jess E.; Knocke, Philip C.; Lyons, Daniel T.; Pojman, Joan L.; Stetson, Douglas S.; Wolf, Aron A.

    1990-01-01

    An overview of an interactive software environment for space mission design termed QUICK is presented. This stand-alone program provides a programmable FORTRAN-like calculator interface to a wide range of both built-in and user defined functions. QUICK has evolved into a general-purpose software environment that can be intrinsically and dynamically customized for a wide range of mission design applications. Specific applications are described for some space programs, e.g., the earth-Venus-Mars mission, the Cassini mission to Saturn, the Mars Observer, the Galileo Project, and the Magellan Spacecraft.

  6. RIPL - Reference Input Parameter Library for Calculation of Nuclear Reactions and Nuclear Data Evaluations

    NASA Astrophysics Data System (ADS)

    Capote, R.; Herman, M.; Obložinský, P.; Young, P. G.; Goriely, S.; Belgya, T.; Ignatyuk, A. V.; Koning, A. J.; Hilaire, S.; Plujko, V. A.; Avrigeanu, M.; Bersillon, O.; Chadwick, M. B.; Fukahori, T.; Ge, Zhigang; Han, Yinlu; Kailas, S.; Kopecky, J.; Maslov, V. M.; Reffo, G.; Sin, M.; Soukhovitskii, E. Sh.; Talou, P.

    2009-12-01

    We describe the physics and data included in the Reference Input Parameter Library, which is devoted to input parameters needed in calculations of nuclear reactions and nuclear data evaluations. Advanced modelling codes require substantial numerical input, therefore the International Atomic Energy Agency (IAEA) has worked extensively since 1993 on a library of validated nuclear-model input parameters, referred to as the Reference Input Parameter Library (RIPL). A final RIPL coordinated research project (RIPL-3) was brought to a successful conclusion in December 2008, after 15 years of challenging work carried out through three consecutive IAEA projects. The RIPL-3 library was released in January 2009, and is available on the Web through http://www-nds.iaea.org/RIPL-3/. This work and the resulting database are extremely important to theoreticians involved in the development and use of nuclear reaction modelling (ALICE, EMPIRE, GNASH, UNF, TALYS) both for theoretical research and nuclear data evaluations. The numerical data and computer codes included in RIPL-3 are arranged in seven segments: MASSES contains ground-state properties of nuclei for about 9000 nuclei, including three theoretical predictions of masses and the evaluated experimental masses of Audi et al. (2003). DISCRETE LEVELS contains 117 datasets (one for each element) with all known level schemes, electromagnetic and γ-ray decay probabilities available from ENSDF in October 2007. NEUTRON RESONANCES contains average resonance parameters prepared on the basis of the evaluations performed by Ignatyuk and Mughabghab. OPTICAL MODEL contains 495 sets of phenomenological optical model parameters defined in a wide energy range. When there are insufficient experimental data, the evaluator has to resort to either global parameterizations or microscopic approaches. Radial density distributions to be used as input for microscopic calculations are stored in the MASSES segment. LEVEL DENSITIES contains

  7. [Specific parameters for the calculation of dose after aerosol inhalation of transuranium elements].

    PubMed

    Ramounet-Le Gall, B; Fritsch, P; Abram, M C; Rateau, G; Grillon, G; Guillet, K; Baude, S; Bérard, P; Ansoborlo, E; Delforge, J

    2002-07-01

    A review on specific parameter measurements to calculate doses per unit of incorporation according to recommendations of the International Commission of Radiological Protection has been performed for inhaled actinide oxides. Alpha activity distribution of the particles can be obtained by autoradiography analysis using aerosol sampling filters at the work places. This allows us to characterize granulometric parameters of "pure" actinide oxides, but complementary analysis by scanning electron microscopy is needed for complex aerosols. Dissolution parameters with their standard deviation are obtained after rat inhalation exposure, taking into account both mechanical lung clearance and actinide transfer to the blood estimated from bone retention. In vitro experiments suggest that the slow dissolution rate might decrease as a function of time following exposure. Dose calculation software packages have been developed to take into account granulometry and dissolution parameters as well as specific physiological parameters of exposed individuals. In the case of poorly soluble actinide oxides, granulometry and physiology appear as the main parameters controlling dose value, whereas dissolution only alters dose distribution. Validation of these software packages are in progress.

  8. Development of a Software Tool for Calculating Transmission Line Parameters and Updating Related Databases

    NASA Astrophysics Data System (ADS)

    Xiu, Wanjing; Liao, Yuan

    2014-12-01

    Transmission lines are essential components of electric power grids. Diverse power system applications and simulation based studies require transmission line parameters including series resistance, reactance, and shunt susceptance, and accurate parameters are pivotal in ensuring the accuracy of analyses and reliable system operation. Commercial software packages for performing power system studies usually have their own databases that store the power system model including line parameters. When there is a physical system model change, the corresponding component in the database of the software packages will need to be modified. Manually updating line parameters are tedious and error-prone. This paper proposes a solution for streamlining the calculation of line parameters and updating of their values in respective software databases. The algorithms used for calculating the values of line parameters are described. The software developed for implementing the solution is described, and typical results are presented. The proposed solution is developed for a utility and has a potential to be put into use by other utilities.

  9. Use Of Programmable Calculators In Lens Design And Analysis

    NASA Astrophysics Data System (ADS)

    Beckmann, Leo H.

    1983-10-01

    For several years the hand-held programmable calculator has been known to be an attractive tool for solving some relatively simple problems in optical computation, such as general ray tracing, first order optics and optical system analysis. The range of application can however, be extended far beyond this level and includes the semi-automatic design of unsophisticated optical imaging systems such as the air-spaced doublet and the Cooke triplet, for which examples are presented. In view of the limitations in the number of program steps, it is mandatory to implement such programs with utmost economy of use of these program steps and to utilize the inherent properties of these optical systems in order to obtain convergence in the automatic design. improvement part of the programs. While the most appropriate application may be in supporting the teaching of elementary lens design, these calculator programs can be quite helpful if relatively simple optical systems have to be designed without as access to a large computer facility and associated software.

  10. Programmable Calculators: Their Use In Lens Design And Analysis

    NASA Astrophysics Data System (ADS)

    Beckmann, Leo H. J. F.

    1985-08-01

    For several years the hand-held programmable calculator has been known to be an attractive tool for solving some relatively simple problems in optical computation, such as general ray tracing, first-order optics, and optical system analysis. The range of application, however, can be extended far beyond this level and includes the semiautomatic design of unsophisticated optical imaging systems such as the air-spaced doublet and the Cooke triplet, for which examples are presented. In view of the limitations in the number of program steps, it is mandatory to implement such programs with utmost economy of use of these program steps and to utilize the inherent properties of these optical systems in order to obtain convergence in the automatic design improvement part of the programs. While the most appropriate application may be in support-ing the teaching of elementary lens design, these calculator programs can be quite helpful if relatively simple optical systems have to be designed without easy access to a large computer facility and associated software.

  11. Hybrid functional calculations on the band gap bowing parameters of In x Ga1-x N

    NASA Astrophysics Data System (ADS)

    Mei, Lin; Yixu, Xu; Jianhua, Zhang; Shunqing, Wu; Zizhong, Zhu

    2016-04-01

    The electronic band structures and band gap bowing parameters of In x Ga1-x N are studied by the first-principles method based on the density functional theory. Calculations by employing both the Heyd-Scuseria-Ernzerh of hybrid functional (HSE06) and the Perdew-Burke-Ernzerhof (PBE) one are performed. We found that the theoretical band gap bowing parameter is dependent significantly on the calculation method, especially on the exchange-correlation functional employed in the DFT calculations. The band gap of In x Ga1-x N alloy decreases considerably when the In constituent x increases. It is the interactions of s-s and p-p orbitals between anions and cations that play significant roles in formatting the band gaps bowing. In general, the HSE06 hybrid functional could provide a good alternative to the PBE functional in calculating the band gap bowing parameters. Project supported by the National Natural Science Foundation of China (Nos. 11204257, 21233004) and the China Postdoctoral Science Foundation (No. 2012M511447).

  12. Integration based profile likelihood calculation for PDE constrained parameter estimation problems

    NASA Astrophysics Data System (ADS)

    Boiger, R.; Hasenauer, J.; Hroß, S.; Kaltenbacher, B.

    2016-12-01

    Partial differential equation (PDE) models are widely used in engineering and natural sciences to describe spatio-temporal processes. The parameters of the considered processes are often unknown and have to be estimated from experimental data. Due to partial observations and measurement noise, these parameter estimates are subject to uncertainty. This uncertainty can be assessed using profile likelihoods, a reliable but computationally intensive approach. In this paper, we present the integration based approach for the profile likelihood calculation developed by (Chen and Jennrich 2002 J. Comput. Graph. Stat. 11 714-32) and adapt it to inverse problems with PDE constraints. While existing methods for profile likelihood calculation in parameter estimation problems with PDE constraints rely on repeated optimization, the proposed approach exploits a dynamical system evolving along the likelihood profile. We derive the dynamical system for the unreduced estimation problem, prove convergence and study the properties of the integration based approach for the PDE case. To evaluate the proposed method, we compare it with state-of-the-art algorithms for a simple reaction-diffusion model for a cellular patterning process. We observe a good accuracy of the method as well as a significant speed up as compared to established methods. Integration based profile calculation facilitates rigorous uncertainty analysis for computationally demanding parameter estimation problems with PDE constraints.

  13. Total energy control system autopilot design with constrained parameter optimization

    NASA Technical Reports Server (NTRS)

    Ly, Uy-Loi; Voth, Christopher

    1990-01-01

    A description is given of the application of a multivariable control design method (SANDY) based on constrained parameter optimization to the design of a multiloop aircraft flight control system. Specifically, the design method is applied to the direct synthesis of a multiloop AFCS inner-loop feedback control system based on total energy control system (TECS) principles. The design procedure offers a structured approach for the determination of a set of stabilizing controller design gains that meet design specifications in closed-loop stability, command tracking performance, disturbance rejection, and limits on control activities. The approach can be extended to a broader class of multiloop flight control systems. Direct tradeoffs between many real design goals are rendered systematic by proper formulation of the design objectives and constraints. Satisfactory designs are usually obtained in few iterations. Performance characteristics of the optimized TECS design have been improved, particularly in the areas of closed-loop damping and control activity in the presence of turbulence.

  14. Sequential ensemble-based optimal design for parameter estimation

    NASA Astrophysics Data System (ADS)

    Man, Jun; Zhang, Jiangjiang; Li, Weixuan; Zeng, Lingzao; Wu, Laosheng

    2016-10-01

    The ensemble Kalman filter (EnKF) has been widely used in parameter estimation for hydrological models. The focus of most previous studies was to develop more efficient analysis (estimation) algorithms. On the other hand, it is intuitively understandable that a well-designed sampling (data-collection) strategy should provide more informative measurements and subsequently improve the parameter estimation. In this work, a Sequential Ensemble-based Optimal Design (SEOD) method, coupled with EnKF, information theory and sequential optimal design, is proposed to improve the performance of parameter estimation. Based on the first-order and second-order statistics, different information metrics including the Shannon entropy difference (SD), degrees of freedom for signal (DFS) and relative entropy (RE) are used to design the optimal sampling strategy, respectively. The effectiveness of the proposed method is illustrated by synthetic one-dimensional and two-dimensional unsaturated flow case studies. It is shown that the designed sampling strategies can provide more accurate parameter estimation and state prediction compared with conventional sampling strategies. Optimal sampling designs based on various information metrics perform similarly in our cases. The effect of ensemble size on the optimal design is also investigated. Overall, larger ensemble size improves the parameter estimation and convergence of optimal sampling strategy. Although the proposed method is applied to unsaturated flow problems in this study, it can be equally applied in any other hydrological problems.

  15. k.p Parameters with Accuracy Control from Preexistent First-Principles Band Structure Calculations

    NASA Astrophysics Data System (ADS)

    Sipahi, Guilherme; Bastos, Carlos M. O.; Sabino, Fernando P.; Faria Junior, Paulo E.; de Campos, Tiago; da Silva, Juarez L. F.

    The k.p method is a successful approach to obtain band structure, optical and transport properties of semiconductors. It overtakes the ab initio methods in confined systems due to its low computational cost since it is a continuum method that does not require all the atoms' orbital information. From an effective one-electron Hamiltonian, the k.p matrix representation can be calculated using perturbation theory and the parameters identified by symmetry arguments. The parameters determination, however, needs a complementary approach. In this paper, we developed a general method to extract the k.p parameters from preexistent band structures of bulk materials that is not limited by the crystal symmetry or by the model. To demonstrate our approach, we applied it to zinc blende GaAs band structure calculated by hybrid density functional theory within the Heyd-Scuseria-Ernzerhof functional (DFT-HSE), for the usual 8 ×8 k.p Hamiltonian. Our parameters reproduced the DFT-HSE band structure with great accuracy up to 20% of the first Brillouin zone (FBZ). Furthermore, for fitting regions ranging from 7-20% of FBZ, the parameters lie inside the range of values reported by the most reliable studies in the literature. The authors acknowledge financial support from the Brazilian agencies CNPq (Grant #246549/2012-2) and FAPESP (Grants #2011/19333-4, #2012/05618-0 and #2013/23393-8).

  16. Thermodynamics calculation of protein-ligand interactions by QM/MM polarizable charge parameters.

    PubMed

    Wang, Jinan; Shao, Qiang; Cossins, Benjamin P; Shi, Jiye; Chen, Kaixian; Zhu, Weiliang

    2016-01-01

    The calculation of protein-ligand binding free energy (ΔG) is of great importance for virtual screening and drug design. Molecular dynamics (MD) simulation has been an attractive tool to investigate this scientific problem. However, the reliability of such approach is affected by many factors including electrostatic interaction calculation. Here, we present a practical protocol using quantum mechanics/molecular mechanics (QM/MM) calculations to generate polarizable QM protein charge (QMPC). The calculated QMPC of some atoms in binding pockets was obviously different from that calculated by AMBER ff03, which might significantly affect the calculated ΔG. To evaluate the effect, the MD simulations and MM/GBSA calculation with QMPC for 10 protein-ligand complexes, and the simulation results were then compared to those with the AMBER ff03 force field and experimental results. The correlation coefficient between the calculated ΔΔG using MM/GBSA under QMPC and the experimental data is .92, while that with AMBER ff03 force field is .47 for the complexes formed by streptavidin or its mutants and biotin. Moreover, the calculated ΔΔG with QMPC for the complexes formed by ERβ and five ligands is positively related to experimental result with correlation coefficient of .61, while that with AMBER ff03 charge is negatively related to experimental data with correlation coefficient of .42. The detailed analysis shows that the electrostatic polarization introduced by QMPC affects the electrostatic contribution to the binding affinity and thus, leads to better correlation with experimental data. Therefore, this approach should be useful to virtual screening and drug design.

  17. Loss of Information in Estimating Item Parameters in Incomplete Designs

    ERIC Educational Resources Information Center

    Eggen, Theo J. H. M.; Verelst, Norman D.

    2006-01-01

    In this paper, the efficiency of conditional maximum likelihood (CML) and marginal maximum likelihood (MML) estimation of the item parameters of the Rasch model in incomplete designs is investigated. The use of the concept of F-information (Eggen, 2000) is generalized to incomplete testing designs. The scaled determinant of the F-information…

  18. The calculation of some gamma shielding parameters for semiconductor CsPbBr3

    NASA Astrophysics Data System (ADS)

    Oto, Berna; Gulebaglan, Sinem Erden; Kanberoglu, Gulsah Saydan

    2017-02-01

    Recently, researchers produced perovskites structures used in optoelectronic devices as substrates, sensors. CsPbBr3 crystal is found in the cubic perovskite structure and its space group is Pm-3m. CsPbBr3 is a developing material for detection of X- and γ-ray radiations and the knowledge of the attenuation parameters of CsPbBr3 crystal is important. In this study, some photon shielding parameters such as mass attenuation coefficient (μρ), effective atomic number (Zeff) and electron density (Nel) have been investigated for CsPbBr3 compound. The theoretical values of μρ have been calculated in the energy range from 1 keV to 100 GeV using WinXCom computer code and these values have been used in order to calculate the values of Zeff and Nel in the same energy range.

  19. An investigation on the catalytic capacity of dolomite in transesterification and the calculation of kinetic parameters.

    PubMed

    Niu, Sheng-Li; Huo, Meng-Jia; Lu, Chun-Mei; Liu, Meng-Qi; Li, Hui

    2014-04-01

    The catalytic capacity of dolomite in transesterification was investigated and the kinetic parameters were calculated. The activated dolomites as transesterification catalyst were characterized by X-ray diffraction, nitrogen adsorption and desorption and Hammett indicator method, where the original dolomite was analyzed by thermogravimetric and X-ray fluorescence in advance. Its potential catalytic capacity was validated from aspects of the activated temperature and the reused property, where the reliability of the experimental system was also examined. Then, influences of the catalyst added amount, the mole ratio of methanol to oil, the transesterification temperature and the transesterification time on the catalytic capacity were investigated. Finally, kinetic parameters of the transesterification catalyzed by the activated dolomite were calculated.

  20. Determination of representative dimension parameter values of Korean knee joints for knee joint implant design.

    PubMed

    Kwak, Dai Soon; Tao, Quang Bang; Todo, Mitsugu; Jeon, Insu

    2012-05-01

    Knee joint implants developed by western companies have been imported to Korea and used for Korean patients. However, many clinical problems occur in knee joints of Korean patients after total knee joint replacement owing to the geometric mismatch between the western implants and Korean knee joint structures. To solve these problems, a method to determine the representative dimension parameter values of Korean knee joints is introduced to aid in the design of knee joint implants appropriate for Korean patients. Measurements of the dimension parameters of 88 male Korean knee joint subjects were carried out. The distribution of the subjects versus each measured parameter value was investigated. The measured dimension parameter values of each parameter were grouped by suitable intervals called the "size group," and average values of the size groups were calculated. The knee joint subjects were grouped as the "patient group" based on "size group numbers" of each parameter. From the iterative calculations to decrease the errors between the average dimension parameter values of each "patient group" and the dimension parameter values of the subjects, the average dimension parameter values that give less than the error criterion were determined to be the representative dimension parameter values for designing knee joint implants for Korean patients.

  1. Accuracy of theoretical calculations of the main parameters of the F2-layer of the daytime ionosphere

    NASA Astrophysics Data System (ADS)

    Pavlov, A. V.; Sitnov, Iu. S.

    1985-10-01

    Pavlov's (1984) method is used to determine the relative errors (due to errors in measuring the input parameters of the model) in theoretical calculations of the main parameters of the daytime F2-layer under quiet conditions. The parameters calculated are the height of the F2-layer maximum and the electron density.

  2. Design parameters and source terms: Volume 3, Source terms

    SciTech Connect

    Not Available

    1987-10-01

    The Design Parameters and Source Terms Document was prepared in accordance with DOE request and to provide data for the environmental impact study to be performed in the future for the Deaf Smith County, Texas site for a nuclear waste repository in salt. This document updates a previous unpublished report by Stearns Catalytic Corporation (SCC), entitled ''Design Parameters and Source Terms for a Two-Phase Repository in Salt,'' 1985, to the level of the Site Characterization Plan - Conceptual Design Report. The previous unpublished SCC Study identifies the data needs for the Environmental Assessment effort for seven possible Salt Repository sites. 11 refs., 9 tabs.

  3. Parameter-free effective field theory calculation for the solar proton-fusion and hep processes

    SciTech Connect

    T.S. Park; L.E. Marcucci; R. Schiavilla; M. Viviani; A. Kievsky; S. Rosati; K. Kubodera; D.P. Min; M. Rho

    2002-08-01

    Spurred by the recent complete determination of the weak currents in two-nucleon systems up to {Omicron}(Q{sup 3}) in heavy-baryon chiral perturbation theory, we carry out a parameter-free calculation of the threshold S-factors for the solar pp (proton-fusion) and hep processes in an effective field theory that combines the merits of the standard nuclear physics method and systematic chiral expansion. The power of the EFT adopted here is that one can correlate in a unified formalism the weak-current matrix elements of two-, three- and four-nucleon systems. Using the tritium {beta}-decay rate as an input to fix the only unknown parameter in the theory, we can evaluate the threshold S factors with drastically improved precision; the results are S{sub pp}(0) = 3.94 x (1 {+-} 0.004) x 10{sup -25} MeV-b and S{sub hep}(0) = (8.6 {+-} 1.3) x 10{sup -20} keV-b. The dependence of the calculated S-factors on the momentum cutoff parameter {Lambda} has been examined for a physically reasonable range of {Lambda}. This dependence is found to be extremely small for the pp process, and to be within acceptable levels for the hep process, substantiating the consistency of our calculational scheme.

  4. Calculation of pressure broadening parameters for the CO-He system at low temperatures

    NASA Technical Reports Server (NTRS)

    Green, S.

    1985-01-01

    Theoretical pressure broadening parameters were computed for the 0-1 and 1-2 rotational transitions of CO in He at very low temperatures and compared with the recent experimental measurements at 4.2 K. The interaction potential was taken from extensive SCF-CI calculations, molecular collision dynamics were described by essentially exact converged close coupling calculations, and pressure broadening cross sections were obtained from the collisional S matrices within the accurate Fano-Ben Reuven framework. Resonances at low collision energies give rise to an increase in the thermally averaged cross sections at low temperatures. Although previous calculations for this system at higher temperatures (77-300 K) were in good accord with experiment, at 4.2 K predicted values are about two times larger than experiment; possible sources of this discrepancy are discussed.

  5. Ab initio crystal structure prediction of magnesium (poly)sulfides and calculation of their NMR parameters.

    PubMed

    Mali, Gregor

    2017-03-01

    Ab initio prediction of sensible crystal structures can be regarded as a crucial task in the quickly-developing methodology of NMR crystallography. In this contribution, an evolutionary algorithm was used for the prediction of magnesium (poly)sulfide crystal structures with various compositions. The employed approach successfully identified all three experimentally detected forms of MgS, i.e. the stable rocksalt form and the metastable wurtzite and zincblende forms. Among magnesium polysulfides with a higher content of sulfur, the most probable structure with the lowest formation energy was found to be MgS2, exhibiting a modified rocksalt structure, in which S(2-) anions were replaced by S2(2-) dianions. Magnesium polysulfides with even larger fractions of sulfur were not predicted to be stable. For the lowest-energy structures, (25)Mg quadrupolar coupling constants and chemical shift parameters were calculated using the density functional theory approach. The calculated NMR parameters could be well rationalized by the symmetries of the local magnesium environments, by the coordination of magnesium cations and by the nature of the surrounding anions. In the future, these parameters could serve as a reference for the experimentally determined (25)Mg NMR parameters of magnesium sulfide species.

  6. Monte Carlo Method for Determining Earthquake Recurrence Parameters from Short Paleoseismic Catalogs: Example Calculations for California

    USGS Publications Warehouse

    Parsons, Tom

    2008-01-01

    Paleoearthquake observations often lack enough events at a given site to directly define a probability density function (PDF) for earthquake recurrence. Sites with fewer than 10-15 intervals do not provide enough information to reliably determine the shape of the PDF using standard maximum-likelihood techniques [e.g., Ellsworth et al., 1999]. In this paper I present a method that attempts to fit wide ranges of distribution parameters to short paleoseismic series. From repeated Monte Carlo draws, it becomes possible to quantitatively estimate most likely recurrence PDF parameters, and a ranked distribution of parameters is returned that can be used to assess uncertainties in hazard calculations. In tests on short synthetic earthquake series, the method gives results that cluster around the mean of the input distribution, whereas maximum likelihood methods return the sample means [e.g., NIST/SEMATECH, 2006]. For short series (fewer than 10 intervals), sample means tend to reflect the median of an asymmetric recurrence distribution, possibly leading to an overestimate of the hazard should they be used in probability calculations. Therefore a Monte Carlo approach may be useful for assessing recurrence from limited paleoearthquake records. Further, the degree of functional dependence among parameters like mean recurrence interval and coefficient of variation can be established. The method is described for use with time-independent and time-dependent PDF?s, and results from 19 paleoseismic sequences on strike-slip faults throughout the state of California are given.

  7. Monte Carlo method for determining earthquake recurrence parameters from short paleoseismic catalogs: Example calculations for California

    USGS Publications Warehouse

    Parsons, T.

    2008-01-01

    Paleoearthquake observations often lack enough events at a given site to directly define a probability density function (PDF) for earthquake recurrence. Sites with fewer than 10-15 intervals do not provide enough information to reliably determine the shape of the PDF using standard maximum-likelihood techniques (e.g., Ellsworth et al., 1999). In this paper I present a method that attempts to fit wide ranges of distribution parameters to short paleoseismic series. From repeated Monte Carlo draws, it becomes possible to quantitatively estimate most likely recurrence PDF parameters, and a ranked distribution of parameters is returned that can be used to assess uncertainties in hazard calculations. In tests on short synthetic earthquake series, the method gives results that cluster around the mean of the input distribution, whereas maximum likelihood methods return the sample means (e.g., NIST/SEMATECH, 2006). For short series (fewer than 10 intervals), sample means tend to reflect the median of an asymmetric recurrence distribution, possibly leading to an overestimate of the hazard should they be used in probability calculations. Therefore a Monte Carlo approach may be useful for assessing recurrence from limited paleoearthquake records. Further, the degree of functional dependence among parameters like mean recurrence interval and coefficient of variation can be established. The method is described for use with time-independent and time-dependent PDFs, and results from 19 paleoseismic sequences on strike-slip faults throughout the state of California are given.

  8. Respirometric kinetic parameter calculations of a batch jet loop bioreactor treating leachate and oxygen uptake rate estimation by DTM.

    PubMed

    Ince, M; Yildiz, F; Engin, G Onkal; Engin, S N; Keskinler, B

    2008-05-30

    A novel circulating jet loop bioreactor adapted for organic matter oxidation has been designed and constructed. In this study, the input was leachate samples collected from Kemerburgaz Odayeri waste landfill site located on the European side of Istanbul. Controlling the jet loop bioreactor to realize high rates of purification depends on maintaining the appropriate loadings and operating conditions. This requires collecting various system data to estimate the dynamics of the system satisfactorily with the aim of keeping certain parameters within the specified range. The differential transform method (DTM) based solution of the state equations reveals the current state of the process so that any deviation in the system parameters can be immediately detected and regulated accordingly. The respirometric method for kinetic parameter calculations for biodegradation has been used for some time. In many studies, the respirometer was designed separately, usually in bench-scale. However, when a separate respirometer is used, the scale effect and parameters that affect the hydrodynamic structure of the system should be taken into consideration. In this study, therefore, the jet loop reactor itself was used as a respirometer. Thus, the kinetic parameters found reflecting the characteristics of microorganisms used for biodegradation would be more realistic. If the main reactor, here the jet loop reactor, would be used as the respirometer, the kinetic parameter changes can easily be monitored in the long run. Using the bioreactor as a respirometer, the most important kinetic parameters, Ks, kd and micromax were found to be 11,000 mg L(-1), 0.019 day(-1), and 0.21 day(-1), respectively. The stoichiometric coefficient, Y, was found to be 0.28 gr gr(-1) for the present system.

  9. A computer-based matrix for rapid calculation of pulmonary hemodynamic parameters in congenital heart disease

    PubMed Central

    Lopes, Antonio Augusto; dos Anjos Miranda, Rogério; Gonçalves, Rilvani Cavalcante; Thomaz, Ana Maria

    2009-01-01

    BACKGROUND: In patients with congenital heart disease undergoing cardiac catheterization for hemodynamic purposes, parameter estimation by the indirect Fick method using a single predicted value of oxygen consumption has been a matter of criticism. OBJECTIVE: We developed a computer-based routine for rapid estimation of replicate hemodynamic parameters using multiple predicted values of oxygen consumption. MATERIALS AND METHODS: Using Microsoft® Excel facilities, we constructed a matrix containing 5 models (equations) for prediction of oxygen consumption, and all additional formulas needed to obtain replicate estimates of hemodynamic parameters. RESULTS: By entering data from 65 patients with ventricular septal defects, aged 1 month to 8 years, it was possible to obtain multiple predictions for oxygen consumption, with clear between-age groups (P <.001) and between-methods (P <.001) differences. Using these predictions in the individual patient, it was possible to obtain the upper and lower limits of a likely range for any given parameter, which made estimation more realistic. CONCLUSION: The organized matrix allows for rapid obtainment of replicate parameter estimates, without error due to exhaustive calculations. PMID:19641642

  10. Polarizable Simulations with Second order Interaction Model – force field and software for fast polarizable calculations: Parameters for small model systems and free energy calculations

    PubMed Central

    Kaminski, George A.; Ponomarev, Sergei Y.; Liu, Aibing B.

    2009-01-01

    We are presenting POSSIM (POlarizable Simulations with Second order Interaction Model) – a software package and a set of parameters designed for molecular simulations. The key feature of POSSIM is that the electrostatic polarization is taken into account using a previously introduced fast formalism. This permits cutting computational cost of using the explicit polarization by about an order of magnitude. In this article, parameters for water, methane, ethane, propane, butane, methanol and NMA are introduced. These molecules are viewed as model systems for protein simulations. We have achieved our goal of ca. 0.5 kcal/mol accuracy for gas-phase dimerization energies and no more than 2% deviations in liquid state heats of vaporization and densities. Moreover, free energies of hydration of the polarizable methane, ethane and methanol have been calculated using the statistical perturbation theory. These calculations are a model for calculating protein pKa shifts and ligand binding affinities. The free energies of hydration were found to be 2.12 kcal/mol, 1.80 kcal/mol and −4.95 kcal/mol for methane, ethane and methanol, respectively. The experimentally determined literature values are 1.91 kcal/mol, 1.83 kcal/mol and −5.11 kcal/mol. The POSSIM average error in these absolute free energies of hydration is only about 0.13 kcal/mol. Using the statistical perturbation theory with polarizable force fields is not widespread, and we believe that this work opens road to further development of the POSSIM force field and its applications for obtaining accurate energies in protein-related computer modeling. PMID:20209038

  11. Control design for a class of nonlinear parameter varying systems

    NASA Astrophysics Data System (ADS)

    Cai, Xiushan; Liu, Yang; Zhang, Wei

    2015-07-01

    Stabilisation for a class of one-sided Lipschitz nonlinear parameter varying systems is dealt with in this paper. First, the nonlinear parameter varying system is represented as a subsystem of a differential inclusion. Sufficient conditions for exponential stabilisation for the differential inclusion are given by solving linear matrix inequalities. Then a continuous control law is designed to stabilise the differential inclusion. It leads to stabilising the nonlinear parameter varying system. Finally, a simulation example is presented to show the validity and advantages of the proposed method.

  12. Teaching-learning-based Optimization Algorithm for Parameter Identification in the Design of IIR Filters

    NASA Astrophysics Data System (ADS)

    Singh, R.; Verma, H. K.

    2013-12-01

    This paper presents a teaching-learning-based optimization (TLBO) algorithm to solve parameter identification problems in the designing of digital infinite impulse response (IIR) filter. TLBO based filter modelling is applied to calculate the parameters of unknown plant in simulations. Unlike other heuristic search algorithms, TLBO algorithm is an algorithm-specific parameter-less algorithm. In this paper big bang-big crunch (BB-BC) optimization and PSO algorithms are also applied to filter design for comparison. Unknown filter parameters are considered as a vector to be optimized by these algorithms. MATLAB programming is used for implementation of proposed algorithms. Experimental results show that the TLBO is more accurate to estimate the filter parameters than the BB-BC optimization algorithm and has faster convergence rate when compared to PSO algorithm. TLBO is used where accuracy is more essential than the convergence speed.

  13. Statistical Analyses of Femur Parameters for Designing Anatomical Plates

    PubMed Central

    2016-01-01

    Femur parameters are key prerequisites for scientifically designing anatomical plates. Meanwhile, individual differences in femurs present a challenge to design well-fitting anatomical plates. Therefore, to design anatomical plates more scientifically, analyses of femur parameters with statistical methods were performed in this study. The specific steps were as follows. First, taking eight anatomical femur parameters as variables, 100 femur samples were classified into three classes with factor analysis and Q-type cluster analysis. Second, based on the mean parameter values of the three classes of femurs, three sizes of average anatomical plates corresponding to the three classes of femurs were designed. Finally, based on Bayes discriminant analysis, a new femur could be assigned to the proper class. Thereafter, the average anatomical plate suitable for that new femur was selected from the three available sizes of plates. Experimental results showed that the classification of femurs was quite reasonable based on the anatomical aspects of the femurs. For instance, three sizes of condylar buttress plates were designed. Meanwhile, 20 new femurs are judged to which classes the femurs belong. Thereafter, suitable condylar buttress plates were determined and selected. PMID:28044087

  14. Statistical Analyses of Femur Parameters for Designing Anatomical Plates.

    PubMed

    Wang, Lin; He, Kunjin; Chen, Zhengming

    2016-01-01

    Femur parameters are key prerequisites for scientifically designing anatomical plates. Meanwhile, individual differences in femurs present a challenge to design well-fitting anatomical plates. Therefore, to design anatomical plates more scientifically, analyses of femur parameters with statistical methods were performed in this study. The specific steps were as follows. First, taking eight anatomical femur parameters as variables, 100 femur samples were classified into three classes with factor analysis and Q-type cluster analysis. Second, based on the mean parameter values of the three classes of femurs, three sizes of average anatomical plates corresponding to the three classes of femurs were designed. Finally, based on Bayes discriminant analysis, a new femur could be assigned to the proper class. Thereafter, the average anatomical plate suitable for that new femur was selected from the three available sizes of plates. Experimental results showed that the classification of femurs was quite reasonable based on the anatomical aspects of the femurs. For instance, three sizes of condylar buttress plates were designed. Meanwhile, 20 new femurs are judged to which classes the femurs belong. Thereafter, suitable condylar buttress plates were determined and selected.

  15. Application of GRS method to evaluation of uncertainties of calculation parameters of perspective sodium-cooled fast reactor

    SciTech Connect

    Peregudov, A.; Andrianova, O.; Raskach, K.; Tsibulya, A.

    2012-07-01

    A number of recent studies have been devoted to the estimation of errors of reactor calculation parameters by the GRS (Generation Random Sampled) method. This method is based on direct sampling input data resulting in formation of random sets of input parameters which are used for multiple calculations. Once these calculations are performed, statistical processing of the calculation results is carried out to determine the mean value and the variance of each calculation parameter of interest. In our study this method is used for estimation of errors of calculation parameters (K{sub eff}, power density, dose rate) of a perspective sodium-cooled fast reactor. Neutron transport calculations were performed by the nodal diffusion code TRIGEX and Monte Carlo code MMK. (authors)

  16. Improvement of plant parameters of the ROBO gamma irradiation facility due to design modification

    NASA Astrophysics Data System (ADS)

    Kovacs, A.; Moussa, A.; Othman, I.; Del Valle Odar, C.; Seminario, A.; Linares, M.; Huamanlazo, P.; Aymar, J.; Chu, R.

    1998-06-01

    Two industrial scale, "ROBO" type 60Co gamma irradiation facilities have recently been put into operation in Syria and Peru, and the dosimetry commissioning of both plants have been carried out to determine dose distribution within products and to calculate plant parameters such as efficiency, dose uniformity ratio and throughput. There are some design modifications between the two plants in connection with the location of the carriers with respect to the source plaque and also to each other. The effect of these construction modifications on the plant parameters is discussed in the analysis of the dose distribution data measured in the carriers with depth and height among the four irradiation rows on both sides of the source plaque. The plant parameters were also calculated for different product densities using the technical data of the facilities, and the calculated and measured results were compared to each other.

  17. Neoclassical calculations for W7-X OP1.1 parameters

    NASA Astrophysics Data System (ADS)

    Landreman, Matt; Alonso, A.; Beidler, C. D.; Bozhenkov, S.; Dinklage, A.; Fuchert, G.; Geiger, J.; Hirsch, M.; Krämer-Flecken, A.; Langenberg, A.; Maassberg, H.; Mollén, A.; Pablant, N.; Pasch, E.; Satake, S.; Smith, H. M.; Traverso, P.; Turkin, Y.; Valson, P.; Velasco, J. L.; Windisch, T.; Zhang, D.; W7-X Team

    2016-10-01

    Neoclassical calculations are carried out for W7-X OP1.1 plasmas with the SFINCS code, using experimental profiles of ne, Te, and Ti. An electron root solution is found in the inner part of the plasma, consistent with measurements. Calculations are performed using a variety of assumptions for the plasma's impurity composition. Impurities modestly reduce the bootstrap current, and if a flat Zeff profile is assumed, the impurity particle flux profile resembles the Er profile due to dominance of the associated thermodynamic force. Variations of quantities on flux surfaces computed with SFINCS are also presented. The incompressible-ExB approximation is found to be quite accurate for W7-X parameters.

  18. Calculation of physiological acid-base parameters in multicompartment systems with application to human blood.

    PubMed

    Wooten, E Wrenn

    2003-12-01

    A general formalism for calculating parameters describing physiological acid-base balance in single compartments is extended to multicompartment systems and demonstrated for the multicompartment example of human whole blood. Expressions for total titratable base, strong ion difference, change in total titratable base, change in strong ion difference, and change in Van Slyke standard bicarbonate are derived, giving calculated values in agreement with experimental data. The equations for multicompartment systems are found to have the same mathematical interrelationships as those for single compartments, and the relationship of the present formalism to the traditional form of the Van Slyke equation is also demonstrated. The multicompartment model brings the strong ion difference theory to the same quantitative level as the base excess method.

  19. Calculation of the wetting parameter from a cluster model in the framework of nanothermodynamics.

    PubMed

    García-Morales, V; Cervera, J; Pellicer, J

    2003-06-01

    The critical wetting parameter omega(c) determines the strength of interfacial fluctuations in critical wetting transitions. In this Brief Report, we calculate omega(c) from considerations on critical liquid clusters inside a vapor phase. The starting point is a cluster model developed by Hill and Chamberlin in the framework of nanothermodynamics [Proc. Natl. Acad. Sci. USA 95, 12779 (1998)]. Our calculations yield results for omega(c) between 0.52 and 1.00, depending on the degrees of freedom considered. The findings are in agreement with previous experimental results and give an idea of the universal dynamical behavior of the clusters when approaching criticality. We suggest that this behavior is a combination of translation and vortex rotational motion (omega(c)=0.84).

  20. Calculation of electromagnetic constitutive parameters of insulating magnetic materials with conducting inclusions

    SciTech Connect

    Kuster, E.; Moore, R.; Lust, L.; Kemper, P.

    1996-12-31

    A Method of Moments (MoM) electromagnetic model of percolating conducting films was applied to calculate the effective parameters of the composite formed by conducting inclusions placed within a dispersive magnetic but nondispersive dielectric matrix. The MoM calculations demonstrate a coupling between the magnetic properties of the matrix and the effective composite permittivity and frequency dispersion of the composite. The coupling of permittivity and permeability is observed near the percolation threshold of the composite and for high conductivity inclusions. The prediction agrees with physical expectations since near percolation the conduction correlation length dominates the effective permittivity of the composite and this correlation length is determined by both the permittivity and permeability of the composite.

  1. Structure simulation with calculated NMR parameters - integrating COSMOS into the CCPN framework.

    PubMed

    Schneider, Olaf; Fogh, Rasmus H; Sternberg, Ulrich; Klenin, Konstantin; Kondov, Ivan

    2012-01-01

    The Collaborative Computing Project for NMR (CCPN) has build a software framework consisting of the CCPN data model (with APIs) for NMR related data, the CcpNmr Analysis program and additional tools like CcpNmr FormatConverter. The open architecture allows for the integration of external software to extend the abilities of the CCPN framework with additional calculation methods. Recently, we have carried out the first steps for integrating our software Computer Simulation of Molecular Structures (COSMOS) into the CCPN framework. The COSMOS-NMR force field unites quantum chemical routines for the calculation of molecular properties with a molecular mechanics force field yielding the relative molecular energies. COSMOS-NMR allows introducing NMR parameters as constraints into molecular mechanics calculations. The resulting infrastructure will be made available for the NMR community. As a first application we have tested the evaluation of calculated protein structures using COSMOS-derived 13C Cα and Cβ chemical shifts. In this paper we give an overview of the methodology and a roadmap for future developments and applications.

  2. Algorithms and physical parameters involved in the calculation of model stellar atmospheres

    NASA Astrophysics Data System (ADS)

    Merlo, D. C.

    This contribution summarizes the Doctoral Thesis presented at Facultad de Matemática, Astronomía y Física, Universidad Nacional de Córdoba for the degree of PhD in Astronomy. We analyze some algorithms and physical parameters involved in the calculation of model stellar atmospheres, such as atomic partition functions, functional relations connecting gaseous and electronic pressure, molecular formation, temperature distribution, chemical compositions, Gaunt factors, atomic cross-sections and scattering sources, as well as computational codes for calculating models. Special attention is paid to the integration of hydrostatic equation. We compare our results with those obtained by other authors, finding reasonable agreement. We make efforts on the implementation of methods that modify the originally adopted temperature distribution in the atmosphere, in order to obtain constant energy flux throughout. We find limitations and we correct numerical instabilities. We integrate the transfer equation solving directly the integral equation involving the source function. As a by-product, we calculate updated atomic partition functions of the light elements. Also, we discuss and enumerate carefully selected formulae for the monochromatic absorption and dispersion of some atomic and molecular species. Finally, we obtain a flexible code to calculate model stellar atmospheres.

  3. Theoretical calculations of Electron Paramagnetic Resonance parameters of liquid phase Orotic acid radical

    NASA Astrophysics Data System (ADS)

    Sarikaya, Ebru Karakaş; Dereli, Ömer

    2017-02-01

    To obtain liquid phase molecular structure, conformational analysis of Orotic acid was performed and six conformers were determined. For these conformations, eight possible radicals were modelled by using Density Functional Theory computations with respect to molecular structure. Electron Paramagnetic Resonance parameters of these model radicals were calculated and then they were compared with the experimental ones. Geometry optimizations of the molecule and modeled radicals were performed using Becke's three-parameter hybrid-exchange functional combined with the Lee-Yang-Parr correlation functional of Density Functional Theory and 6-311++G(d,p) basis sets in p-dioxane solution. Because Orotic acid can be mutagenic in mammalian somatic cells and it is also mutagenic for bacteria and yeast, it has been studied.

  4. Microscopic calculation of interacting boson model parameters by potential-energy surface mapping

    SciTech Connect

    Bentley, I.; Frauendorf, S.

    2011-06-15

    A coherent state technique is used to generate an interacting boson model (IBM) Hamiltonian energy surface which is adjusted to match a mean-field energy surface. This technique allows the calculation of IBM Hamiltonian parameters, prediction of properties of low-lying collective states, as well as the generation of probability distributions of various shapes in the ground state of transitional nuclei, the last two of which are of astrophysical interest. The results for krypton, molybdenum, palladium, cadmium, gadolinium, dysprosium, and erbium nuclei are compared with experiment.

  5. Design of Fiber Optic Sensors for Measuring Hydrodynamic Parameters

    NASA Technical Reports Server (NTRS)

    Lyons, Donald R.; Quiett, Carramah; Griffin, DeVon (Technical Monitor)

    2001-01-01

    The science of optical hydrodynamics involves relating the optical properties to the fluid dynamic properties of a hydrodynamic system. Fiber-optic sensors are being designed for measuring the hydrodynamic parameters of various systems. As a flowing fluid makes an encounter with a flat surface, it forms a boundary layer near this surface. The region between the boundary layer and the flat plate contains information about parameters such as viscosity, compressibility, pressure, density, and velocity. An analytical model has been developed for examining the hydrodynamic parameters near the surface of a fiber-optic sensor. An analysis of the conservation of momentum, the continuity equation and the Navier-Stokes equation for compressible flow were used to develop expressions for the velocity and the density as a function of the distance along the flow and above the surface. When examining the flow near the surface, these expressions are used to estimate the sensitivity required to perform direct optical measurements and to derive the shear force for indirect optical measurements. The derivation of this result permits the incorporation of better design parameters for other fiber-based sensors. Future work includes analyzing the optical parametric designs of fiber-optic sensors, modeling sensors to utilize the parameters for hydrodynamics and applying different mixtures of hydrodynamic flow. Finally, the fabrication of fiber-optic sensors for hydrodynamic flow applications of the type described in this presentation could enhance aerospace, submarine, and medical technology.

  6. Effect of buoyancy and power design parameters on hybrid airship performance

    NASA Technical Reports Server (NTRS)

    Talbot, P. D.; Gelhausen, P. A.

    1983-01-01

    The effects of several design parameters on the performance of hybrid airships having rotors and propellers were examined with a simple mathematical model. The parameters included buoyancy ratio, Froude number, ratio of rotor power to total power, and rotor shaft tilt. Performance variations resulting from changes in these parameters were calculated, and are presented and discussed. Performance quantities included best climb rate, equivalent vehicle L/D, and maximum speed. Performance at all speeds between hover and maximum speed was found to be sensitive to power distribution between rotors and propellers, and to rotor shaft tilt.

  7. Robust integrated autopilot/autothrottle design using constrained parameter optimization

    NASA Technical Reports Server (NTRS)

    Ly, Uy-Loi; Voth, Christopher; Sanjay, Swamy

    1990-01-01

    A multivariable control design method based on constrained parameter optimization was applied to the design of a multiloop aircraft flight control system. Specifically, the design method is applied to the following: (1) direct synthesis of a multivariable 'inner-loop' feedback control system based on total energy control principles; (2) synthesis of speed/altitude-hold designs as 'outer-loop' feedback/feedforward control systems around the above inner loop; and (3) direct synthesis of a combined 'inner-loop' and 'outer-loop' multivariable control system. The design procedure offers a direct and structured approach for the determination of a set of controller gains that meet design specifications in closed-loop stability, command tracking performance, disturbance rejection, and limits on control activities. The presented approach may be applied to a broader class of multiloop flight control systems. Direct tradeoffs between many real design goals are rendered systematic by this method following careful problem formulation of the design objectives and constraints. Performance characteristics of the optimization design were improved over the current autopilot design on the B737-100 Transport Research Vehicle (TSRV) at the landing approach and cruise flight conditions; particularly in the areas of closed-loop damping, command responses, and control activity in the presence of turbulence.

  8. Parameter Screening and Optimisation for ILP Using Designed Experiments

    NASA Astrophysics Data System (ADS)

    Srinivasan, Ashwin; Ramakrishnan, Ganesh

    Reports of experiments conducted with an Inductive Logic Programming system rarely describe how specific values of parameters of the system are arrived at when constructing models. Usually, no attempt is made to identify sensitive parameters, and those that are used are often given "factory-supplied" default values, or values obtained from some non-systematic exploratory analysis. The immediate consequence of this is, of course, that it is not clear if better models could have been obtained if some form of parameter selection and optimisation had been performed. Questions follow inevitably on the experiments themselves: specifically, are all algorithms being treated fairly, and is the exploratory phase sufficiently well-defined to allow the experiments to be replicated? In this paper, we investigate the use of parameter selection and optimisation techniques grouped under the study of experimental design. Screening and "response surface" methods determine, in turn, sensitive parameters and good values for these parameters. This combined use of parameter selection and response surface-driven optimisation has a long history of application in industrial engineering, and its role in ILP is investigated using two well-known benchmarks. The results suggest that computational overheads from this preliminary phase are not substantial, and that much can be gained, both on improving system performance and on enabling controlled experimentation, by adopting well-established procedures such as the ones proposed here.

  9. Calculating wave-generated bottom orbital velocities from surface-wave parameters

    USGS Publications Warehouse

    Wiberg, P.L.; Sherwood, C.R.

    2008-01-01

    Near-bed wave orbital velocities and shear stresses are important parameters in many sediment-transport and hydrodynamic models of the coastal ocean, estuaries, and lakes. Simple methods for estimating bottom orbital velocities from surface-wave statistics such as significant wave height and peak period often are inaccurate except in very shallow water. This paper briefly reviews approaches for estimating wave-generated bottom orbital velocities from near-bed velocity data, surface-wave spectra, and surface-wave parameters; MATLAB code for each approach is provided. Aspects of this problem have been discussed elsewhere. We add to this work by providing a method for using a general form of the parametric surface-wave spectrum to estimate bottom orbital velocity from significant wave height and peak period, investigating effects of spectral shape on bottom orbital velocity, comparing methods for calculating bottom orbital velocity against values determined from near-bed velocity measurements at two sites on the US east and west coasts, and considering the optimal representation of bottom orbital velocity for calculations of near-bed processes. Bottom orbital velocities calculated using near-bed velocity data, measured wave spectra, and parametric spectra for a site on the northern California shelf and one in the mid-Atlantic Bight compare quite well and are relatively insensitive to spectral shape except when bimodal waves are present with maximum energy at the higher-frequency peak. These conditions, which are most likely to occur at times when bottom orbital velocities are small, can be identified with our method as cases where the measured wave statistics are inconsistent with Donelan's modified form of the Joint North Sea Wave Project (JONSWAP) spectrum. We define the 'effective' forcing for wave-driven, near-bed processes as the product of the magnitude of forcing times its probability of occurrence, and conclude that different bottom orbital velocity statistics

  10. Parameter design considerations for an oscillator IR-FEL

    NASA Astrophysics Data System (ADS)

    Jia, Qi-Ka

    2017-01-01

    An infrared oscillator FEL user facility will be built at the National Synchrotron Radiation Laboratory at in Hefei, China. In this paper, the parameter design of the oscillator FEL is discussed, and some original relevant approaches and expressions are presented. Analytic formulae are used to estimate the optical field gain and saturation power for the preliminary design. By considering both physical and technical constraints, the relation of the deflection parameter K to the undulator period is analyzed. This helps us to determine the ranges of the magnetic pole gap, the electron energy and the radiation wavelength. The relations and design of the optical resonator parameters are analyzed. Using dimensionless quantities, the interdependences between the radii of curvature of the resonator mirror and the various parameters of the optical resonator are clearly demonstrated. The effect of the parallel-plate waveguide is analyzed for the far-infrared oscillator FEL. The condition of the necessity of using a waveguide and the modified filling factor in the case of the waveguide are given, respectively. Supported by National Nature Science Foundation of China (21327901, 11375199)

  11. Considerations for design parameters for a dedicated medical accelerator

    SciTech Connect

    Alonso, J.R.

    1980-10-01

    There are only a very few critical parameters which determine the size, performance and cost of a heavy ion accelerator. These are the mass of the heaviest ion desired, the maximum range of this heaviest ion in tissue, and the highest intensity desired. Other parameters, such as beam emittance, beam delivery flexibility, reliability and experimental facility configurations are important, but are not primary driving factors in the design effort. The various clinical applications for a heavy ion accelerator are evaluated, detailing the most desirable beams for each application.

  12. Designing of discrete mechatronic vibrating systems with negative value parameters

    NASA Astrophysics Data System (ADS)

    Buchacz, Andrzej; Gałęziowski, Damian

    2016-10-01

    In the paper, the known problem of vibration control, authors expanded for designing of mechatronic discrete systems that contains single or multiply piezoelectric elements connected to external electric networks. Main focus has been given for investigations in relation to damping performance and parameters study, in case of potential practical application. By different configurations of considered mechatronic discrete branched structures with two degrees of freedom, key negative parameters have been identified and investigated in case of vibration control effectiveness. Results have been presented in graphical form of amplitudes and dynamical flexibility functions.

  13. Selection and calculation of overall parameters of laser communicator applied for vehicle mobile target

    NASA Astrophysics Data System (ADS)

    Zhang, Hongtao; Yin, FuChang; Shi, Jiangtian

    2002-09-01

    The model of laser communication system using in vehicle mobile target was built. Optimal design and calculation was analyzed for system performance, such as laser transmission, photoelectric reception and speech information processing and image stabilization. Algorithm of MELP (Mixed Excitation Line Predication) compressed speech scrambling was received in processing voice message, which reached 2.4 kbps digital speech code stream, and realized digitization of laser communication. It was also analyzed carefully about the principle theory of MELP algorithm encoding and decoding as well as algorithm realization used in DSP. Image stabilization and tracking were realized by process signal errors which acquired at quadrant error sensors.

  14. Calculation of PID controller parameters by using a fuzzy neural network.

    PubMed

    Lee, Ching-Hung; Teng, Ching-Cheng

    2003-07-01

    In this paper, we use the fuzzy neural network (FNN) to develop a formula for designing the proportional-integral-derivative (PID) controller. This PID controller satisfies the criteria of minimum integrated absolute error (IAE) and maximum of sensitivity (Ms). The FNN system is used to identify the relationship between plant model and controller parameters based on IAE and Ms. To derive the tuning rule, the dominant pole assignment method is applied to simplify our optimization processes. Therefore, the FNN system is used to automatically tune the PID controller for different system parameters so that neither theoretical methods nor numerical methods need be used. Moreover, the FNN-based formula can modify the controller to meet our specification when the system model changes. A simulation result for applying to the motor position control problem is given to demonstrate the effectiveness of our approach.

  15. A Modified Rodrigues Parameter-based Nonlinear Observer Design for Spacecraft Gyroscope Parameters Estimation

    NASA Astrophysics Data System (ADS)

    Yong, Kilyuk; Jo, Sujang; Bang, Hyochoong

    This paper presents a modified Rodrigues parameter (MRP)-based nonlinear observer design to estimate bias, scale factor and misalignment of gyroscope measurements. A Lyapunov stability analysis is carried out for the nonlinear observer. Simulation is performed and results are presented illustrating the performance of the proposed nonlinear observer under the condition of persistent excitation maneuver. In addition, a comparison between the nonlinear observer and alignment Kalman filter (AKF) is made to highlight favorable features of the nonlinear observer.

  16. Consideration of Design Parameters of Ultrasonic Transducer for Fruit

    NASA Astrophysics Data System (ADS)

    Kim, K. B.; Kim, M. S.; Lee, S. D.; Choi, M. Y.

    2005-04-01

    This study was conducted to develop the ultrasonic transducers for non-destructive contact measurement of fruits. The design parameters for ultrasonic transducer such as acoustical impedance of fruits, kinds of piezoelectric materials, ultrasonic wave frequency, and transducer diameter were investigated. In order to match the impedance between piezoelectric material and fruit, various materials were evaluated. And to control the bandwidth of ultrasonic wave of the transducer, various backing materials were fabricated and evaluated. Especially, the wear plate of the transducer was designed and fabricated considering curvature of fruit. Finally, the ultrasonic transducer having 100 kHz of central frequency were fabricated and tested.

  17. Robust parameter design for automatically controlled systems and nanostructure synthesis

    NASA Astrophysics Data System (ADS)

    Dasgupta, Tirthankar

    2007-12-01

    This research focuses on developing comprehensive frameworks for developing robust parameter design methodology for dynamic systems with automatic control and for synthesis of nanostructures. In many automatically controlled dynamic processes, the optimal feedback control law depends on the parameter design solution and vice versa and therefore an integrated approach is necessary. A parameter design methodology in the presence of feedback control is developed for processes of long duration under the assumption that experimental noise factors are uncorrelated over time. Systems that follow a pure-gain dynamic model are considered and the best proportional-integral and minimum mean squared error control strategies are developed by using robust parameter design. The proposed method is illustrated using a simulated example and a case study in a urea packing plant. This idea is also extended to cases with on-line noise factors. The possibility of integrating feedforward control with a minimum mean squared error feedback control scheme is explored. To meet the needs of large scale synthesis of nanostructures, it is critical to systematically find experimental conditions under which the desired nanostructures are synthesized reproducibly, at large quantity and with controlled morphology. The first part of the research in this area focuses on modeling and optimization of existing experimental data. Through a rigorous statistical analysis of experimental data, models linking the probabilities of obtaining specific morphologies to the process variables are developed. A new iterative algorithm for fitting a Multinomial GLM is proposed and used. The optimum process conditions, which maximize the above probabilities and make the synthesis process less sensitive to variations of process variables around set values, are derived from the fitted models using Monte-Carlo simulations. The second part of the research deals with development of an experimental design methodology, tailor

  18. Calculations of the electronic levels, spin-Hamiltonian parameters and vibrational spectra for the CrCl3 layered crystals

    NASA Astrophysics Data System (ADS)

    Avram, C. N.; Gruia, A. S.; Brik, M. G.; Barb, A. M.

    2015-12-01

    Calculations of the Cr3+ energy levels, spin-Hamiltonian parameters and vibrational spectra for the layered CrCl3 crystals are reported for the first time. The crystal field parameters and the energy level scheme were calculated in the framework of the Exchange Charge Model of crystal field. The spin-Hamiltonian parameters (zero-field splitting parameter D and g-factors) for Cr3+ ion in CrCl3 crystals were obtained using two independent techniques: i) semi-empirical crystal field theory and ii) density functional theory (DFT)-based model. In the first approach, the spin-Hamiltonian parameters were calculated from the perturbation theory method and the complete diagonalization (of energy matrix) method. The infrared (IR) and Raman frequencies were calculated for both experimental and fully optimized geometry of the crystal structure, using CRYSTAL09 software. The obtained results are discussed and compared with the experimental available data.

  19. Optimizing Hyperspectral Imagery Anomaly Detection through Robust Parameter Design

    DTIC Science & Technology

    2011-10-01

    THROUGH ROBUST PARAMETER DESIGN DISSERTATION Presented to the Faculty Graduate School of Engineering and Management Air Force Institute of Technology...Air University Air Education and Training Command in Partial Fulfillment of the Requirements for the Degree of Doctor of Philosophy Francis M. Mindrup...Graduate School of Engineering and Management For my loving wife, daughter and sons iv AFIT/DS/ENS/11-04 Abstract Advances in sensor technology

  20. [Calculation of spectroscopic parameters of highly doped Er3+ in lithium niobate].

    PubMed

    Sun, Dun-lu; Zhang, Qing-li; Wang, Ai-hua; Hang, Yin; Zhang, Lian-han; Qian, Xiao-bo; Zhu, Shi-ning; Yin, Shao-tang

    2005-09-01

    A highly doped Er3+: LiNbO3 (concentration 6 mol%) crystal was grown successfully by Czochralski method. The crystal is higher than that of the lowly doped Er3+ in LiNbO3 crystal, which is helpful to improve absorption coefficient of the grown the pumping efficiency. The absorption spectra at two unpolarized directions (X and Z) and two polarized directions (E parallel Z, E perpendicular Z) were measured. Using the Judd-Ofelt theory, and according to the measured absorption spectra, the intensity parameters omegalambda of Er3+ were fitted. The results of root-mean square (r. m. s) deviation show that the error of polarized fitting is less than that of unpolarized one. Thus fluorescence transition probabilities (Ajj), radioactive lifetime (tau), fluorescence branching ratio (beta), and integrated emission cross section (sigmap) were calculated and accepted according to the polarized results, and were also discussed and compared with the ones reported in the literature.

  1. Nanoscintillator Conjugates as Photodynamic Therapy-Based Radiosensitizers: Calculation of Required Physical Parameters

    PubMed Central

    Morgan, Nicole Y.; Kramer-Marek, Gabriela; Smith, Paul D.; Camphausen, Kevin; Capala, Jacek

    2011-01-01

    The recent demonstration of nanoscale scintillators has led to interest in the combination of radiation and photodynamic therapy. In this model, scintillating nanoparticles conjugated to photosensitizers and molecular targeting agents would enhance the targeting and improve the efficacy of radiotherapy and extend the application of photodynamic therapy to deeply seated tumors. In this study, we calculated the physical parameters required for these nanoparticle conjugates to deliver cytotoxic levels of singlet oxygen at therapeutic radiation doses, drawing on the published literature from several disparate fields. Although uncertainties remain, it appears that the light yield of the nanoscintillators, the efficiency of energy transfer to the photosensitizers, and the cellular uptake of the nano-particles all need to be fairly well optimized to observe a cytotoxic effect. Even so, the efficacy of the combination therapy will likely be restricted to X-ray energies below 300 keV, which limits the application to brachytherapy. PMID:19267550

  2. Ab initio calculation of the Gilbert damping parameter via the linear response formalism.

    PubMed

    Ebert, H; Mankovsky, S; Ködderitzsch, D; Kelly, P J

    2011-08-05

    A Kubo-Greenwood-like equation for the Gilbert damping parameter α is presented that is based on the linear response formalism. Its implementation using the fully relativistic Korringa-Kohn-Rostoker band structure method in combination with coherent potential approximation alloy theory allows it to be applied to a wide range of situations. This is demonstrated with results obtained for the bcc alloy system Fe(1-x)Co(x) as well as for a series of alloys of Permalloy with 5d transition metals. To account for the thermal displacements of atoms as a scattering mechanism, an alloy-analogy model is introduced. The corresponding calculations for Ni correctly describe the rapid change of α when small amounts of substitutional Cu are introduced.

  3. A design methodology for nonlinear systems containing parameter uncertainty: Application to nonlinear controller design

    NASA Technical Reports Server (NTRS)

    Young, G.

    1982-01-01

    A design methodology capable of dealing with nonlinear systems, such as a controlled ecological life support system (CELSS), containing parameter uncertainty is discussed. The methodology was applied to the design of discrete time nonlinear controllers. The nonlinear controllers can be used to control either linear or nonlinear systems. Several controller strategies are presented to illustrate the design procedure.

  4. GENENG: A program for calculating design and off-design performance for turbojet and turbofan engines

    NASA Technical Reports Server (NTRS)

    Koenig, R. W.; Fishbach, L. H.

    1972-01-01

    A computer program entitled GENENG employs component performance maps to perform analytical, steady state, engine cycle calculations. Through a scaling procedure, each of the component maps can be used to represent a family of maps (different design values of pressure ratios, efficiency, weight flow, etc.) Either convergent or convergent-divergent nozzles may be used. Included is a complete FORTRAN 4 listing of the program. Sample results and input explanations are shown for one-spool and two-spool turbojets and two-spool separate- and mixed-flow turbofans operating at design and off-design conditions.

  5. Bedside calculation of hemodynamic parameters with a hand-held programmable calculator. Part I.: Choice of hemodynamic formulas.

    PubMed

    Laurent, M

    1980-01-01

    Currently used hemodynamic and oxygen transport formulas are reviewed in order to chose the shortest form compatible with an optimal clinical accuracy. Programming of hand held calculators with these selected equations spares steps available in the program memory. (Acta anaesth. belg., 1980, 31, 45-52).

  6. Launch Vehicle Propulsion Parameter Design Multiple Selection Criteria

    NASA Technical Reports Server (NTRS)

    Shelton, Joey Dewayne

    2004-01-01

    The optimization tool described herein addresses and emphasizes the use of computer tools to model a system and focuses on a concept development approach for a liquid hydrogen/liquid oxygen single-stage-to-orbit system, but more particularly the development of the optimized system using new techniques. This methodology uses new and innovative tools to run Monte Carlo simulations, genetic algorithm solvers, and statistical models in order to optimize a design concept. The concept launch vehicle and propulsion system were modeled and optimized to determine the best design for weight and cost by varying design and technology parameters. Uncertainty levels were applied using Monte Carlo Simulations and the model output was compared to the National Aeronautics and Space Administration Space Shuttle Main Engine. Several key conclusions are summarized here for the model results. First, the Gross Liftoff Weight and Dry Weight were 67% higher for the design case for minimization of Design, Development, Test and Evaluation cost when compared to the weights determined by the minimization of Gross Liftoff Weight case. In turn, the Design, Development, Test and Evaluation cost was 53% higher for optimized Gross Liftoff Weight case when compared to the cost determined by case for minimization of Design, Development, Test and Evaluation cost. Therefore, a 53% increase in Design, Development, Test and Evaluation cost results in a 67% reduction in Gross Liftoff Weight. Secondly, the tool outputs define the sensitivity of propulsion parameters, technology and cost factors and how these parameters differ when cost and weight are optimized separately. A key finding was that for a Space Shuttle Main Engine thrust level the oxidizer/fuel ratio of 6.6 resulted in the lowest Gross Liftoff Weight rather than at 5.2 for the maximum specific impulse, demonstrating the relationships between specific impulse, engine weight, tank volume and tank weight. Lastly, the optimum chamber pressure for

  7. Methodological aspects in the calculation of parity-violating effects in nuclear magnetic resonance parameters.

    PubMed

    Weijo, Ville; Bast, Radovan; Manninen, Pekka; Saue, Trond; Vaara, Juha

    2007-02-21

    We examine the quantum chemical calculation of parity-violating (PV) electroweak contributions to the spectral parameters of nuclear magnetic resonance (NMR) from a methodological point of view. Nuclear magnetic shielding and indirect spin-spin coupling constants are considered and evaluated for three chiral molecules, H2O2, H2S2, and H2Se2. The effects of the choice of a one-particle basis set and the treatment of electron correlation, as well as the effects of special relativity, are studied. All of them are found to be relevant. The basis-set dependence is very pronounced, especially at the electron correlated ab initio levels of theory. Coupled-cluster and density-functional theory (DFT) results for PV contributions differ significantly from the Hartree-Fock data. DFT overestimates the PV effects, particularly with nonhybrid exchange-correlation functionals. Beginning from third-row elements, special relativity is of importance for the PV NMR properties, shown here by comparing perturbational one-component and various four-component calculations. In contrast to what is found for nuclear magnetic shielding, the choice of the model for nuclear charge distribution--point charge or extended (Gaussian)--has a significant impact on the PV contribution to the spin-spin coupling constants.

  8. Evaluation of the electrical properties of dust storms by multi-parameter observations and theoretical calculations

    NASA Astrophysics Data System (ADS)

    Zhang, Huan; Bo, Tian-Li; Zheng, Xiaojing

    2017-03-01

    Dusty phenomena, such as wind-blown sand, dust devils, and dust storms, play key roles in Earth's climate and geological processes. Dust electrification considerably affects the lifting and transport of dust particles. However, the electrical properties of dust storms remain poorly understood. Here, we conducted multi-parameter measurements and theoretical calculations to investigate the electrical properties of dust storms and their application to dust storm prediction. The results show that the vertical electric field (E-field) decreases first, then increases, and finally decreases with the height above the ground, reversing its direction at two heights, ∼ 8- 12 and ∼ 24 m. This suggests that the charge polarity of dust particles changes from negative to positive and back to negative again as the height increases. By carefully analyzing the E-field and dust concentration data, we further found that there is a significant positive linear relationship between the measured E-field intensity and dust concentration at the given ambient conditions. In addition, measurements and calculations demonstrate that a substantial enhancement in the vertical E-field can be observed several hours before the arrival of the external-source dust storms, indicating that the E-field can be used to provide an early warning of external-source dust storms.

  9. MCDHF calculations and study of plasma parameters for Li-like ions

    NASA Astrophysics Data System (ADS)

    Khatri, Indu; Goyal, Arun; Aggarwal, Sunny; Singh, A. K.; Man Mohan

    2016-06-01

    Extensive configuration interaction calculations for several Li-like ions (Z=32, 36, 42, 46, 50, 54 and 56) are performed using the code GRASP2K based on the multiconfiguration Dirac-Hartree-Fock (MCDHF) method. Breit interaction and leading quantum electrodynamical (QED) effects are also included by applying active-space techniques to enlarge the configuration set. Results for fine-structure energy levels for 1s22p, 1s23s, 1s23p and 1s23d configurations with relative to ground states 1s22s are presented. The wavelengths, transition rates and oscillator strengths for the 1s22s 2S1/2-1s22p 1/2,3/2,0 2P, 1s22p 1/2,3/2,0,2P - -1s23s 2S1/2, 1s22p calculated results are in good agreement with previous theoretical results and compiled values of the National Institute for Standards and Technology (NIST). We have also provided the line intensity ratios and plasma parameters for optically thin plasma. Our calculated data may be useful for experimentalists in identifying the fine-structure levels, for plasma modeling, astrophysical research applications.

  10. Introduction to boundary-layer theory. [viscous friction loss calculation for turbine blade design

    NASA Technical Reports Server (NTRS)

    Mcnally, W. D.

    1973-01-01

    The pressure ratio across a turbine provides a certain amount of ideal energy that is available to the turbine for producing work. The portion of the ideal energy that is not converted to work is considered to be a loss. One of the more important and difficult aspects of turbine design is the prediction of the losses. The primary cause of losses is the boundary layer that develops on the blade and end wall surfaces. Boundary-layer theory is used to calculate the parameters needed to estimate viscous (friction) losses.

  11. Calculation of radiation reaction effect on orbital parameters in Kerr spacetime

    NASA Astrophysics Data System (ADS)

    Sago, Norichika; Fujita, Ryuichi

    2015-07-01

    We calculate the secular changes of the orbital parameters of a point particle orbiting a Kerr black hole, due to the gravitational radiation reaction. For this purpose, we use the post-Newtonian (PN) approximation in the first-order black hole perturbation theory, with the expansion with respect to the orbital eccentricity. In this work, the calculation is done up to the fourth post-Newtonian (4PN) order and to the sixth order of the eccentricity, including the effect of the absorption of gravitational waves by the black hole. We confirm that, in the Kerr case, the effect of the absorption appears at the 2.5PN order beyond the leading order in the secular change of the particle's energy and may induce a superradiance, as known previously for circular orbits. In addition, we find that the superradiance may be suppressed when the orbital plane inclines with respect to the equatorial plane of the central black hole. We also investigate the accuracy of the 4PN formulae by comparing to numerical results. If we require that the relative errors in the 4PN formulae are less than 10^{-5}, the parameter region to satisfy the condition will be p≳ 50 for e=0.1, p≳ 80 for e=0.4, and p≳ 120 for e = 0.7 almost irrespective of the inclination angle or the spin of the black hole, where p and e are the semi-latus rectum and the eccentricity of the orbit. The region can further be extended using an exponential resummation method to p≳ 40 for e=0.1, p≳ 60 for e=0.4, and p≳ 100 for e=0.7. Although we still need the higher-order calculations of the PN approximation and the expansion with respect to the orbital eccentricity to apply for data analysis of gravitational waves, the results in this paper would be an important improvement from the previous work at the 2.5PN order, especially for large-p regions.

  12. Test verification and design of the bicycle frame parameters

    NASA Astrophysics Data System (ADS)

    Zhang, Long; Xiang, Zhongxia; Luo, Huan; Tian, Guan

    2015-07-01

    Research on design of bicycles is concentrated on mechanism and auto appearance design, however few on matches between the bike and the rider. Since unreasonable human-bike relationship leads to both riders' worn-out joints and muscle injuries, the design of bicycles should focus on the matching. In order to find the best position of human-bike system, simulation experiments on riding comfort under different riding postures are done with the lifemode software employed to facilitate the cycling process as well as to obtain the best position and the size function of it. With BP neural network and GA, analyzing simulation data, conducting regression analysis of parameters on different heights and bike frames, the equation of best position of human-bike system is gained at last. In addition, after selecting testers, customized bikes based on testers' height dimensions are produced according to the size function. By analyzing and comparing the experimental data that are collected from testers when riding common bicycles and customized bicycles, it is concluded that customized bicycles are four times even six times as comfortable as common ones. The equation of best position of human-bike system is applied to improve bikes' function, and the new direction on future design of bicycle frame parameters is presented.

  13. Design of Life Extending Controls Using Nonlinear Parameter Optimization

    NASA Technical Reports Server (NTRS)

    Lorenzo, Carl F.; Holmes, Michael S.; Ray, Asok

    1998-01-01

    This report presents the conceptual development of a life extending control system where the objective is to achieve high performance and structural durability of the plant. A life extending controller is designed for a reusable rocket engine via damage mitigation in both the fuel and oxidizer turbines while achieving high performance for transient responses of the combustion chamber pressure and the O2/H2 mixture ratio. This design approach makes use of a combination of linear and nonlinear controller synthesis techniques and also allows adaptation of the life extending controller module to augment a conventional performance controller of a rocket engine. The nonlinear aspect of the design is achieved using nonlinear parameter optimization of a prescribed control structure.

  14. Design parameters for a FM/FM system

    NASA Astrophysics Data System (ADS)

    Carden, Frank

    Design parameters for a FM/FM telemetry system are determined in terms of the IRIG specifications for proportional bandwidth channels. Three mathematical models used by designers of the above processes are extended and compared. That is, FM multi-tone models are used to establish the relationship between frequency deviations, modulation indices, signal-to-noise and IF bandwidth for the IRIG channels. Since spectral efficiency and signal quality are of major importance, a goal of the design is to have a minimum IF bandwidth, while fixing as large as possible the values of the modulation indices for the subcarriers modulating the carrier in order to achieve as large as needed output signal-to-noise ratio.

  15. Linear parameter varying representations for nonlinear control design

    NASA Astrophysics Data System (ADS)

    Carter, Lance Huntington

    Linear parameter varying (LPV) systems are investigated as a framework for gain-scheduled control design and optimal hybrid control. An LPV system is defined as a linear system whose dynamics depend upon an a priori unknown but measurable exogenous parameter. A gain-scheduled autopilot design is presented for a bank-to-turn (BTT) missile. The method is novel in that the gain-scheduled design does not involve linearizations about operating points. Instead, the missile dynamics are brought to LPV form via a state transformation. This idea is applied to the design of a coupled longitudinal/lateral BTT missile autopilot. The pitch and yaw/roll dynamics are separately transformed to LPV form, where the cross axis states are treated as "exogenous" parameters. These are actually endogenous variables, so such a plant is called "quasi-LPV." Once in quasi-LPV form, a family of robust controllers using mu synthesis is designed for both the pitch and yaw/roll channels, using angle-of-attack and roll rate as the scheduling variables. The closed-loop time response is simulated using the original nonlinear model and also using perturbed aerodynamic coefficients. Modeling and control of engine idle speed is investigated using LPV methods. It is shown how generalized discrete nonlinear systems may be transformed into quasi-LPV form. A discrete nonlinear engine model is developed and expressed in quasi-LPV form with engine speed as the scheduling variable. An example control design is presented using linear quadratic methods. Simulations are shown comparing the LPV based controller performance to that using PID control. LPV representations are also shown to provide a setting for hybrid systems. A hybrid system is characterized by control inputs consisting of both analog signals and discrete actions. A solution is derived for the optimal control of hybrid systems with generalized cost functions. This is shown to be computationally intensive, so a suboptimal strategy is proposed that

  16. Aerodynamic optimization by simultaneously updating flow variables and design parameters with application to advanced propeller designs

    NASA Technical Reports Server (NTRS)

    Rizk, Magdi H.

    1988-01-01

    A scheme is developed for solving constrained optimization problems in which the objective function and the constraint function are dependent on the solution of the nonlinear flow equations. The scheme updates the design parameter iterative solutions and the flow variable iterative solutions simultaneously. It is applied to an advanced propeller design problem with the Euler equations used as the flow governing equations. The scheme's accuracy, efficiency and sensitivity to the computational parameters are tested.

  17. Lens design based on lens form parameters using Gaussian brackets

    NASA Astrophysics Data System (ADS)

    Yuan, Xiangyu; Cheng, Xuemin

    2014-11-01

    The optical power distribution and the symmetry of the lens components are two important attributes that decide the ultimate lens performance and characteristics. Lens form parameters W and S are the key criteria describing the two attributes mentioned above. Lens components with smaller W and S will have a good nature of aberration balance and perform well in providing good image quality. Applying the Gaussian brackets, the two lens form parameters and the Seidel Aberration Coefficients are reconstructed. An initial lens structure can be analytically described by simultaneous equations of Seidel Aberration Coefficients and third-order aberration theory. Adding the constraints of parameters W and S in the solving process, a solution with a proper image quality and aberration distribution is achieved. The optical properties and image quality of the system based on the parameters W and S are also analyzed in this article. In the method, the aberration distribution can be controlled to some extent in the beginning of design, so that we can reduce some workload of optimization later.

  18. Predictive Calculation of Neutral Beam Heating Plasmas in EAST Tokamak by NUBEAM Code for Certain Parameter Ranges

    NASA Astrophysics Data System (ADS)

    Ni, Qionglin; Fan, Tieshuan; Zhang, Xing; Zhang, Cheng; Ren, Qilong; Hu, Chundong

    2010-12-01

    A predictive calculation is carried out for neutral beam heating of fusion plasmas in EAST by using NUBEAM code under certain plasma conditions. Results calculated are analyzed for different plasma parameters. Relations between major plasma parameters, such as density and temperature, are obtained and key physical processes in the neutral beam heating, including beam power deposition, trapped fraction, heating efficiency, and power loss, are simulated. Other physical processes, such as current-drive, toroidal rotation and neutron emission, are also discussed.

  19. Design Parameters Influencing Reliability of CCGA Assembly: A Sensitivity Analysis

    NASA Technical Reports Server (NTRS)

    Tasooji, Amaneh; Ghaffarian, Reza; Rinaldi, Antonio

    2006-01-01

    Area Array microelectronic packages with small pitch and large I/O counts are now widely used in microelectronics packaging. The impact of various package design and materials/process parameters on reliability has been studied through extensive literature review. Reliability of Ceramic Column Grid Array (CCGA) package assemblies has been evaluated using JPL thermal cycle test results (-50(deg)/75(deg)C, -55(deg)/100(deg)C, and -55(deg)/125(deg)C), as well as those reported by other investigators. A sensitivity analysis has been performed using the literature da to study the impact of design parameters and global/local stress conditions on assembly reliability. The applicability of various life-prediction models for CCGA design has been investigated by comparing model's predictions with the experimental thermal cycling data. Finite Element Method (FEM) analysis has been conducted to assess the state of the stress/strain in CCGA assembly under different thermal cycling, and to explain the different failure modes and locations observed in JPL test assemblies.

  20. Criteria for calculating the efficiency of HEPA filters during and after design basis accidents

    SciTech Connect

    Bergman, W.; First, M.W.; Anderson, W.L.; Gilbert, H.; Jacox, J.W.

    1994-12-01

    We have reviewed the literature on the performance of high efficiency particulate air (HEPA) filters under normal and abnormal conditions to establish criteria for calculating the efficiency of HEPA filters in a DOE nonreactor nuclear facility during and after a Design Basis Accident (DBA). The literature review included the performance of new filters and parameters that may cause deterioration in the filter performance such as filter age, radiation, corrosive chemicals, seismic and rough handling, high temperature, moisture, particle clogging, high air flow and pressure pulses. The deterioration of the filter efficiency depends on the exposure parameters; in severe exposure conditions the filter will be structurally damaged and have a residual efficiency of 0%. Despite the many studies on HEPA filter performance under adverse conditions, there are large gaps and limitations in the data that introduce significant error in the estimates of HEPA filter efficiencies under DBA conditions. Because of this limitation, conservative values of filter efficiency were chosen when there was insufficient data.

  1. Numerical investigation of design and operational parameters on CHI spheromak performance

    NASA Astrophysics Data System (ADS)

    O'Bryan, J. B.; Romero-Talamas, C. A.; Woodruff, S.

    2016-10-01

    Nonlinear, extended-MHD computation with the NIMROD code is used to explore magnetic self-organization and performance with respect to externally controllable parameters in spheromaks formed with coaxial helicity injection. The goal of this study is to inform the design and operational parameters of proposed proof-of-principle spheromak experiment. The calculations explore multiple distinct phases of evolution (including adiabatic magnetic compression), which must be explored and optimized separately. Results indicate that modest changes to the design and operation of past experiments, e.g. SSPX [E.B. Hooper et al. PPCF 2012], could have significantly improved the plasma-current injector coupling efficiency and performance, particularly with respect to peak temperature and lifetime. Though we frequently characterize performance relative to SSPX, we are also exploring fundamentally different designs and modes of operation, e.g. flux compression. This work is supported by DAPRA under Grant No. N66001-14-1-4044.

  2. Validation of the MCNP-DSP Monte Carlo code for calculating source-driven noise parameters of subcritical systems

    SciTech Connect

    Valentine, T.E.; Mihalczo, J.T.

    1995-12-31

    This paper describes calculations performed to validate the modified version of the MCNP code, the MCNP-DSP, used for: the neutron and photon spectra of the spontaneous fission of californium 252; the representation of the detection processes for scattering detectors; the timing of the detection process; and the calculation of the frequency analysis parameters for the MCNP-DSP code.

  3. Studies of design parameters for interferometric methane sensors

    NASA Astrophysics Data System (ADS)

    Wykes, John S.; Willett, Martin J.; Croydon, W. F.

    1992-08-01

    Methane detectors based on the absorption of infrared radiation show some promise as the basis of sensitive and accurate industrial instrumentation. Comb filter methods that utilize the vibration-rotation structure of the methane spectrum in an optically efficient manner have recently aroused particular interest in this context. We describe a mathematical model to simulate the behavior of scanning interferometric comb filters in methane detection systems and discuss the use of the model to investigate optimum design parameters for such systems. The behavior of prototype methane detectors based on scanning Fabry-Perot and Mach Zehnder interferometers is briefly reported. Possible techniques for obtaining further improvements in the design of comb filters for methane detection are suggested.

  4. Design Parameters of a Miniaturized Piezoelectric Underwater Acoustic Transmitter

    PubMed Central

    Li, Huidong; Deng, Zhiqun Daniel; Yuan, Yong; Carlson, Thomas J.

    2012-01-01

    PZT ceramics have been widely used in underwater acoustic transducers. However, literature available discussing the design parameters of a miniaturized PZT-based low-duty-cycle transmitter is very limited. This paper discusses some of the design parameters—the backing material, driving voltage, PZT material type, power consumption and the transducer length of a miniaturized acoustic fish tag using a PZT tube. Four different types of PZT were evaluated with respect to the source level, energy consumption and bandwidth of the transducer. The effect of the tube length on the source level is discussed. The results demonstrate that ultralow-density closed-cell foam is the best backing material for the PZT tube. The Navy Type VI PZTs provide the best source level with relatively low energy consumption and that a low transducer capacitance is preferred for high efficiency. A 35% reduction in the transducer length results in 2 dB decrease in source level. PMID:23012534

  5. 40 CFR Table S-1 to Subpart S of... - Basic Parameters for the Calculation of Emission Factors for Lime Production

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 40 Protection of Environment 21 2011-07-01 2011-07-01 false Basic Parameters for the Calculation of Emission Factors for Lime Production S Table S-1 to Subpart S of Part 98 Protection of Environment... Manufacturing Pt. 98, Subpt. S, Table S-1 Table S-1 to Subpart S of Part 98—Basic Parameters for the...

  6. Adjustable Parameter-Based Distributed Fault Estimation Observer Design for Multiagent Systems With Directed Graphs.

    PubMed

    Zhang, Ke; Jiang, Bin; Shi, Peng

    2017-02-01

    In this paper, a novel adjustable parameter (AP)-based distributed fault estimation observer (DFEO) is proposed for multiagent systems (MASs) with the directed communication topology. First, a relative output estimation error is defined based on the communication topology of MASs. Then a DFEO with AP is constructed with the purpose of improving the accuracy of fault estimation. Based on H ∞ and H 2 with pole placement, multiconstrained design is given to calculate the gain of DFEO. Finally, simulation results are presented to illustrate the feasibility and effectiveness of the proposed DFEO design with AP.

  7. Automation of data processing and calculation of retention parameters and thermodynamic data for gas chromatography

    NASA Astrophysics Data System (ADS)

    Makarycheva, A. I.; Faerman, V. A.

    2017-02-01

    The analyses of automation patterns is performed and the programming solution for the automation of data processing of the chromatographic data and their further information storage with a help of a software package, Mathcad and MS Excel spreadsheets, is developed. The offered approach concedes the ability of data processing algorithm modification and does not require any programming experts participation. The approach provides making a measurement of the given time and retention volumes, specific retention volumes, a measurement of differential molar free adsorption energy, and a measurement of partial molar solution enthalpies and isosteric heats of adsorption. The developed solution is focused on the appliance in a small research group and is tested on the series of some new gas chromatography sorbents. More than 20 analytes were submitted to calculation of retention parameters and thermodynamic sorption quantities. The received data are provided in the form accessible to comparative analysis, and they are able to find sorbing agents with the most profitable properties to solve some concrete analytic issues.

  8. Tulip-poplar leaf diffusion resistance calculated from stomatal dimensions and varying environmental parameters

    SciTech Connect

    McConathy, R.K.

    1983-03-01

    The study describes the gradients of stomatal size and density in the crown of a mature forest-grown tulip-poplar (Liriodendron tulipifera L.) in eastern Tennessee. These data are used to predict leaf resistance to vapor diffusion in relation to stomatal width and boundary layer resistance. Stomatal density on individual leaves did not vary, but density increased with increasing crown height. Stomatal size decreased with increasing height of leaves within the crown. Stomatal size and density variations interacted to result in a constant number of stomata per leaf at all crown heights. Stomatal diffusive resistance values calculated from stomatal measurements and varying environmental parameters indicated that stomatal resistance controlled transpiration water losses only at small apertures (<0.6 ..mu..m). Boundary layer resistance was controlling at large stomatal apertures (>0.6 ..mu..m) and at low wind speeds (approx.100 cm/s). Under normal forest conditions tulip-poplar stomatal resistance exercised more control over transpiration than did boundary layer resistance.

  9. Efficient global optimization of a limited parameter antenna design

    NASA Astrophysics Data System (ADS)

    O'Donnell, Teresa H.; Southall, Hugh L.; Kaanta, Bryan

    2008-04-01

    Efficient Global Optimization (EGO) is a competent evolutionary algorithm suited for problems with limited design parameters and expensive cost functions. Many electromagnetics problems, including some antenna designs, fall into this class, as complex electromagnetics simulations can take substantial computational effort. This makes simple evolutionary algorithms such as genetic algorithms or particle swarms very time-consuming for design optimization, as many iterations of large populations are usually required. When physical experiments are necessary to perform tradeoffs or determine effects which may not be simulated, use of these algorithms is simply not practical at all due to the large numbers of measurements required. In this paper we first present a brief introduction to the EGO algorithm. We then present the parasitic superdirective two-element array design problem and results obtained by applying EGO to obtain the optimal element separation and operating frequency to maximize the array directivity. We compare these results to both the optimal solution and results obtained by performing a similar optimization using the Nelder-Mead downhill simplex method. Our results indicate that, unlike the Nelder-Mead algorithm, the EGO algorithm did not become stuck in local minima but rather found the area of the correct global minimum. However, our implementation did not always drill down into the precise minimum and the addition of a local search technique seems to be indicated.

  10. Effects of Microneedle Design Parameters on Hydraulic Resistance.

    PubMed

    Hood, R Lyle; Kosoglu, Mehmet A; Parker, Matthew; Rylander, Christopher G

    2011-09-01

    Microneedles have been an expanding medical technology in recent years due to their ability to penetrate tissue and deliver therapy with minimal invasiveness and patient discomfort. Variations in design have allowed for enhanced fluid delivery, biopsy collection, and the measurement of electric potentials. Our novel microneedle design attempts to combine many of these functions into a single length of silica tubing capable of both light and fluid delivery terminating in a sharp tip of less than 100 microns in diameter. This manuscript focuses on the fluid flow aspects of the design, characterizing the contributions to hydraulic resistance from the geometric parameters of the microneedles. Experiments consisted of measuring the volumetric flow rate of de-ionized water at set pressures (ranging from 69-621 kPa) through a relevant range of tubing lengths, needle lengths, and needle tip diameters. Data analysis showed that the silica tubing (~150 micron bore diameter) adhered to within ±5% of the theoretical prediction by Poiseuille's Law describing laminar internal pipe flow at Reynolds numbers less than 700. High hydraulic resistance within the microneedles correlated with decreasing tip diameter. The hydraulic resistance offered by the silica tubing preceding the microneedle taper was approximately 1-2 orders of magnitude less per unit length, but remained the dominating resistance in most experiments as the tubing length was >30 mm. These findings will be incorporated into future design permutations to produce a microneedle capable of both efficient fluid transfer and light delivery.

  11. Knitted Strain Sensors: Impact of Design Parameters on Sensing Properties

    PubMed Central

    Atalay, Ozgur; Kennon, William Richard

    2014-01-01

    This paper presents a study of the sensing properties exhibited by textile-based knitted strain sensors. Knitted sensors were manufactured using flat-bed knitting technology, and electro-mechanical tests were subsequently performed on the specimens using a tensile testing machine to apply strain whilst the sensor was incorporated into a Wheatstone bridge arrangement to allow electrical monitoring. The sensing fabrics were manufactured from silver-plated nylon and elastomeric yarns. The component yarns offered similar diameters, bending characteristics and surface friction, but their production parameters differed in respect of the required yarn input tension, the number of conductive courses in the sensing structure and the elastomeric yarn extension characteristics. Experimental results showed that these manufacturing controls significantly affected the sensing properties of the knitted structures such that the gauge factor values, the working range and the linearity of the sensors varied according to the knitted structure. These results confirm that production parameters play a fundamental role in determining the physical behavior and the sensing properties of knitted sensors. It is thus possible to manipulate the sensing properties of knitted sensors and the sensor response may be engineered by varying the production parameters applied to specific designs. PMID:24608010

  12. Design and parameter optimization of flip-chip bonder

    NASA Astrophysics Data System (ADS)

    Shim, Hyoungsub; Kang, Heuiseok; Jeong, Hoon; Cho, Youngjune; Kim, Wansoo; Kang, Shinill

    2005-12-01

    Bare-chip packaging becomes more popular along with the miniaturization of IT components. In this paper, we have studied flip-chip process, and developed automated bonding system. Among the several bonding method, NCP bonding is chosen and batch-type equipment is manufactured. The dual optics and vision system aligns the chip with the substrate. The bonding head equipped with temperature and force controllers bonds the chip. The system can be easily modified for other bonding methods such as ACF. In bonding process, the bonding force and temperature are known as the most dominant bonding parameters. A parametric study is performed for these two parameters. For the test sample, we used standard flip-chip test kit which consists of FR4 boards and dummy flip-chips. The bonding temperatures are chosen between 25°C to 300°C. The bonding forces are chosen between 5N and 300N. To test the bonding strength, a bonding strength tester was designed and constructed. After the bonding strength test, the samples are examined by microscope to determine the failure mode. The relations between the bonding strength and the bonding parameters are analyzed and compared with bonding models. Finally, the most suitable bonding condition is suggested in terms of temperature and force.

  13. Experimental investigation of design parameters on dry powder inhaler performance.

    PubMed

    Ngoc, Nguyen Thi Quynh; Chang, Lusi; Jia, Xinli; Lau, Raymond

    2013-11-30

    The study aims to investigate the impact of various design parameters of a dry powder inhaler on the turbulence intensities generated and the performance of the dry powder inhaler. The flow fields and turbulence intensities in the dry powder inhaler are measured using particle image velocimetry (PIV) techniques. In vitro aerosolization and deposition a blend of budesonide and lactose are measured using an Andersen Cascade Impactor. Design parameters such as inhaler grid hole diameter, grid voidage and chamber length are considered. The experimental results reveal that the hole diameter on the grid has negligible impact on the turbulence intensity generated in the chamber. On the other hand, hole diameters smaller than a critical size can lead to performance degradation due to excessive particle-grid collisions. An increase in grid voidage can improve the inhaler performance but the effect diminishes at high grid voidage. An increase in the chamber length can enhance the turbulence intensity generated but also increases the powder adhesion on the inhaler wall.

  14. An integral equation solution for multistage turbomachinery design calculations

    NASA Technical Reports Server (NTRS)

    Mcfarland, Eric R.

    1993-01-01

    A method was developed to calculate flows in multistage turbomachinery. The method is an extension of quasi-three-dimensional blade-to-blade solution methods. Governing equations for steady compressible inviscid flow are linearized by introducing approximations. The linearized flow equations are solved using integral equation techniques. The flows through both stationary and rotating blade rows are determined in a single calculation. Multiple bodies can be modelled for each blade row, so that arbitrary blade counts can be analyzed. The method's benefits are its speed and versatility.

  15. Add-in macros for rapid and versatile calculation of non-compartmental pharmacokinetic parameters on Microsoft Excel spreadsheets.

    PubMed

    Sato, H; Sato, S; Wang, Y M; Horikoshi, I

    1996-06-01

    We developed a package of macro programs (named PK_MOMENT) to automatically calculate non-compartmental pharmacokinetic parameters on Microsoft Excel spreadsheets. These macros include rigorous algorithms to execute moment calculations in a comprehensive manner. An optimum number of terminal data points for infinite-time extrapolation can be calculated with one of these macros so that automatic calculation of infinite moment parameters is possible. The moment calculation with PK_MOMENT provided satisfactory results using the hybrid (mixed linear-logarithmic) trapezoidal method rather than the conventional linear trapezoidal method. The macro-aided pharmacokinetic analyses turned out to be useful in that the macro-containing cells can be easily copied and pasted to analyze other data sets and that powerful tools of Excel can be utilized. The use of our macros will be significantly time-saving for routine pharmacokinetic analyses, considering that pharmacokinetic data are usually stored in a spreadsheet format, typically with Excel.

  16. Cold-Crucible Design Parameters for Next Generation HLW Melters

    SciTech Connect

    Gombert, D.; Richardson, J.; Aloy, A.; Day, D.

    2002-02-26

    The cold-crucible induction melter (CCIM) design eliminates many materials and operating constraints inherent in joule-heated melter (JHM) technology, which is the standard for vitrification of high-activity wastes worldwide. The cold-crucible design is smaller, less expensive, and generates much less waste for ultimate disposal. It should also allow a much more flexible operating envelope, which will be crucial if the heterogeneous wastes at the DOE reprocessing sites are to be vitrified. A joule-heated melter operates by passing current between water-cooled electrodes through a molten pool in a refractory-lined chamber. This design is inherently limited by susceptibility of materials to corrosion and melting. In addition, redox conditions and free metal content have exacerbated materials problems or lead to electrical short-circuiting causing failures in DOE melters. In contrast, the CCIM design is based on inductive coupling of a water-cooled high-frequency electrical coil with the glass, causing eddycurrents that produce heat and mixing. A critical difference is that inductance coupling transfers energy through a nonconductive solid layer of slag coating the metal container inside the coil, whereas the jouleheated design relies on passing current through conductive molten glass in direct contact with the metal electrodes and ceramic refractories. The frozen slag in the CCIM design protects the containment and eliminates the need for refractory, while the corrosive molten glass can be the limiting factor in the JH melter design. The CCIM design also eliminates the need for electrodes that typically limit operating temperature to below 1200 degrees C. While significant marketing claims have been made by French and Russian technology suppliers and developers, little data is available for engineering and economic evaluation of the technology, and no facilities are available in the US to support testing. A currently funded project at the Idaho National Engineering

  17. How to calculate sample size for different study designs in medical research?

    PubMed

    Charan, Jaykaran; Biswas, Tamoghna

    2013-04-01

    Calculation of exact sample size is an important part of research design. It is very important to understand that different study design need different method of sample size calculation and one formula cannot be used in all designs. In this short review we tried to educate researcher regarding various method of sample size calculation available for different study designs. In this review sample size calculation for most frequently used study designs are mentioned. For genetic and microbiological studies readers are requested to read other sources.

  18. Calculated Parameters of Thyroid Homeostasis: Emerging Tools for Differential Diagnosis and Clinical Research

    PubMed Central

    Dietrich, Johannes W.; Landgrafe-Mende, Gabi; Wiora, Evelin; Chatzitomaris, Apostolos; Klein, Harald H.; Midgley, John E. M.; Hoermann, Rudolf

    2016-01-01

    Although technical problems of thyroid testing have largely been resolved by modern assay technology, biological variation remains a challenge. This applies to subclinical thyroid disease, non-thyroidal illness syndrome, and those 10% of hypothyroid patients, who report impaired quality of life, despite normal thyrotropin (TSH) concentrations under levothyroxine (L-T4) replacement. Among multiple explanations for this condition, inadequate treatment dosage and monotherapy with L-T4 in subjects with impaired deiodination have received major attention. Translation to clinical practice is difficult, however, since univariate reference ranges for TSH and thyroid hormones fail to deliver robust decision algorithms for therapeutic interventions in patients with more subtle thyroid dysfunctions. Advances in mathematical and simulative modeling of pituitary–thyroid feedback control have improved our understanding of physiological mechanisms governing the homeostatic behavior. From multiple cybernetic models developed since 1956, four examples have also been translated to applications in medical decision-making and clinical trials. Structure parameters representing fundamental properties of the processing structure include the calculated secretory capacity of the thyroid gland (SPINA-GT), sum activity of peripheral deiodinases (SPINA-GD) and Jostel’s TSH index for assessment of thyrotropic pituitary function, supplemented by a recently published algorithm for reconstructing the personal set point of thyroid homeostasis. In addition, a family of integrated models (University of California-Los Angeles platform) provides advanced methods for bioequivalence studies. This perspective article delivers an overview of current clinical research on the basis of mathematical thyroid models. In addition to a summary of large clinical trials, it provides previously unpublished results of validation studies based on simulation and clinical samples. PMID:27375554

  19. Calculated Parameters of Thyroid Homeostasis: Emerging Tools for Differential Diagnosis and Clinical Research.

    PubMed

    Dietrich, Johannes W; Landgrafe-Mende, Gabi; Wiora, Evelin; Chatzitomaris, Apostolos; Klein, Harald H; Midgley, John E M; Hoermann, Rudolf

    2016-01-01

    Although technical problems of thyroid testing have largely been resolved by modern assay technology, biological variation remains a challenge. This applies to subclinical thyroid disease, non-thyroidal illness syndrome, and those 10% of hypothyroid patients, who report impaired quality of life, despite normal thyrotropin (TSH) concentrations under levothyroxine (L-T4) replacement. Among multiple explanations for this condition, inadequate treatment dosage and monotherapy with L-T4 in subjects with impaired deiodination have received major attention. Translation to clinical practice is difficult, however, since univariate reference ranges for TSH and thyroid hormones fail to deliver robust decision algorithms for therapeutic interventions in patients with more subtle thyroid dysfunctions. Advances in mathematical and simulative modeling of pituitary-thyroid feedback control have improved our understanding of physiological mechanisms governing the homeostatic behavior. From multiple cybernetic models developed since 1956, four examples have also been translated to applications in medical decision-making and clinical trials. Structure parameters representing fundamental properties of the processing structure include the calculated secretory capacity of the thyroid gland (SPINA-GT), sum activity of peripheral deiodinases (SPINA-GD) and Jostel's TSH index for assessment of thyrotropic pituitary function, supplemented by a recently published algorithm for reconstructing the personal set point of thyroid homeostasis. In addition, a family of integrated models (University of California-Los Angeles platform) provides advanced methods for bioequivalence studies. This perspective article delivers an overview of current clinical research on the basis of mathematical thyroid models. In addition to a summary of large clinical trials, it provides previously unpublished results of validation studies based on simulation and clinical samples.

  20. Pre-drilling calculation of geomechanical parameters for safe geothermal wells based on outcrop analogue samples

    NASA Astrophysics Data System (ADS)

    Reyer, Dorothea; Philipp, Sonja

    2014-05-01

    It is desirable to enlarge the profit margin of geothermal projects by reducing the total drilling costs considerably. Substantiated assumptions on uniaxial compressive strengths and failure criteria are important to avoid borehole instabilities and adapt the drilling plan to rock mechanical conditions to minimise non-productive time. Because core material is rare we aim at predicting in situ rock properties from outcrop analogue samples which are easy and cheap to provide. The comparability of properties determined from analogue samples with samples from depths is analysed by performing physical characterisation (P-wave velocities, densities), conventional triaxial tests, and uniaxial compressive strength tests of both quarry and equivalent core samples. "Equivalent" means that the quarry sample is of the same stratigraphic age and of comparable sedimentary facies and composition as the correspondent core sample. We determined the parameters uniaxial compressive strength (UCS) and Young's modulus for 35 rock samples from quarries and 14 equivalent core samples from the North German Basin. A subgroup of these samples was used for triaxial tests. For UCS versus Young's modulus, density and P-wave velocity, linear- and non-linear regression analyses were performed. We repeated regression separately for clastic rock samples or carbonate rock samples only as well as for quarry samples or core samples only. Empirical relations were used to calculate UCS values from existing logs of sampled wellbore. Calculated UCS values were then compared with measured UCS of core samples of the same wellbore. With triaxial tests we determined linearized Mohr-Coulomb failure criteria, expressed in both principal stresses and shear and normal stresses, for quarry samples. Comparison with samples from larger depths shows that it is possible to apply the obtained principal stress failure criteria to clastic and volcanic rocks, but less so for carbonates. Carbonate core samples have higher

  1. Sensitivity of p-nuclei abundance calculations to statistical model parameters

    NASA Astrophysics Data System (ADS)

    Roach, Brandon; Simon, Anna

    2017-01-01

    Many reactions relevant to astrophysics involve nuclei far from stability, and their cross sections must therefore be calculated numerically for input into large-scale stellar nucleosynthesis calculations. Recent work, especially regarding p-process nucleosynthesis, has shown that the observed astrophysical abundances of certain nuclides differ by almost a factor of 10 from those predicted by network calculations using accepted reaction rates. Additionally, significant differences between calculated abundances when using different versions of these rates have been obtained. We therefore present the abundances of p-nuclei calculated using the open-source NucNet Tools code for a 25 solar mass type II supernova model, incorporating reaction cross sections calculated using the statistical-model code TALYS using several α optical potentials and γ-strength functions. This work is supported by the NSF under Grant Numbers PHY-1614442 and PHY-1430152 (JINA-CEE).

  2. Development of design and economic parameters for passive solar systems

    NASA Astrophysics Data System (ADS)

    Woods, R. A.; Harrison, M. P.

    1984-09-01

    In order to reach the energy consumption goals established by executive Order 12003 and Public Law 95-356, the Air Force must integrate conservation measures with present technology. This analysis generates target design and economic parameters for one such technology - passive solar systems. This thesis provides the Air Force design manager with a three phase method of determining the economic feasibility of passive solar heating for a given Military Construction Project. In the first phase, guidelines are presented for preliminary sizing insulation levels and solar collection (glazing) area based on the building location and size. Next, the second phase presented a quantitative energy analysis to achieve an accurate estimate of the energy savings of a passive solar building using the guidelines from the first phase. Finally, the third phase presented a method for economic analysis of passive solar systems using life-cycle costing. This method determines whether the energy savings justifies the incremental increase in construction cost based on a 25 year payback period.

  3. Technique for Calculating Solution Derivatives With Respect to Geometry Parameters in a CFD Code

    NASA Technical Reports Server (NTRS)

    Mathur, Sanjay

    2011-01-01

    A solution has been developed to the challenges of computation of derivatives with respect to geometry, which is not straightforward because these are not typically direct inputs to the computational fluid dynamics (CFD) solver. To overcome these issues, a procedure has been devised that can be used without having access to the mesh generator, while still being applicable to all types of meshes. The basic approach is inspired by the mesh motion algorithms used to deform the interior mesh nodes in a smooth manner when the surface nodes, for example, are in a fluid structure interaction problem. The general idea is to model the mesh edges and nodes as constituting a spring-mass system. Changes to boundary node locations are propagated to interior nodes by allowing them to assume their new equilibrium positions, for instance, one where the forces on each node are in balance. The main advantage of the technique is that it is independent of the volumetric mesh generator, and can be applied to structured, unstructured, single- and multi-block meshes. It essentially reduces the problem down to defining the surface mesh node derivatives with respect to the geometry parameters of interest. For analytical geometries, this is quite straightforward. In the more general case, one would need to be able to interrogate the underlying parametric CAD (computer aided design) model and to evaluate the derivatives either analytically, or by a finite difference technique. Because the technique is based on a partial differential equation (PDE), it is applicable not only to forward mode problems (where derivatives of all the output quantities are computed with respect to a single input), but it could also be extended to the adjoint problem, either by using an analytical adjoint of the PDE or a discrete analog.

  4. Calculation of Weibull strength parameters and Batdorf flow-density constants for volume- and surface-flaw-induced fracture in ceramics

    NASA Technical Reports Server (NTRS)

    Pai, Shantaram S.; Gyekenyesi, John P.

    1988-01-01

    The calculation of shape and scale parameters of the two-parameter Weibull distribution is described using the least-squares analysis and maximum likelihood methods for volume- and surface-flaw-induced fracture in ceramics with complete and censored samples. Detailed procedures are given for evaluating 90 percent confidence intervals for maximum likelihood estimates of shape and scale parameters, the unbiased estimates of the shape parameters, and the Weibull mean values and corresponding standard deviations. Furthermore, the necessary steps are described for detecting outliers and for calculating the Kolmogorov-Smirnov and the Anderson-Darling goodness-of-fit statistics and 90 percent confidence bands about the Weibull distribution. It also shows how to calculate the Batdorf flaw-density constants by uing the Weibull distribution statistical parameters. The techniques described were verified with several example problems, from the open literature, and were coded. The techniques described were verified with several example problems from the open literature, and were coded in the Structural Ceramics Analysis and Reliability Evaluation (SCARE) design program.

  5. The photon dose calculation algorithm used in breast radiotherapy has significant impact on the parameters of radiobiological models.

    PubMed

    Petillion, Saskia; Swinnen, Ans; Defraene, Gilles; Verhoeven, Karolien; Weltens, Caroline; Van den Heuvel, Frank

    2014-07-08

    The comparison of the pencil beam dose calculation algorithm with modified Batho heterogeneity correction (PBC-MB) and the analytical anisotropic algorithm (AAA) and the mutual comparison of advanced dose calculation algorithms used in breast radiotherapy have focused on the differences between the physical dose distributions. Studies on the radiobiological impact of the algorithm (both on the tumor control and the moderate breast fibrosis prediction) are lacking. We, therefore, investigated the radiobiological impact of the dose calculation algorithm in whole breast radiotherapy. The clinical dose distributions of 30 breast cancer patients, calculated with PBC-MB, were recalculated with fixed monitor units using more advanced algorithms: AAA and Acuros XB. For the latter, both dose reporting modes were used (i.e., dose-to-medium and dose-to-water). Next, the tumor control probability (TCP) and the normal tissue complication probability (NTCP) of each dose distribution were calculated with the Poisson model and with the relative seriality model, respectively. The endpoint for the NTCP calculation was moderate breast fibrosis five years post treatment. The differences were checked for significance with the paired t-test. The more advanced algorithms predicted a significantly lower TCP and NTCP of moderate breast fibrosis then found during the corresponding clinical follow-up study based on PBC calculations. The differences varied between 1% and 2.1% for the TCP and between 2.9% and 5.5% for the NTCP of moderate breast fibrosis. The significant differences were eliminated by determination of algorithm-specific model parameters using least square fitting. Application of the new parameters on a second group of 30 breast cancer patients proved their appropriateness. In this study, we assessed the impact of the dose calculation algorithms used in whole breast radiotherapy on the parameters of the radiobiological models. The radiobiological impact was eliminated by

  6. An Efficient Method to Calculate the Failure Rate of Dynamic Systems with Random Parameters using the Total Probability Theorem

    DTIC Science & Technology

    2015-05-12

    using a vibratory system . Our approach can be easily extended to non-stationary Gaussian input processes. Introduction The response of a vibratory...Page 1 of 9 15IDM-0105 An Efficient Method to Calculate the Failure Rate of Dynamic Systems with Random Parameters using the Total Probability...failure rate of a linear vibratory system with random parameters excited by stationary Gaussian processes. The response of such a system is non

  7. Calculation of solute transport parameters from the breakthrough experimental data using solute transport models

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Traditionally, a two-parameter partial differential equation has been used to describe the one-dimensional convective-dispersive transport of chemicals in field soils. The parameters in this equation include the dispersion coefficient and a distribution coefficient, the latter accounting for interac...

  8. Numerical Procedures for the Calculations of Inorganic Solubility and Cohesive Parameters

    NASA Technical Reports Server (NTRS)

    Lawson, D.

    1996-01-01

    The entire history of chemistry bears witness to the extraorinary importance of the phenomena of solubility. It is necessary to emphasize that the Hildebrand parameter (solubility parameter) is fundamentally a liquid state property. When gases are considered they are treated as hypothetical.

  9. Inverse gas chromatographic study of the oxidation stability of lubricating base oils via solubility parameter calculations.

    PubMed

    Moustafa, Nagy Emam; Eissa, Elham Ahmed

    2007-11-01

    The Flory-Huggins interaction parameter (chi1, 2(infinity)) and solubility parameter (delta2) and its hydrogen bonding sensing component (delta(h)) were determined using inverse gas chromatography (IGC). These parameters were successfully used in the probes of chemical changes that occur during the oxidation of naphthenic and paraffinic base oils in a GC column. Changes in chi1, 2(infinity) values reflect the different types of intermolecular interactions (dispersive, polar, hydrogen bonding) of the given lubricating base oil during oxidation. The obtained results showed that delta(h) component of solubility parameter is the most important parameter for probing the oxidative-chemical changes during the oxidation of given lubricating oils.

  10. Strategy and calculations for the design of baffles for Wolter Type II telescopes

    NASA Technical Reports Server (NTRS)

    Mangus, John D.

    1988-01-01

    Spaceflight, stellar pointing telescopes require baffle systems to define the field of view and protect this observational area from stray and scattered light. In the case of near normal incidence telescope systems, the problem consists in controlling the stray/scattered radiation reaching the image plane when circular plates, the primary and secondary mirrors, are the imaging elements. The case addressed in this paper is quite different in that it involves baffling two conical surfaces, i.e., the primary and secondary mirrors of a Wolter Type II telescope. A strategy is described for systematically moving through the telescope system and establishing criteria for placement of baffles. Calculations are given which determine the size and number of permitted baffles as a function of practical physical parameters. Clear options are given for the design of minimum baffle lengths to meet packaging constraints.

  11. Evaluation of centrifugation parameters for density gradient experiments by means of a programmable pocket calculator.

    PubMed

    Kreutzfeldt, C

    1980-10-01

    A calculation program is proposed suitable for programmable pocket calculators (e.g. HP series) to estimate s20,w f omega2 dt values from density gradient centrifugation data. The program can be applied to linear or exponential density gradients prepared from sucrose or glycerol solutions spun in zonal rotors or swinging bucket rotors. A wide solute concentration range and temperature range is accounted for. Constants for empirical density calculation of glycerol and sucrose solutions concentrated in % (w/v) are estimated. Experimental verification of the program was carried out.

  12. Probabilistic seismic hazard characterization and design parameters for the Pantex Plant

    SciTech Connect

    Bernreuter, D. L.; Foxall, W.; Savy, J. B.

    1998-10-19

    The Hazards Mitigation Center at Lawrence Livermore National Laboratory (LLNL) updated the seismic hazard and design parameters at the Pantex Plant. The probabilistic seismic hazard (PSH) estimates were first updated using the latest available data and knowledge from LLNL (1993, 1998), Frankel et al. (1996), and other relevant recent studies from several consulting companies. Special attention was given to account for the local seismicity and for the system of potentially active faults associated with the Amarillo-Wichita uplift. Aleatory (random) uncertainty was estimated from the available data and the epistemic (knowledge) uncertainty was taken from results of similar studies. Special attention was given to soil amplification factors for the site. Horizontal Peak Ground Acceleration (PGA) and 5% damped uniform hazard spectra were calculated for six return periods (100 yr., 500 yr., 1000 yr., 2000 yr., 10,000 yr., and 100,000 yr.). The design parameters were calculated following DOE standards (DOE-STD-1022 to 1024). Response spectra for design or evaluation of Performance Category 1 through 4 structures, systems, and components are presented.

  13. Control system design using frequency domain models and parameter optimization, with application to supersonic inlet controls

    NASA Technical Reports Server (NTRS)

    Seidel, R. C.; Lehtinen, B.

    1974-01-01

    A technique is described for designing feedback control systems using frequency domain models, a quadratic cost function, and a parameter optimization computer program. FORTRAN listings for the computer program are included. The approach is applied to the design of shock position controllers for a supersonic inlet. Deterministic or random system disturbances, and the presence of random measurement noise are considered. The cost function minimization is formulated in the time domain, but the problem solution is obtained using a frequency domain system description. A scaled and constrained conjugate gradient algorithm is used for the minimization. The approach to a supersonic inlet included the calculations of the optimal proportional-plus integral (PI) and proportional-plus-integral-plus-derivative controllers. A single-loop PI controller was the most desirable of the designs considered.

  14. A few ways of calculating the similarity parameter kappa* for real gases. [increase Reynolds number in cryogenic wind tunnels

    NASA Technical Reports Server (NTRS)

    Lorenz-Meyer, W.

    1977-01-01

    In connection with the question on the applicability of test results obtained from cryogenic wind tunnels to the large-scale model the similarity parameter is referred to. A simple method is given for calculating the similarity parameter. From the numerical values obtained it can be deduced that nitrogen behaves practically like an ideal gas when it is close to the saturation point and in a pressure range up to 4 bar. The influence of this parameter on the pressure distribution of a supercritical profile confirms this finding.

  15. Relativistic Calculating the Spectral Lines Hyperfine Structure Parameters for Heavy Ions

    SciTech Connect

    Khetselius, O. Yu.

    2008-10-22

    The energies and constants of the hyperfine structure, derivatives of the one-electron characteristics on nuclear radius, nuclear electric quadrupole, magnetic dipole moments for some Li-like multicharged ions are calculated.

  16. Design and Study of the Instrument to Assess Students' Attitude toward Graphing Calculator

    ERIC Educational Resources Information Center

    Reznichenko, Nataliya

    2007-01-01

    Assumptions: In mathematics learning, one of the considerations in the graphing calculator (GC) use is to understand students' attitude toward calculators. Rationale: This presentation describes design of an assessment instrument of students' attitude toward graphing calculator. Objectives: A pilot study that assessed the effectiveness of the…

  17. Irradiation Experiment Conceptual Design Parameters for NBSR Fuel Conversion

    SciTech Connect

    Brown N. R.; Brown,N.R.; Baek,J.S; Hanson, A.L.; Cuadra,A.; Cheng,L.Y.; Diamond, D.J.

    2013-03-31

    It has been proposed to convert the National Institute of Standards and Technology (NIST) research reactor, known as the NBSR, from high-enriched uranium (HEU) fuel to low-enriched uranium (LEU) fuel. The motivation to convert the NBSR to LEU fuel is to reduce the risk of proliferation of special nuclear material. This report is a compilation of relevant information from recent studies related to the proposed conversion using a metal alloy of LEU with 10 w/o molybdenum. The objective is to inform the design of the mini-plate and full-size plate irradiation experiments that are being planned. This report provides relevant dimensions of the fuel elements, and the following parameters at steady state: average and maximum fission rate density and fission density, fuel temperature distribution for the plate with maximum local temperature, and two-dimensional heat flux profiles of fuel plates with high power densities. . The latter profiles are given for plates in both the inner and outer core zones and for cores with both fresh and depleted shim arms (reactivity control devices). In addition, a summary of the methodology to obtain these results is presented.

  18. Design Parameter Studies of Emission-Based Iron Opacity Measurements

    NASA Astrophysics Data System (ADS)

    Martin, Madison E.; London, Richard A.; Goluoglu, Sedat; Whitley, Heather D.

    2016-10-01

    Opacity is a critical parameter in the transport of radiation in systems such as inertial confinement fusion capsules and stars. The resolution of current disagreements between solar models and helioseismological observations would benefit from experimental validation of theoretical opacity models. Short pulse lasers can be used to heat targets to higher temperatures and densities than long pulse lasers and pulsed power machines, thus potentially enabling access to x-ray emission spectra at conditions relevant to solar models. The radiation-hydrodynamic code HYDRA is used to investigate the effects of modifying laser energy, laser pulse length, and target dimensions on the plasma conditions, x-ray emission, and inferred opacity of a buried layer iron target. The accuracy of the opacity inference is sensitive to tamper emission and optical depth effects. An example design that reaches temperatures and densities relevant to the radiative zone of the sun while reducing optical depth and tamper emission effects will be discussed. This work was performed under the auspices of the U.S. Department of Energy by Lawrence Livermore National Laboratory under Contract DE-AC52-07NA27344. Lawrence Livermore National Security, LLC.

  19. Irradiation Experiment Conceptual Design Parameters for NBSR Fuel Conversion

    SciTech Connect

    Brown, N. R.; Brown, N. R.; Baek, J. S; Hanson, A. L.; Cuadra, A.; Cheng, L. Y.; Diamond, D. J.

    2014-04-30

    It has been proposed to convert the National Institute of Standards and Technology (NIST) research reactor, known as the NBSR, from high-enriched uranium (HEU) fuel to low-Enriched uranium (LEU) fuel. The motivation to convert the NBSR to LEU fuel is to reduce the risk of proliferation of special nuclear material. This report is a compilation of relevant information from recent studies related to the proposed conversion using a metal alloy of LEU with 10 w/o molybdenum. The objective is to inform the design of the mini-plate and full-size-Plate irradiation experiments that are being planned. This report provides relevant dimensions of the fuel elements, and the following parameters at steady state: average and maximum fission rate density and fission density, fuel temperature distribution for the plate with maximum local temperature, and two-dimensional heat flux profiles of fuel plates with high power densities. The latter profiles are given for plates in both the inner and outer core zones and for cores with both fresh and depleted shim arms (reactivity control devices). A summary of the methodology to obtain these results is presented. Fuel element tolerance assumptions and hot channel factors used in the safety analysis are also given.

  20. Design Parameters of a Miniaturized Piezoelectric Underwater Acoustic Transmitter

    SciTech Connect

    Li, Huidong; Deng, Zhiqun; Yuan, Yong; Carlson, Thomas J.

    2012-07-02

    The Juvenile Salmon Acoustic Telemetry System (JSATS) project supported by the U.S. Army Corps of Engineers, Portland District, has yielded the smallest acoustic fish tag transmitter commercially available to date. In order to study even smaller fish populations and make the transmitter injectable by needles, the JSATS acoustic micro transmitter needs to be further downsized. As part of the transmitter downsizing effort some of the design parameters of the lead zirconate titanate (PZT) ceramic tube transducer in the transmitter were studied, including the type of PZT, the backing material, the necessary drive voltage, the transmitting bandwidth and the length of the transducer. It was found that, to satisfy the 156-dB source level requirement of JSATS, a square wave with a 10-volt amplitude is required to drive 'soft' PZT transducers. PZT-5H demonstrated the best source level performance. For Navy types I and II, 16 volts or 18 volts were needed. Ethylene-propylene-diene monomer (EPDM) closed-cell foam was found to be the backing material providing the highest source level. The effect of tube length on the source level is also demonstrated in this paper, providing quantitative information for downsizing of small piezoelectric transmitters.

  1. Information Extraction of High Resolution Remote Sensing Images Based on the Calculation of Optimal Segmentation Parameters

    PubMed Central

    Zhu, Hongchun; Cai, Lijie; Liu, Haiying; Huang, Wei

    2016-01-01

    Multi-scale image segmentation and the selection of optimal segmentation parameters are the key processes in the object-oriented information extraction of high-resolution remote sensing images. The accuracy of remote sensing special subject information depends on this extraction. On the basis of WorldView-2 high-resolution data, the optimal segmentation parameters methodof object-oriented image segmentation and high-resolution image information extraction, the following processes were conducted in this study. Firstly, the best combination of the bands and weights was determined for the information extraction of high-resolution remote sensing image. An improved weighted mean-variance method was proposed andused to calculatethe optimal segmentation scale. Thereafter, the best shape factor parameter and compact factor parameters were computed with the use of the control variables and the combination of the heterogeneity and homogeneity indexes. Different types of image segmentation parameters were obtained according to the surface features. The high-resolution remote sensing images were multi-scale segmented with the optimal segmentation parameters. Ahierarchical network structure was established by setting the information extraction rules to achieve object-oriented information extraction. This study presents an effective and practical method that can explain expert input judgment by reproducible quantitative measurements. Furthermore the results of this procedure may be incorporated into a classification scheme. PMID:27362762

  2. Information Extraction of High Resolution Remote Sensing Images Based on the Calculation of Optimal Segmentation Parameters.

    PubMed

    Zhu, Hongchun; Cai, Lijie; Liu, Haiying; Huang, Wei

    2016-01-01

    Multi-scale image segmentation and the selection of optimal segmentation parameters are the key processes in the object-oriented information extraction of high-resolution remote sensing images. The accuracy of remote sensing special subject information depends on this extraction. On the basis of WorldView-2 high-resolution data, the optimal segmentation parameters methodof object-oriented image segmentation and high-resolution image information extraction, the following processes were conducted in this study. Firstly, the best combination of the bands and weights was determined for the information extraction of high-resolution remote sensing image. An improved weighted mean-variance method was proposed andused to calculatethe optimal segmentation scale. Thereafter, the best shape factor parameter and compact factor parameters were computed with the use of the control variables and the combination of the heterogeneity and homogeneity indexes. Different types of image segmentation parameters were obtained according to the surface features. The high-resolution remote sensing images were multi-scale segmented with the optimal segmentation parameters. Ahierarchical network structure was established by setting the information extraction rules to achieve object-oriented information extraction. This study presents an effective and practical method that can explain expert input judgment by reproducible quantitative measurements. Furthermore the results of this procedure may be incorporated into a classification scheme.

  3. Jet pumps for thermoacoustic applications: Design guidelines based on a numerical parameter study.

    PubMed

    Oosterhuis, Joris P; Bühler, Simon; Wilcox, Douglas; van der Meer, Theo H

    2015-10-01

    The oscillatory flow through tapered cylindrical tube sections (jet pumps) is characterized by a numerical parameter study. The shape of a jet pump results in asymmetric hydrodynamic end effects which cause a time-averaged pressure drop to occur under oscillatory flow conditions. Hence, jet pumps are used as streaming suppressors in closed-loop thermoacoustic devices. A two-dimensional axisymmetric computational fluid dynamics model is used to calculate the performance of a large number of conical jet pump geometries in terms of time-averaged pressure drop and acoustic power dissipation. The investigated geometrical parameters include the jet pump length, taper angle, waist diameter, and waist curvature. In correspondence with previous work, four flow regimes are observed which characterize the jet pump performance and dimensionless parameters are introduced to scale the performance of the various jet pump geometries. The simulation results are compared to an existing quasi-steady theory and it is shown that this theory is only applicable in a small operation region. Based on the scaling parameters, an optimum operation region is defined and design guidelines are proposed which can be directly used for future jet pump design.

  4. Parametric design calculations using Green's function to determine unique source

    NASA Astrophysics Data System (ADS)

    Carter, L. L.; Lan, J. S.

    1991-01-01

    The energy dependence of the current incident on a macrocell can in principle be determined if the Green's function and the interior flux due to the total current are known. The Green's function is the flux within some portion of the macrocell due to a unit source in each energy group. It was demonstrated that the appropriate solution for the current is obtained for the higher energy groups in a fast reactor example. However, the lower energy groups are very sensitive to the downscattering and the solution even led to negative values for the incident partial current in some energy groups, which is not physical. In this particular example, the preliminary design study was insensitive to the incident current of the lower energy groups. For problems where the lower groups are important, it would seem prudent to abandon the exact solution and use a weighted least squares solution. Such a weighted least squares solution could assign importance for obtaining nearly the exact solution for as many energy groups as possible, while simultaneously making slight adjustments in the higher energy currents to obtain downscatter contributions that will approximately perserve the flux in the lower energy groups.

  5. Calculation of Nuclear Level Density Parameters of Some Light Deformed Medical Radionuclides Using Collective Excitation Modes of Observed Nuclear Spectra

    NASA Astrophysics Data System (ADS)

    Okuducu, Ş.; Akti, N. N.; Saraç, H.; Bölükdemir, M. H.; Tel, E.

    In this study the nuclear energy level density based on nuclear collective excitation mechanism has been identified in terms of the low-lying collective level bands near the neutron binding energy. Nuclear level density parameters of some light deformed medical radionuclides used widely in medical applications have been calculated by using different collective excitation modes of observed nuclear spectra. The calculated parameters have been used successfully in estimation of the neutron-capture cross section basic data for the production of new medical radionuclides. The investigated radionuclides have been considered in the region of mass number 40calculated results have been compared with the compiled values from the literatures for s-wave neutron resonance data.

  6. Calculation of the structural parameters of small cadmium selenide clusters, (CdSe)n, n = 1,2,3

    NASA Astrophysics Data System (ADS)

    Alselawe, A. I. A.; Gopir, G.; Anas, M. M.

    2016-11-01

    The structural parameters of small cadmium selenide clusters (CdSe)n, for n=1,2, and 3 were studied. The calculations were performed using the pseudopotential and planewave basis sets, within the density functional theory. These parameters for geometry optimization can be used as elementary information for further investigations. The total energy calculations for the three linear structures of (CdSe)2 showed that these isomers are close in their stability. The rhombus structure (CdSe)2 planar is more stable isomer. The bond distances for the different structures show that the distances decrease with increasing the atoms in the structure. The calculated bond angles were close to other relevant studies.

  7. The resolution of the identity approximation for calculations of spin-spin contribution to zero-field splitting parameters

    NASA Astrophysics Data System (ADS)

    Ganyushin, Dmitry; Gilka, Natalie; Taylor, Peter R.; Marian, Christel M.; Neese, Frank

    2010-04-01

    In this work, the resolution of the identity (RI) approximation is developed for the calculation of the electron-electron spin-spin coupling (SSC) interaction that is a central component of the zero-field splitting (ZFS) term in the effective spin Hamiltonian. The approximated integrals are then used in large-scale multireference configuration interaction treatments of the SSC interaction. The SSC contribution to the ZFS is treated using the Breit-Pauli spin-spin Hamiltonian in conjunction with first-order perturbation theory. Test calculations on a set of diatomic molecules reveal that the error of the RI approximation does not exceed 0.01 cm-1 even if standard auxiliary basis sets are used. This error of less than 1% is considered to be negligible compared to the presently achievable accuracy of the SSC calculations relative to experimental data. The present development allows the correlated ab initio calculation of ZFS parameters of larger systems such as linear polyenes and linear polyacenes. The basis set convergence of the calculated ZFS values was investigated, and the effect of electronic correlation on the calculated ZFS parameters is discussed.

  8. DFT Calculations on Mössbauer Parameters of Nonheme Iron Nitrosyls

    PubMed Central

    Hopmann, Kathrin H.; Ghosh, Abhik; Noodleman, Louis

    2009-01-01

    DFT calculations on transition metal nitrosyls often reveal unusual spin density profiles, involving substantial spatial separation of majority and minority spin densities. Against this context, there is a significant lack of studies where DFT calculations have been quantitatively calibrated against experimental spectroscopic properties. Reported herein are DFT calculations of Mössbauer isomer shifts and quadrupole splittings for 21 nonheme iron complexes (26 distinct iron sites) including 9 iron nitrosyls. Low- (S = 1/2) and high-spin (S = 3/2) {FeNO}7 complexes, S = 1/2 {Fe(NO)2}9 species, and polynuclear iron nitrosyls are all represented within the set of compounds examined. The general conclusion with respect to isomer shifts is that DFT (OLYP/STO-TZP) performs comparably well for iron nitrosyls and for iron complexes in general. However, quadrupole splittings are less accurately reproduced for nitrosyl complexes. PMID:19780615

  9. On the Methodology to Calculate the Covariance of Estimated Resonance Parameters

    SciTech Connect

    Becker, B.; Kopecky, S.; Schillebeeckx, P.

    2015-01-15

    Principles to determine resonance parameters and their covariance from experimental data are discussed. Different methods to propagate the covariance of experimental parameters are compared. A full Bayesian statistical analysis reveals that the level to which the initial uncertainty of the experimental parameters propagates, strongly depends on the experimental conditions. For high precision data the initial uncertainties of experimental parameters, like a normalization factor, has almost no impact on the covariance of the parameters in case of thick sample measurements and conventional uncertainty propagation or full Bayesian analysis. The covariances derived from a full Bayesian analysis and least-squares fit are derived under the condition that the model describing the experimental observables is perfect. When the quality of the model can not be verified a more conservative method based on a renormalization of the covariance matrix is recommended to propagate fully the uncertainty of experimental systematic effects. Finally, neutron resonance transmission analysis is proposed as an accurate method to validate evaluated data libraries in the resolved resonance region.

  10. Calculations of the heights, periods, profile parameters, and energy spectra of wind waves

    NASA Technical Reports Server (NTRS)

    Korneva, L. A.

    1975-01-01

    Sea wave behavior calculations require the precalculation of wave elements as well as consideration of the spectral functions of ocean wave formation. The spectrum of the random wave process is largely determined by the distribution of energy in the actual wind waves observed on the surface of the sea as expressed in statistical and spectral characteristics of the sea swell.

  11. CONTROL OF LASER RADIATION PARAMETERS: Stabilisation of a laser by the calculated quantum transition frequency

    NASA Astrophysics Data System (ADS)

    Bagaev, S. N.; Dmitriev, A. K.; Lugovoy, A. A.

    2008-01-01

    A method is proposed to stabilise the frequency of a He—Ne laser with an intracavity nonlinear absorption cell by the calculated frequency of the 7→6 transition of F2(2)P(7)ν3 in methane. The long-term frequency stability and reproducibility are measured for a He—Ne/CH4 laser with a telescopic cavity.

  12. Dosimetric parameters of the new design (103)Pd brachytherapy source based on Monte Carlo study.

    PubMed

    Saidi, Pooneh; Sadeghi, Mahdi; Shirazi, Alireza; Tenreiro, Claudio

    2012-01-01

    In this study version 5 of the MCNP photon transport simulation was used to calculate the dosimetric parameters for new palladium brachytherapy source design following AAPM Task Group No. 43U1 report. The internal source components include four resin beads of 0.6 mm diameters with (103)Pd uniformly absorbed inside and one cylindrical copper marker with 1.5 mm length. The resin beads and marker are then encapsulated within 0.8 mm in diameter and 4.5 mm long cylindrical capsule of titanium. The dose rate constant, Λ, line and point-source radial dose function, g(L)(r) and g(P)(r), and the anisotropy function, F(r,θ) of the IR01-(103)Pd seed have been calculated at distances from 0.25 to 5 cm. All the results are in good agreement with previously published thermoluminescence-dosimeter measured values [3] for the source. The dosimetric parameters calculated in this work showed that in dosimetry point of view, the IR01-(103)Pd seed is suitable for use in brachytherapy of prostate cancer.

  13. Sensitivity analysis of a dry-processed Candu fuel pellet's design parameters

    SciTech Connect

    Choi, Hangbok; Ryu, Ho Jin

    2007-07-01

    Sensitivity analysis was carried out in order to investigate the effect of a fuel pellet's design parameters on the performance of a dry-processed Canada deuterium uranium (CANDU) fuel and to suggest the optimum design modifications. Under a normal operating condition, a dry-processed fuel has a higher internal pressure and plastic strain due to a higher fuel centerline temperature when compared with a standard natural uranium CANDU fuel. Under a condition that the fuel bundle dimensions do not change, sensitivity calculations were performed on a fuel's design parameters such as the axial gap, dish depth, gap clearance and plenum volume. The results showed that the internal pressure and plastic strain of the cladding were most effectively reduced if a fuel's element plenum volume was increased. More specifically, the internal pressure and plastic strain of the dry-processed fuel satisfied the design limits of a standard CANDU fuel when the plenum volume was increased by one half a pellet, 0.5 mm{sup 3}/K. (authors)

  14. Impact of eigenvalues on the pseudopotential calculation of superconducting parameters of metals Ga, Cd and In

    NASA Astrophysics Data System (ADS)

    Yadav, Jayprakash; Rafique, S. M.; Kumari, Shanti

    2009-10-01

    In the present paper some superconducting (SC) state parameters of metals Ga, Cd and In have been studied through Harrison's First Principle [HFP] pseudopotential technique using McMillan's formalism. The impact of choosing two different sets of core energy eigenvalues viz. Herman-Skillman and Clementi (or Experimental) has been studied.

  15. Influence of different approaches for calculating the athlete's mechanical energy on energetic parameters in the pole vault.

    PubMed

    Schade, F; Arampatzis, A; Brüggemann, G

    2000-10-01

    The purposes of this study were as follows: (1) To determine the differences between two- and three-dimensionally calculated energy of the athlete in the pole vault. (2) To determine the differences between CM energy and total body energy. (3) To examine the influence of these different approaches of calculating the athlete's energy on energetic parameter values during the pole vault. Kinematic data were gathered during the pole vault final of the track and field world championships in 1997. Two video cameras (50Hz) covered the last step of the approach including the pole plant and 2 cameras covered the pole phase up to bar clearance, respectively. Twenty successful jumps were analysed. The characteristics of the energy development is similar for the different approaches. Initial energy, energy at maximum pole bend and energy at pole release (primary parameters) show significant differences (p<0.05). The findings indicate that rotatory movements and movements relative to the CM have a larger influence on the primary parameters than movements apart from the main plane of movement. For analysing the energy exchange between the athlete and the elastic implement pole only the differences among the secondary parameters (initial energy minus energy at maximum pole bend, final energy minus energy at maximum pole bend) are needed (Arampatzis et al., 1997 Biomechanical Research Project at the Vth World Championships in Athletics, Athens 1997: Preliminary Report. New Studies in Athletics 13, 66-69). For those parameters the relative differences between the calculation approaches range only between 1.47 and 0.04%. This indicates that the influence of the different approaches for calculating the athlete's energy on the analysis of energy exchange is negligible.

  16. Engineering reactions in crystalline solids: predicting photochemical decarbonylation from calculated thermochemical parameters.

    PubMed

    Campos, Luis M; Dang, Hung; Ng, Danny; Yang, Zhe; Martinez, Hernan L; Garcia-Garibay, Miguel A

    2002-05-31

    A detailed thermochemical analysis of the alpha-cleavage and decarbonylation reactions of acetone and several ketodiesters was carried out with the B3LYP/6-31G* density functional method. The heats of formation of several ground-state ketones and radicals were calculated at 298 K to determine bond dissociation energies (BDE) and radical stabilization energies (RSE) as a function of substituents. Results show that the radical-stabilizing abilities of the ketone substituents play a very important role on the thermodynamics of the alpha-cleavage and decarbonylation steps. An excellent correlation between calculated values and previous experimental observations suggests that photochemical alpha-cleavage and decarbonylation in crystals should be predictable from knowledge of excitation energies and the RSE of the substituent.

  17. Methods and new approaches to the calculation of physiological parameters by videodensitometry

    NASA Technical Reports Server (NTRS)

    Kedem, D.; Londstrom, D. P.; Rhea, T. C., Jr.; Nelson, J. H.; Price, R. R.; Smith, C. W.; Graham, T. P., Jr.; Brill, A. B.; Kedem, D.

    1976-01-01

    A complex system featuring a video-camera connected to a video disk, cine (medical motion picture) camera and PDP-9 computer with various input/output facilities has been developed. This system enables the performance of quantitative analysis of various functions recorded in clinical studies. Several studies are described, such as heart chamber volume calculations, left ventricle ejection fraction, blood flow through the lungs and also the possibility of obtaining information about blood flow and constrictions in small cross-section vessels

  18. Monte Carlo calculations and experimental measurements of dosimetric parameters of the IRA-103Pd brachytherapy source.

    PubMed

    Sadeghi, Mahdi; Raisali, Gholamreza; Hosseini, S Hamed; Shavar, Arzhang

    2008-04-01

    This article presents a brachytherapy source having 103Pd adsorbed onto a cylindrical silver rod that has been developed by the Agricultural, Medical, and Industrial Research School for permanent implant applications. Dosimetric characteristics (radial dose function, anisotropy function, and anisotropy factor) of this source were experimentally and theoretically determined in terms of the updated AAPM Task group 43 (TG-43U1) recommendations. Monte Carlo simulations were used to calculate the dose rate constant. Measurements were performed using TLD-GR200A circular chip dosimeters using standard methods employing thermoluminescent dosimeters in a Perspex phantom. Precision machined bores in the phantom located the dosimeters and the source in a reproducible fixed geometry, providing for transverse-axis and angular dose profiles over a range of distances from 0.5 to 5 cm. The Monte Carlo N-particle (MCNP) code, version 4C simulation techniques have been used to evaluate the dose-rate distributions around this model 103Pd source in water and Perspex phantoms. The Monte Carlo calculated dose rate constant of the IRA-103Pd source in water was found to be 0.678 cGy h(-1) U(-1) with an approximate uncertainty of +/-0.1%. The anisotropy function, F(r, theta), and the radial dose function, g(r), of the IRA- 103Pd source were also measured in a Perspex phantom and calculated in both Perspex and liquid water phantoms.

  19. Comparison of ionospheric parameters calculated with UAM and measured at Voeykovo observatory

    NASA Astrophysics Data System (ADS)

    Rybakov, M. V.; Namgaladze, A. A.; Karpov, M. I.

    2016-09-01

    The measurements of the critical frequencies of the ionospheric F2 layer based on vertical radiosounding, which was performed with a CADI digital ionosonde at the Voeykovo magnetic-ionospheric observatory in February 2013, have been considered. The observations have been compared with the upper atmosphere numerical model (UAM) data for three days that differ in the amplitude and the character of solar and magnetic activity and correspond to quiet and moderately disturbed states of the ionosphere. The work was performed in order to improve the methods for determining the ionospheric state by vertical sounding ionograms. The time variations in the F2 layer critical frequency, electric field vector zonal component, and thermospheric wind velocity meridional component have been analyzed. Calculations were performed with three UAM variants. The UAM version providing the best agreement with the CADI ionosonde data was the version in which the neutral temperature, neutral composition, and pressure gradients are calculated according to the MSIS empirical model and the horizontal neutral wind velocity is determined by the equation of motion with pressure gradients from MSIS. The calculated values corresponded to the measurements, except those for the evening, because the electron density at the ionospheric F2 layer maximum depends more strongly on electric fields and thermospheric wind velocities during this period. Thus, the indicated UAM version with the above limitations can be used to determine the state of the subauroral ionosphere.

  20. SAMPLE SIZE/POWER CALCULATION FOR STRATIFIED CASE-COHORT DESIGN

    PubMed Central

    Hu, Wenrong; Cai, Jianwen; Zeng, Donglin

    2014-01-01

    The Case-cohort (CC) study design usually has been used for risk factor assessment in epidemiologic studies or disease prevention trials for rare diseases. The sample size/power calculation for the CC design is given in Cai and Zeng [1]. However, the sample size/power calculation for a stratified case-cohort (SCC) design has not been addressed before. This article extends the results of Cai and Zeng [1] to the SCC design. Simulation studies show that the proposed test for the SCC design utilizing small sub-cohort sampling fractions is valid and efficient for situations where the disease rate is low. Furthermore, optimization of sampling in the SCC design is discussed and compared with proportional and balanced sampling techniques. An epidemiological study is provided to illustrate the sample size calculation under the SCC design. PMID:24889145

  1. Ocean color spectrum calculations. [theoretical models relating oceanographic parameters to upwelling radiances

    NASA Technical Reports Server (NTRS)

    Mccluney, W. R.

    1974-01-01

    The development is considered of procedures for measuring a number of subsurface oceanographic parameters using remotely sensed ocean color data. It is proposed that the first step in this effort should be the development of adequate theoretical models relating the desired oceanographic parameters to the upwelling radiances to be observed. A portion of a contributory theoretical model is shown to be described by a modified single scattering approach based upon a simple treatment of multiple scattering. The resulting quasi-single scattering model can be used to predict the upwelling distribution of spectral radiance emerging from the sea. The shape of the radiance spectrum predicted by this model for clear ocean water shows encouraging agreement with measurments made at the edge of the Sargasso Sea off Cape Hatteras.

  2. [Design of high performance DSP-based gradient calculation module for MRI].

    PubMed

    Pan, Wenyu; Zhang, Fu; Luo, Hai; Zhou, Heqin

    2011-05-01

    A gradient calculation module based on high performance DSP was designed to meet the needs of digital MRI spectrometer. According to the requirements of users, this apparatus can achieve rotation transformation, pre-emphasis, shimming and other gradient calculation functions in a single chip of DSP. It then outputs gradient waveform data of channel X, Y, Z and shimming data of channel B0. Experiments show that the design has good versatility and can satisfy the functional, speed and accuracy requirements of MRI gradient calculation. It provides a practical gradient calculation solution for the development of digital spectrometer.

  3. Data files for ab initio calculations of the lattice parameter and elastic stiffness coefficients of bcc Fe with solutes.

    PubMed

    Fellinger, Michael R; Hector, Louis G; Trinkle, Dallas R

    2017-02-01

    We present computed datasets on changes in the lattice parameter and elastic stiffness coefficients of bcc Fe due to substitutional Al, B, Cu, Mn, and Si solutes, and octahedral interstitial C and N solutes. The data is calculated using the methodology based on density functional theory (DFT) presented in Ref. (M.R. Fellinger, L.G. Hector Jr., D.R. Trinkle, 2017) [1]. All the DFT calculations were performed using the Vienna Ab initio Simulations Package (VASP) (G. Kresse, J. Furthmüller, 1996) [2]. The data is stored in the NIST dSpace repository (http://hdl.handle.net/11256/671).

  4. A summary of the sources of input parameter values for the Waste Isolation Pilot Plant final porosity surface calculations

    SciTech Connect

    Butcher, B.M.

    1997-08-01

    A summary of the input parameter values used in final predictions of closure and waste densification in the Waste Isolation Pilot Plant disposal room is presented, along with supporting references. These predictions are referred to as the final porosity surface data and will be used for WIPP performance calculations supporting the Compliance Certification Application to be submitted to the U.S. Environmental Protection Agency. The report includes tables and list all of the input parameter values, references citing their source, and in some cases references to more complete descriptions of considerations leading to the selection of values.

  5. Magnetic Field Line Tracing Calculations for Conceptual PFC Design in the National Compact Stellarator Experiment

    SciTech Connect

    Maingi, R; Kaiser, T; Hill, D N; Lyon, J F; Monticello, D; Zarnstorff, M C

    2006-06-12

    The National Compact Stellarator Experiment (NCSX) is a three-field period compact stellarator presently in the construction phase at Princeton, NJ. The design parameters of the device are major radius R=1.4m, average minor radius = 0.32m, 1.2 {le} toroidal field (B{sub t}) {le} 1.7 T, and auxiliary input power up to 12 MW with neutral beams and radio-frequency heating. The NCSX average aspect ratio of 4.4 lies well below present stellarator experiments and designs, enabling the investigation of high {beta} physics in a compact stellarator geometry. Also the NCSX design choice for a quasi-axisymmetric configuration aims toward the achievement of tokamak-like transport. In this paper, we report on the magnetic field line tracing calculations used to evaluate conceptual plasma facing component (PFC) designs. In contrast to tokamaks, axisymmetric target plates are not required to intercept the majority of the heat flux in stellarators, owing to the nature of the 3-D magnetic field footprint. The divertor plate design investigated in this study covers approximately one half of the toroidal extent in each period. Typical Poincare plots in Figure 1 illustrate the plasma cross-section at several toroidal angles for a computed NCSX high-beta equilibrium. The plates used for these calculations are centered in each period about the elongated cross-section shown in Figure 1a, extending to +/- {pi}/6 in each direction. Two methods for tracing the edge field line topology were used in this study. The first entails use of the VMEC/MFBE-2001 packages, whereas the second entails use of the PIES code with a post-processor by Michael Drevlak; the same field line integration routine was used to evaluate the equilibria for this comparison. Both inputs were generated based on the {beta}=4%, =iota=0.5 equilibrium computed from the final NCSX coil set. We first compare these two methods for a specific plate geometry, and conclude with a comparison of the strike characteristics

  6. Calculation and measurement of the influence of flow parameters on rotordynamic coefficients in labyrinth seals

    NASA Technical Reports Server (NTRS)

    Kwanka, K.; Ortinger, W.; Steckel, J.

    1994-01-01

    First experimental investigations performed on a new test rig are presented. For a staggered labyrinth seal with fourteen cavities the stiffness coefficient and the leakage flow are measured. The experimental results are compared to calculated results which are obtained by a one-volume bulk-flow theory. A perturbation analysis is made for seven terms. It is found out that the friction factors have great impact on the dynamic coefficients. They are obtained by turbulent flow computation by a finite-volume model with the Reynolds equations used as basic equations.

  7. Calculation of supersonic stream parameters of a real gas from measurable quantities using FORTRAN 4 routines

    NASA Technical Reports Server (NTRS)

    Johnson, R. C.

    1974-01-01

    Sets of routines are presented that calculate such real-gas supersonic stream properties as velocity, density, enthalpy, entropy, and isentropic exponent. Two alternative sets of measurements are assumed: (1) stagnation pressure, stagnation temperature, and the pressure on the surface of a static-pressure wedge; or (2) pressure and temperature in a plenum upstream of a supersonic nozzle and the stagnation pressure at the exit of this nozzle. The routines are applicable to any gas whose properties are known. Explicit routines are presented for determining these properties for air, nitrogen, oxygen, normal hydrogen, para-hydrogen, helium, argon, steam, methane, and natural gas.

  8. A design method for minimizing sensitivity to plant parameter variations

    NASA Technical Reports Server (NTRS)

    Hadass, Z.; Powell, J. D.

    1974-01-01

    A method is described for minimizing the sensitivity of multivariable systems to parameter variations. The variable parameters are considered as random variables and their effect is included in a quadratic performance index. The performance index is a weighted sum of the state and control covariances that stem from both the random system disturbances and the parameter uncertainties. The numerical solution of the problem is described and application of the method to several initially sensitive tracking systems is discussed. The sensitivity factor of reduction was typically 2 or 3 over a system based on random system noise only, and yet resulted in state RMS increases of only about a factor of two.

  9. Multi-parameter sensitivity analysis and application research in the robust optimization design for complex nonlinear system

    NASA Astrophysics Data System (ADS)

    Ma, Tao; Zhang, Weigang; Zhang, Yang; Tang, Ting

    2015-01-01

    The current research of complex nonlinear system robust optimization mainly focuses on the features of design parameters, such as probability density functions, boundary conditions, etc. After parameters study, high-dimensional curve or robust control design is used to find an accurate robust solution. However, there may exist complex interaction between parameters and practical engineering system. With the increase of the number of parameters, it is getting hard to determine high-dimensional curves and robust control methods, thus it's difficult to get the robust design solutions. In this paper, a method of global sensitivity analysis based on divided variables in groups is proposed. By making relevant variables in one group and keeping each other independent among sets of variables, global sensitivity analysis is conducted in grouped variables and the importance of parameters is evaluated by calculating the contribution value of each parameter to the total variance of system response. By ranking the importance of input parameters, relatively important parameters are chosen to conduct robust design analysis of the system. By applying this method to the robust optimization design of a real complex nonlinear system-a vehicle occupant restraint system with multi-parameter, good solution is gained and the response variance of the objective function is reduced to 0.01, which indicates that the robustness of the occupant restraint system is improved in a great degree and the method is effective and valuable for the robust design of complex nonlinear system. This research proposes a new method which can be used to obtain solutions for complex nonlinear system robust design.

  10. Two Approaches to the Calculation of Approximate Symmetry of Ostrovsky Equation with Small Parameter

    NASA Astrophysics Data System (ADS)

    Mahdavi, Abolhassan; Nadjafikhah, Mehdi; Toomanian, Megerdich

    2015-12-01

    In this paper, two methods of approximate symmetries for partial differential equations with a small parameter are applied to a perturbed nonlinear Ostrovsky equation. To compute the first-order approximate symmetry, we have applied two methods which one of them was proposed by Baikov et al. in which the infinitesimal generator is expanded in a perturbation series; whereas the other method by Fushchich and Shtelen [3] is based on the expansion of the dependent variables in perturbation series. Especially, an optimal system of one dimensional subalgebras is constructed and some invariant solutions corresponding to the resulted symmetries are obtained.

  11. Calculation of Source and Strucutral Parameters at Regional and Teleseismic Distances

    DTIC Science & Technology

    1987-02-28

    Williams, L.A.J., 1972. Geology of the Eastern Rift System; Geol. Soc. of Amer. Spec. Paper #136, 67 p. Barker, J.S. & Langston, CA., 1981. Inversion of...Parameters, Regional Wave Propagation, Waveguide Scattering, T-Matrix. Upper Mantle Structure. Australia . India 1». ABSTRACT (Continu* on nttftrt« if...8hort-Period ^ *nd near-regional seismograms from l?t:L^ 5 ~A ) ^ar^uake3 located 1« Australia and India. When the effect of crusta

  12. Validity of the semi-classical approach for calculation of the surface excitation parameter.

    PubMed

    Da, B; Mao, S F; Ding, Z J

    2011-10-05

    The problem of surface plasmon excitation by moving charges has been elaborated by several different approaches, mainly based on dielectric response theory within either semi-classical or quantum mechanical frameworks. In this work, a comparison of the surface excitation effect between two different frameworks is made by calculation of the differential inverse inelastic mean free path (DIIMFP) and a Monte Carlo simulation of reflection electron energy loss spectroscopy (REELS) spectra. A semi-classical modeling of the interaction between electrons and a solid surface is based on analyzing the work done by moving electrons; the stopping power and inelastic cross section are derived with the induced potential. On the other hand, a quantum mechanical approach is based on derivation of the complex inhomogeneous self-energy of the electrons. The numerical calculation shows that the semi-classical model presents almost the same values of DIIMFP as by the quantum model except at the glancing condition. The simulation of REELS spectra for Ag and SiO(2) as well as a comparison with experimental spectra also confirms that a good agreement with the spectral shape is found among the two simulation results and the experimental data.

  13. A theoretical study of benzaldehyde derivatives as tyrosinase inhibitors using Ab initio calculated NQCC parameters

    PubMed Central

    Rafiee, Marjan; Javaheri, Masoumeh

    2015-01-01

    Tyrosinase is a multifunctional copper-containing enzyme. It can catalyze two distinct reactions of melanin synthesis and benzaldehyde derivatives, which are potential tyrosinase inhibitors. To find the relationships between charge distributions of benzaldehyde and their pharmaceutical behavior, the present study aimed at investigating nuclear quadrupole coupling constants of quadrupolare nuclei in the functional benzaldehyde group and calculating some its derivatives. In addition, the differences between the electronic structures of various derivatives of this depigmenting drug were examined. All ab initio calculations were carried out using Gaussian 03. The results predicted benzaldehyde derivatives to be bicentral inhibitors; nevertheless, the oxygen or hydrogen contents of the aldehyde group were not found to be the only active sites. Furthermore with the presence of the aldehyde group, the terminal methoxy group in C4 was found to contribute to tyrosinase inhibitory activities. In addition, an oxygen atom with high charge density in the side chain was found to play an important role in its inhibitory effect. PMID:27844007

  14. Parameter Calculation Technique for the Waste Treatment Facilities Using Naturally-Aerated Blocks in the Bog Ecosystems

    NASA Astrophysics Data System (ADS)

    Akhmed-Ogly, K. V.; Savichev, O. G.; Tokarenko, O. G.; Pasechnik, E. Yu; Reshetko, M. V.; Nalivajko, N. G.; Vlasova, M. V.

    2014-08-01

    Technique for the domestic wastewater treatment in the small residential areas and oil and gas facilities of the natural and man-made systems including a settling tank for mechanical treatment and a biological pond with peat substrate and bog vegetation for biological treatment has been substantiated. Technique for parameters calculation of the similar natural and man-made systems has been developed. It was proven that effective treatment of wastewater can be performed in Siberia all year round.

  15. Ab initio calculations on peptide-derived oxazoles and thiazoles: Improved molecular mechanics parameters for the AMBER* force field

    NASA Astrophysics Data System (ADS)

    Boden, Christopher D. J.; Pattenden, Gerald

    1999-03-01

    Ab initio calculations at the RHF/6-31G* and MP2/6- 31G*//RHF/6-31G* levels of theory are performed for 2-methyl-4-carboxamido-oxazoles and -thiazoles, including rotational profiles for the ring-carboxamide bond, which showed the expected conjugation and hydrogen bonding effects. On the basis of these data, newly optimised stretch, bend and torsional parameters for the AMBER* force field are derived, along with CHELPG-fitted partial atomic charges.

  16. Calculated and measured brachytherapy dosimetry parameters in water for the Xoft Axxent X-Ray Source: an electronic brachytherapy source.

    PubMed

    Rivard, Mark J; Davis, Stephen D; DeWerd, Larry A; Rusch, Thomas W; Axelrod, Steve

    2006-11-01

    A new x-ray source, the model S700 Axxent X-Ray Source (Source), has been developed by Xoft Inc. for electronic brachytherapy. Unlike brachytherapy sources containing radionuclides, this Source may be turned on and off at will and may be operated at variable currents and voltages to change the dose rate and penetration properties. The in-water dosimetry parameters for this electronic brachytherapy source have been determined from measurements and calculations at 40, 45, and 50 kV settings. Monte Carlo simulations of radiation transport utilized the MCNP5 code and the EPDL97-based mcplib04 cross-section library. Inter-tube consistency was assessed for 20 different Sources, measured with a PTW 34013 ionization chamber. As the Source is intended to be used for a maximum of ten treatment fractions, tube stability was also assessed. Photon spectra were measured using a high-purity germanium (HPGe) detector, and calculated using MCNP. Parameters used in the two-dimensional (2D) brachytherapy dosimetry formalism were determined. While the Source was characterized as a point due to the small anode size, < 1 mm, use of the one-dimensional (1D) brachytherapy dosimetry formalism is not recommended due to polar anisotropy. Consequently, 1D brachytherapy dosimetry parameters were not sought. Calculated point-source model radial dose functions at gP(5) were 0.20, 0.24, and 0.29 for the 40, 45, and 50 kV voltage settings, respectively. For 1calculated results. Calculated values for F(r, theta) for all operating voltages were within 15% of unity along the distal end (theta=0 degree), and ranged from F(1 cm, 160 degrees) = 0.2 to F(15 cm, 175 degrees) = 0.4 towards the catheter proximal end. For all three operating voltages using the PTW chamber, measured dependence of output as a function of azimuthal angle, psi, was typically on average +/-3% for 0 degree < or = psi < or = 360 degrees

  17. Elastic parameters of paramagnetic iron-based alloys from first-principles calculations

    NASA Astrophysics Data System (ADS)

    Zhang, Hualei; Punkkinen, Marko P. J.; Johansson, Börje; Vitos, Levente

    2012-02-01

    The elastic properties of paramagnetic (PM) Fe1-xMx (M = Al, Si, V, Cr, Mn, Co, Ni, and Rh; 0 ≤ x ≤ 0.1) solid solutions in the body-centered-cubic (bcc) and face-centered-cubic (fcc) structures are investigated using the exact muffin-tin orbital density functional method in combination with the coherent-potential approximation and disordered local-magnetic-moment model. All impurities considered here enlarge or leave nearly constant the equilibrium volume of PM Fe but at the same time produce both positive and negative changes in the elastic parameters. Some of the alloying elements induce opposite effects on shear elastic parameters C' and C44 of PM bcc and fcc Fe, which is discussed. With a few exceptions, we find that the alloying effects on PM bcc Fe are smaller than on PM fcc Fe. The trends in the tetragonal elastic constant C' show a general correlation with the trends obtained for the bcc-fcc lattice energy difference.

  18. Calculation of Weibull strength parameters, Batdorf flaw density constants and related statistical quantities using PC-CARES

    NASA Technical Reports Server (NTRS)

    Szatmary, Steven A.; Gyekenyesi, John P.; Nemeth, Noel N.

    1990-01-01

    This manual describes the operation and theory of the PC-CARES (Personal Computer-Ceramic Analysis and Reliability Evaluation of Structures) computer program for the IBM PC and compatibles running PC-DOS/MS-DOR OR IBM/MS-OS/2 (version 1.1 or higher) operating systems. The primary purpose of this code is to estimate Weibull material strength parameters, the Batdorf crack density coefficient, and other related statistical quantities. Included in the manual is the description of the calculation of shape and scale parameters of the two-parameter Weibull distribution using the least-squares analysis and maximum likelihood methods for volume- and surface-flaw-induced fracture in ceramics with complete and censored samples. The methods for detecting outliers and for calculating the Kolmogorov-Smirnov and the Anderson-Darling goodness-of-fit statistics and 90 percent confidence bands about the Weibull line, as well as the techniques for calculating the Batdorf flaw-density constants are also described.

  19. Dose equivalent rate constants and barrier transmission data for nuclear medicine facility dose calculations and shielding design.

    PubMed

    Kusano, Maggie; Caldwell, Curtis B

    2014-07-01

    A primary goal of nuclear medicine facility design is to keep public and worker radiation doses As Low As Reasonably Achievable (ALARA). To estimate dose and shielding requirements, one needs to know both the dose equivalent rate constants for soft tissue and barrier transmission factors (TFs) for all radionuclides of interest. Dose equivalent rate constants are most commonly calculated using published air kerma or exposure rate constants, while transmission factors are most commonly calculated using published tenth-value layers (TVLs). Values can be calculated more accurately using the radionuclide's photon emission spectrum and the physical properties of lead, concrete, and/or tissue at these energies. These calculations may be non-trivial due to the polyenergetic nature of the radionuclides used in nuclear medicine. In this paper, the effects of dose equivalent rate constant and transmission factor on nuclear medicine dose and shielding calculations are investigated, and new values based on up-to-date nuclear data and thresholds specific to nuclear medicine are proposed. To facilitate practical use, transmission curves were fitted to the three-parameter Archer equation. Finally, the results of this work were applied to the design of a sample nuclear medicine facility and compared to doses calculated using common methods to investigate the effects of these values on dose estimates and shielding decisions. Dose equivalent rate constants generally agreed well with those derived from the literature with the exception of those from NCRP 124. Depending on the situation, Archer fit TFs could be significantly more accurate than TVL-based TFs. These results were reflected in the sample shielding problem, with unshielded dose estimates agreeing well, with the exception of those based on NCRP 124, and Archer fit TFs providing a more accurate alternative to TVL TFs and a simpler alternative to full spectral-based calculations. The data provided by this paper should assist

  20. A theoretical study of high-pressure-induced phases of LiAlH4 using calculated NQCC parameters

    NASA Astrophysics Data System (ADS)

    Rafiee, Marjan A.

    2016-12-01

    Quadrupolar parameters of nuclei can be used as a tool to understand the electronic structure of compounds. Lithium alanate (LiAlH4) is a potential hydrogen storage material because of its high capacity of 10.5 wt % H2. However, the drawbacks of its dehydrogenation process are the relatively high temperatures and the slow dehydrogenation kinetics; furthermore, its reversibility is rather poor. Understanding the bonding nature of Al and H is essential for improving its dehydrogenation performance. In this work the charge density distribution in LiAlH4 is studied. Thus using calculated nuclear quadrupole coupling constants of hydrogens (2H-NQCCs), the electronic structure of α-LiAlH4 with high pressure forms of LiAlH4, (β- and γ-LiAlH4) were compared. The results show that easier condition for dehydrogenation is expected in β-LiAlH4. Comparison of calculated dehydrogenation enthalpies of LiAlH4 phases verifies this prediction. The electric field gradient (EFG) of quadrupolar nuclei were calculated to obtain NQCC parameters. All calculations performed using Gaussian 03 at B3LYP/6-31G* level of theory.

  1. The stable status evaluation for female breast implant surgery by calculating related physics parameters.

    PubMed

    Sun, Shuh-Ping; Hsu, Ko-Wen; Chen, Jing-Shyr

    2008-05-01

    Cosmetic doctor utilizes the position, size and shapes of female's breast to judge whether the breast is under steady-state condition after breast implant plastic surgery. Since, doctor evaluates the breast condition with the subjective discrimination (such as vision, sense of touch) without using the objective physical parameters auxiliary. This study uses the 3D optics scanner editing 3D image to obtain full-scale 3D female breasts image. The CAD system converts the breast position, size and shapes, as the length of the curve between UBL (upper breast line) and NBL (nipple base line), the length of the curve between NBL and LBL (lower breast line), breast volume and breasts congruence rate. The stability after the breast implant plastic surgery is one of the important successful indexes of plastic surgery, so with the continuity analysis the breast curve length, volume and congruence rate can let the doctor really grasp the stability of the breast after plastic surgery.

  2. Application of Model Based Parameter Estimation for RCS Frequency Response Calculations Using Method of Moments

    NASA Technical Reports Server (NTRS)

    Reddy, C. J.

    1998-01-01

    An implementation of the Model Based Parameter Estimation (MBPE) technique is presented for obtaining the frequency response of the Radar Cross Section (RCS) of arbitrarily shaped, three-dimensional perfect electric conductor (PEC) bodies. An Electric Field Integral Equation (EFTE) is solved using the Method of Moments (MoM) to compute the RCS. The electric current is expanded in a rational function and the coefficients of the rational function are obtained using the frequency derivatives of the EFIE. Using the rational function, the electric current on the PEC body is obtained over a frequency band. Using the electric current at different frequencies, RCS of the PEC body is obtained over a wide frequency band. Numerical results for a square plate, a cube, and a sphere are presented over a bandwidth. Good agreement between MBPE and the exact solution over the bandwidth is observed.

  3. 40 CFR 80.599 - How do I calculate volume balances for designation purposes?

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 40 Protection of Environment 17 2013-07-01 2013-07-01 false How do I calculate volume balances for... § 80.599 How do I calculate volume balances for designation purposes? (a) Quarterly compliance periods... June 30, 2013. July 1, 2013 May 31, 2014. (2) (b) Volume balance for motor vehicle diesel fuel. (1)...

  4. 40 CFR 80.599 - How do I calculate volume balances for designation purposes?

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 40 Protection of Environment 16 2011-07-01 2011-07-01 false How do I calculate volume balances for... § 80.599 How do I calculate volume balances for designation purposes? (a) Quarterly compliance periods... June 30, 2013. July 1, 2013 May 31, 2014. (2) (b) Volume balance for motor vehicle diesel fuel. (1)...

  5. 40 CFR 80.599 - How do I calculate volume balances for designation purposes?

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... 40 Protection of Environment 17 2012-07-01 2012-07-01 false How do I calculate volume balances for... § 80.599 How do I calculate volume balances for designation purposes? (a) Quarterly compliance periods... June 30, 2013. July 1, 2013 May 31, 2014. (2) (b) Volume balance for motor vehicle diesel fuel. (1)...

  6. 40 CFR 80.599 - How do I calculate volume balances for designation purposes?

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... 40 Protection of Environment 17 2014-07-01 2014-07-01 false How do I calculate volume balances for... § 80.599 How do I calculate volume balances for designation purposes? (a) Quarterly compliance periods... June 30, 2013. July 1, 2013 May 31, 2014. (2) (b) Volume balance for motor vehicle diesel fuel. (1)...

  7. A calculation of steady-state electrocoloration parameters of electrochromic systems

    SciTech Connect

    Ushakov, O.A.; Shelepin, I.V.

    1986-01-01

    Electrochromic systems based on solutions of compounds whichchange their color reversibly when electrochemical reactions take place may find wide applications in the design of laser-light modulators, light filters with variable optical density, and means for visual information display. It is the aim of this work to find the limiting steady-state values of current density and electrically induced optical density for electrochromic systems and to discuss possibilities of eliminating solution convection during current flow in them. During prolonged electrocoloration, the convection of anolyte and catholyte in opposite directions can lead to ''glistering'' or separation of the solution layer.

  8. The effect of Fisher information matrix approximation methods in population optimal design calculations.

    PubMed

    Strömberg, Eric A; Nyberg, Joakim; Hooker, Andrew C

    2016-12-01

    With the increasing popularity of optimal design in drug development it is important to understand how the approximations and implementations of the Fisher information matrix (FIM) affect the resulting optimal designs. The aim of this work was to investigate the impact on design performance when using two common approximations to the population model and the full or block-diagonal FIM implementations for optimization of sampling points. Sampling schedules for two example experiments based on population models were optimized using the FO and FOCE approximations and the full and block-diagonal FIM implementations. The number of support points was compared between the designs for each example experiment. The performance of these designs based on simulation/estimations was investigated by computing bias of the parameters as well as through the use of an empirical D-criterion confidence interval. Simulations were performed when the design was computed with the true parameter values as well as with misspecified parameter values. The FOCE approximation and the Full FIM implementation yielded designs with more support points and less clustering of sample points than designs optimized with the FO approximation and the block-diagonal implementation. The D-criterion confidence intervals showed no performance differences between the full and block diagonal FIM optimal designs when assuming true parameter values. However, the FO approximated block-reduced FIM designs had higher bias than the other designs. When assuming parameter misspecification in the design evaluation, the FO Full FIM optimal design was superior to the FO block-diagonal FIM design in both of the examples.

  9. Optimization of reserve lithium thionyl chloride battery electrochemical design parameters

    NASA Astrophysics Data System (ADS)

    Doddapaneni, N.; Godshall, N. A.

    The performance of Reserve Lithium Thionyl Chloride (RLTC) batteries was optimized by conducting a parametric study of seven electrochemical parameters: electrode compression, carbon thickness, presence of catalyst, temperature, electrode limitation, discharge rate, and electrolyte acidity. Increasing electrode compression (from 0 to 15 percent) improved battery performance significantly (10 percent greater carbon capacity density). Although thinner carbon cathodes yielded less absolute capacity than did thicker cathodes, they did so with considerably higher volume efficiencies. The effect of these parameters, and their synergistic interactions, on electrochemical cell performance is illustrated.

  10. Back-calculation of temperature parameters for determination of asphalt layer modulus

    NASA Astrophysics Data System (ADS)

    Dong, Qinxi; Matsui, Kunihito; Yamamoto, Kazuya; Higashi, Shigeo

    2000-05-01

    The pavement elastic modulus of each layer was usually assumed not to be dependent on the environmental factors when the backcalculation of asphalt pavement was conducted from the measured surface deflections of FWD. However, it is well known that the elastic modulus of asphalt layer changes with the variation of temperature. Considering the influence of atmospheric temperature and radiant heat, the temperature distribution is nonlinear along the asphalt layer thickness, and has always been changed. Therefore, the distribution of elastic modulus in the asphalt layer has been considered to change as well. In this paper, we assume the elastic modulus distribution of the asphalt layer to vary with its temperature in terms of the exponential form. Based on the finite element method forward analysis, we propose a method to estimate a standard elastic modulus and temperature coefficient at 20 degrees Celsius for the asphalt layer from the backcalculation analysis. The corresponding FEM backcalculation program using Gauss-Newton method was developed to determine the pavement layer moduli and temperature dependent coefficient, in which the singular value decomposition (SVD) was used for the inverse analysis with scaling of unknown parameters. This method results in a smaller condition number that contributes to improvement of numerical stability. Both numerical simulation and measured data from FWD testing are used to demonstrate the potential applications of this method. As a result, the backcalculation procedure is less dependent on the user's initial values, fast in convergence rate and effective in the pavement engineering.

  11. Analytical Calculation of Sensing Parameters on Carbon Nanotube Based Gas Sensors

    PubMed Central

    Akbari, Elnaz; Buntat, Zolkafle; Ahmad, Mohd Hafizi; Enzevaee, Aria; Yousof, Rubiyah; Iqbal, Syed Muhammad Zafar; Ahmadi, Mohammad Taghi.; Sidik, Muhammad Abu Bakar; Karimi, Hediyeh

    2014-01-01

    Carbon Nanotubes (CNTs) are generally nano-scale tubes comprising a network of carbon atoms in a cylindrical setting that compared with silicon counterparts present outstanding characteristics such as high mechanical strength, high sensing capability and large surface-to-volume ratio. These characteristics, in addition to the fact that CNTs experience changes in their electrical conductance when exposed to different gases, make them appropriate candidates for use in sensing/measuring applications such as gas detection devices. In this research, a model for a Field Effect Transistor (FET)-based structure has been developed as a platform for a gas detection sensor in which the CNT conductance change resulting from the chemical reaction between NH3 and CNT has been employed to model the sensing mechanism with proposed sensing parameters. The research implements the same FET-based structure as in the work of Peng et al. on nanotube-based NH3 gas detection. With respect to this conductance change, the I–V characteristic of the CNT is investigated. Finally, a comparative study shows satisfactory agreement between the proposed model and the experimental data from the mentioned research. PMID:24658617

  12. Recommended environmental dose calculation methods and Hanford-specific parameters. Revision 2

    SciTech Connect

    Schreckhise, R.G.; Rhoads, K.; Napier, B.A.; Ramsdell, J.V.; Davis, J.S.

    1993-03-01

    This document was developed to support the Hanford Environmental Dose overview Panel (HEDOP). The Panel is responsible for reviewing all assessments of potential doses received by humans and other biota resulting from the actual or possible environmental releases of radioactive and other hazardous materials from facilities and/or operations belonging to the US Department of Energy on the Hanford Site in south-central Washington. This document serves as a guide to be used for developing estimates of potential radiation doses, or other measures of risk or health impacts, to people and other biota in the environs on and around the Hanford Site. It provides information to develop technically sound estimates of exposure (i.e., potential or actual) to humans or other biotic receptors that could result from the environmental transport of potentially harmful materials that have been, or could be, released from Hanford operations or facilities. Parameter values and information that are specific to the Hanford environs as well as other supporting material are included in this document.

  13. Analytical calculation of sensing parameters on carbon nanotube based gas sensors.

    PubMed

    Akbari, Elnaz; Buntat, Zolkafle; Ahmad, Mohd Hafizi; Enzevaee, Aria; Yousof, Rubiyah; Iqbal, Syed Muhammad Zafar; Ahmadi, Mohammad Taghi; Sidik, Muhammad Abu Bakar; Karimi, Hediyeh

    2014-03-20

    Carbon Nanotubes (CNTs) are generally nano-scale tubes comprising a network of carbon atoms in a cylindrical setting that compared with silicon counterparts present outstanding characteristics such as high mechanical strength, high sensing capability and large surface-to-volume ratio. These characteristics, in addition to the fact that CNTs experience changes in their electrical conductance when exposed to different gases, make them appropriate candidates for use in sensing/measuring applications such as gas detection devices. In this research, a model for a Field Effect Transistor (FET)-based structure has been developed as a platform for a gas detection sensor in which the CNT conductance change resulting from the chemical reaction between NH3 and CNT has been employed to model the sensing mechanism with proposed sensing parameters. The research implements the same FET-based structure as in the work of Peng et al. on nanotube-based NH3 gas detection. With respect to this conductance change, the I-V characteristic of the CNT is investigated. Finally, a comparative study shows satisfactory agreement between the proposed model and the experimental data from the mentioned research.

  14. Calculation of distribution coefficients in the SAMPL5 challenge from atomic solvation parameters and surface areas

    NASA Astrophysics Data System (ADS)

    Santos-Martins, Diogo; Fernandes, Pedro Alexandrino; Ramos, Maria João

    2016-11-01

    In the context of SAMPL5, we submitted blind predictions of the cyclohexane/water distribution coefficient (D) for a series of 53 drug-like molecules. Our method is purely empirical and based on the additive contribution of each solute atom to the free energy of solvation in water and in cyclohexane. The contribution of each atom depends on the atom type and on the exposed surface area. Comparatively to similar methods in the literature, we used a very small set of atomic parameters: only 10 for solvation in water and 1 for solvation in cyclohexane. As a result, the method is protected from overfitting and the error in the blind predictions could be reasonably estimated. Moreover, this approach is fast: it takes only 0.5 s to predict the distribution coefficient for all 53 SAMPL5 compounds, allowing its application in virtual screening campaigns. The performance of our approach (submission 49) is modest but satisfactory in view of its efficiency: the root mean square error (RMSE) was 3.3 log D units for the 53 compounds, while the RMSE of the best performing method (using COSMO-RS) was 2.1 (submission 16). Our method is implemented as a Python script available at https://github.com/diogomart/SAMPL5-DC-surface-empirical.

  15. Design parameters of a solar-driven heat engine

    SciTech Connect

    Goektun, S.

    1996-01-01

    Maximum power and efficiency are treated at the maximum power output of an internally and externally irreversible solar-driven power plant heat engine. It was found that the thermal efficiency depends on the cycle-irreversibility parameter must be less than 1.0 for maximum power output.

  16. Solubility of hot fuel particles from Chernobyl--influencing parameters for individual radiation dose calculations.

    PubMed

    Garger, Evgenii K; Meisenberg, Oliver; Odintsov, Oleksiy; Shynkarenko, Viktor; Tschiersch, Jochen

    2013-10-15

    Nuclear fuel particles of Chernobyl origin are carriers of increased radioactivity (hot particles) and are still present in the atmosphere of the Chernobyl exclusion zone. Workers in the zone may inhale these particles, which makes assessment necessary. The residence time in the lungs and the transfer in the blood of the inhaled radionuclides are crucial for inhalation dose assessment. Therefore, the dissolution of several kinds of nuclear fuel particles from air filters sampled in the Chernobyl exclusion zone was studied. For this purpose filter fragments with hot particles were submersed in simulated lung fluids (SLFs). The activities of the radionuclides (137)Cs, (90)Sr, (239+240)Pu and (241)Am were measured in the SLF and in the residuum of the fragments by radiometric methods after chemical treatment. Soluble fractions as well as dissolution rates of the nuclides were determined. The influence of the genesis of the hot particles, represented by the (137)Cs/(239+240)Pu ratio, on the availability of (137)Cs was demonstrated, whereas the dissolution of (90)Sr, (239+240)Pu and (241)Am proved to be independent of genesis. No difference in the dissolution of (137)Cs and (239+240)Pu was observed for the two applied types of SLF. Increased solubility was found for smaller hot particles. A two-component exponential model was used to describe the dissolution of the nuclides as a function of time. The results were applied for determining individual inhalation dose coefficients for the workers at the Chernobyl construction site. Greater dose coefficients for the respiratory tract and smaller coefficients for the other organs were calculated (compared to ICRP default values). The effective doses were in general lower for the considered radionuclides, for (241)Am even by one order of magnitude.

  17. NEUTRAL INTERSTELLAR HELIUM PARAMETERS BASED ON IBEX-Lo OBSERVATIONS AND TEST PARTICLE CALCULATIONS

    SciTech Connect

    Bzowski, M.; Kubiak, M. A.; Sokol, J. M.; Hlond, M.; Moebius, E.; Bochsler, P.; Leonard, T.; Heirtzler, D.; Kucharek, H.; Schwadron, N. A.; Crew, G. B.; Fuselier, S. A.; McComas, D. J.

    2012-02-01

    Because of its high ionization potential and weak interaction with hydrogen, neutral interstellar helium (NISHe) is almost unaffected at the heliospheric interface with the interstellar medium and freely enters the solar system. This second most abundant species provides some of the best information on the characteristics of the interstellar gas in the local interstellar cloud. The Interstellar Boundary Explorer (IBEX) is the second mission to directly detect NISHe. We present a comparison between recent IBEX NISHe observations and simulations carried out using a well-tested quantitative simulation code. Simulation and observation results compare well for times when measured fluxes are dominated by NISHe (and contributions from other species are small). Differences between simulations and observations indicate a previously undetected secondary population of neutral helium, likely produced by interaction of interstellar helium with plasma in the outer heliosheath. Interstellar neutral parameters are statistically different from previous in situ results obtained mostly from the GAS/Ulysses experiment, but they do agree with the local interstellar flow vector obtained from studies of interstellar absorption: the newly established flow direction is ecliptic longitude 79.{sup 0}2, latitude -5.{sup 0}1, the velocity is {approx}22.8 km s{sup -1}, and the temperature is 6200 K. These new results imply a markedly lower absolute velocity of the gas and thus significantly lower dynamic pressure on the boundaries of the heliosphere and different orientation of the Hydrogen Deflection Plane compared to prior results from Ulysses. A different orientation of this plane also suggests a new geometry of the interstellar magnetic field, and the lower dynamic pressure calls for a compensation by other components of the pressure balance, most likely a higher density of interstellar plasma and strength of interstellar magnetic field.

  18. Influence of Gear Design Parameters on Gearbox Radiated Noise

    NASA Technical Reports Server (NTRS)

    Oswald, Fred B.; Townsend, Dennis P.; Valco, Mark J.; Spencer, Robert H.; Drago, Raymond J.; Lenski, Joseph W., Jr.

    1994-01-01

    Spur and helical gears were tested in the NASA gear-noise rig to compare the noise produced by different gear designs. Sound power measurements were performed under controlled conditions for a matrix of operating conditions. Sound power was computed from near-field acoustic intensity scans taken just above the top surface of the gearbox. Test gears included four spur and five helical gear designs. The gears were designed to be as nearly identical as possible except for deliberate differences in tooth geometry and contact ratio. Test results are presented as a function of the gear design and operating conditions in the form of sound power charts and as narrow-band spectra.

  19. Estimate of the soil water retention curve from the sorptivity and β parameter calculated from an upward infiltration experiment

    NASA Astrophysics Data System (ADS)

    Moret-Fernández, D.; Latorre, B.

    2017-01-01

    The water retention curve (θ(h)), which defines the relationship between the volumetric water content (θ) and the matric potential (h), is of paramount importance to characterize the hydraulic behaviour of soils. Because current methods to estimate θ(h) are, in general, tedious and time consuming, alternative procedures to determine θ(h) are needed. Using an upward infiltration curve, the main objective of this work is to present a method to determine the parameters of the van Genuchten (1980) water retention curve (α and n) from the sorptivity (S) and the β parameter defined in the 1D infiltration equation proposed by Haverkamp et al. (1994). The first specific objective is to present an equation, based on the Haverkamp et al. (1994) analysis, which allows describing an upward infiltration process. Secondary, assuming a known saturated hydraulic conductivity, Ks, calculated on a finite soil column by the Darcy's law, a numerical procedure to calculate S and β by the inverse analysis of an exfiltration curve is presented. Finally, the α and n values are numerically calculated from Ks, S and β. To accomplish the first specific objective, cumulative upward infiltration curves simulated with HYDRUS-1D for sand, loam, silt and clay soils were compared to those calculated with the proposed equation, after applying the corresponding β and S calculated from the theoretical Ks, α and n. The same curves were used to: (i) study the influence of the exfiltration time on S and β estimations, (ii) evaluate the limits of the inverse analysis, and (iii) validate the feasibility of the method to estimate α and n. Next, the θ(h) parameters estimated with the numerical method on experimental soils were compared to those obtained with pressure cells. The results showed that the upward infiltration curve could be correctly described by the modified Haverkamp et al. (1994) equation. While S was only affected by early-time exfiltration data, the β parameter had a

  20. Parameter optimization in AQM controller design to support TCP traffic

    NASA Astrophysics Data System (ADS)

    Yang, Wei; Yang, Oliver W.

    2004-09-01

    TCP congestion control mechanism has been widely investigated and deployed on Internet in preventing congestion collapse. We would like to employ modern control theory to specify quantitatively the control performance of the TCP communication system. In this paper, we make use of a commonly used performance index called the Integral of the Square of the Error (ISE), which is a quantitative measure to gauge the performance of a control system. By applying the ISE performance index into the Proportional-plus-Integral controller based on Pole Placement (PI_PP controller) for active queue management (AQM) in IP routers, we can further tune the parameters for the controller to achieve an optimum control minimizing control errors. We have analyzed the dynamic model of the TCP congestion control under this ISE, and used OPNET simulation tool to verify the derived optimized parameters of the controllers.

  1. Determination of critical anthropometric parameters for design of respirators

    SciTech Connect

    You-Hin Liau

    1982-12-01

    Anthropometric data were collected from 243 workers in a respirator fit-test programme, and an attempt was made to determine a correlation between these data and the Protection Factor obtained from quantitative fit-testing for half-mask respirators. Data were collected for two direct and five indirect facial measurements from front- and side-view slides of test subjects. For analysis, the data were normalized with relevant respirators dimensions (4 brands and 10 sizes). Results of linear regression analysis indicated that correlation coefficients between Protection Factor and anthropometric data (face length, mouth width, face width, nasal root breadth) were, respectively, 0.04, 0.22, 0.30 and 0.04. These correlation coefficients are for white males without facial hair. The analysis showed the 'critical' parameters to be mouth width and face width; however, a person with certain combinations of anthropometric parameters may provide a better correlation with Protection Factor.

  2. Effective Parameters on Seismic Design of Rectangular Underground Structures

    SciTech Connect

    Amiri, G. Ghodrati; Maddah, N.; Mohebi, B.

    2008-07-08

    Underground structures are a significant part of the transportation in the modern society and in the seismic zones should withstand against both seismic and static loadings. Embedded structures should conform to ground deformations during the earthquake but almost exact evaluation of structure to ground distortion is critical. Several two-dimensional finite difference models are used to find effective parameters on racking ratio (structure to ground distortion) including flexibility ratio, various cross sections, embedment depth, and Poisson's ratio of soil. Results show that influence of different cross sections, by themselves is negligible but embedment depth in addition to flexibility ratio and Poisson's ratio is known as a consequential parameter. A comparison with pseudo-static method (simplified frame analysis) is also performed. The results show that for a stiffer structure than soil, racking ratio decreases as the depth of burial decreases; on the other hand, shallow and flexible structures can suffer greater distortion than deeper ones up to 30 percents.

  3. Preliminary safety calculations to improve the design of Molten Salt Fast Reactor

    SciTech Connect

    Brovchenko, M.; Heuer, D.; Merle-Lucotte, E.; Allibert, M.; Capellan, N.; Ghetta, V.; Laureau, A.

    2012-07-01

    Molten salt reactors are liquid fuel reactors so that they are flexible in operation but very different in the safety approach from solid fuel reactors. This study bears on the specific concept named Molten Salt Fast Reactor (MSFR). Since this new nuclear technology is in development, safety is an essential point to be considered all along the R and D studies. This paper presents the first step of the safety approach: the systematic description of the MSFR, limited here to the main systems surrounding the core. This systematic description is the basis on which we will be able to devise accidental scenarios. Thanks to the negative reactivity feedback coefficient, most accidental scenarios lead to reactor shut down. Because of the decay heat generated in the fuel salt, it must be cooled. After the description of the tools developed to calculate the residual heat, the different contributions are discussed in this study. The decay heat of fission products in the MSFR is evaluated to be low (3% of nominal power), mainly due to the reprocessing that transfers the fission products to the gas reprocessing unit. As a result, the contribution of the actinides is significant (0.5% of nominal power). The unprotected loss of heat sink transients are studied in this paper. It appears that slow transients are favorable (> 1 min) to minimize the temperature increase of the fuel salt. This work will be the basis of further safety studies as well as an essential parameter for the design of the draining system. (authors)

  4. Improving the Design of Science Intervention Studies: An Empirical Investigation of Design Parameters for Planning Group Randomized Trials

    ERIC Educational Resources Information Center

    Westine, Carl; Spybrook, Jessaca

    2013-01-01

    The capacity of the field to conduct power analyses for group randomized trials (GRTs) of educational interventions has improved over the past decade (Authors, 2009). However, a power analysis depends on estimates of design parameters. Hence it is critical to build the empirical base of design parameters for GRTs across a variety of outcomes and…

  5. Rethinking design parameters in the search for optimal dynamic seating.

    PubMed

    Pynt, Jennifer

    2015-04-01

    Dynamic seating design purports to lessen damage incurred during sedentary occupations by increasing sitter movement while modifying muscle activity. Dynamic sitting is currently defined by O'Sullivan et al. ( 2013a) as relating to 'the increased motion in sitting which is facilitated by the use of specific chairs or equipment' (p. 628). Yet the evidence is conflicting that dynamic seating creates variation in the sitter's lumbar posture or muscle activity with the overall consensus being that current dynamic seating design fails to fulfill its goals. Research is needed to determine if a new generation of chairs requiring active sitter involvement fulfills the goals of dynamic seating and aids cardio/metabolic health. This paper summarises the pursuit of knowledge regarding optimal seated spinal posture and seating design. Four new forms of dynamic seating encouraging active sitting are discussed. These are 1) The Core-flex with a split seatpan to facilitate a walking action while seated 2) the Duo balans requiring body action to create rocking 3) the Back App and 4) Locus pedestal stools both using the sitter's legs to drive movement. Unsubstantiated claims made by the designers of these new forms of dynamic seating are outlined. Avenues of research are suggested to validate designer claims and investigate whether these designs fulfill the goals of dynamic seating and assist cardio/metabolic health. Should these claims be efficacious then a new definition of dynamic sitting is suggested; 'Sitting in which the action is provided by the sitter, while the dynamic mechanism of the chair accommodates that action'.

  6. Elastic properties of amorphous Si and derived Debye temperatures and Grüneisen parameters: Model calculation

    NASA Astrophysics Data System (ADS)

    Feldman, J. L.; Broughton, J. Q.; Wooten, F.

    1991-01-01

    Calculations, based on the Stillinger-Weber (SW) interatomic-potential model and the method of long waves, are presented for the elastic properties of amorphous Si (a-Si) and for pressure derivatives of the elastic constants of crystalline Si. Several models of a-Si, relaxed on the basis of the SW potential, are considered, and the external stresses that are associated with these models are evaluated using the Born-Huang relations. The elastic constants appear to obey the isotropy conditions to within a reasonable accuracy and are also consistent with other predictions based on the SW potential at finite temperature obtained by Kluge and Ray. Estimates of the pressure dependence of the elastic constants, Debye temperature, and Grüeisen parameter for a-Si are also provided on the basis of these calculations.

  7. Cross-section and asymmetry-parameter calculations for the outer- and inner-valence photoionization of ethane

    SciTech Connect

    Toffoli, Daniele; Simpson, Mary J.; Lucchese, Robert R.

    2004-06-01

    We have computed cross sections and asymmetry parameters for the outer- and inner-valence photoionization of ethane using the Schwinger variational method with Pade corrections. The calculated total cross section is found to be in rather good agreement with the available electron-impact and photoabsorption measurements. One-electron resonant processes in the (1e{sub g}){sup -1} (3a{sub 1g}){sup -1}, and (2a{sub 1g}){sup -1} ionization channels were examined comparing resonant states predicted from the virtual orbitals of a minimum basis set self-consistent-field (MBS-SCF) calculations with scattering resonances found using a local model potential for the electron-molecule interaction. The analysis of the interaction potential in terms of adiabatic radial components provides a description of the mechanism of the resonant trapping.

  8. Calculation of structural parameters of a Van Der Waals complex of the CO molecule with a Li+ cation

    NASA Astrophysics Data System (ADS)

    Bulanin, K. M.; Bulychev, V. P.; Buturlimova, M. V.

    2015-12-01

    The equilibrium nuclear configuration and the potential energy and dipole moment component surfaces of an isolated Li+-CO complex are calculated quantum-mechanically in the MP4(SDQ)/6-311++G(3df) approximation. The geometrical parameters and the binding energy of the complex are determined. The frequencies and intensities for the fundamental transitions are calculated in the harmonic approximation. The one-, two-, and three-dimensional anharmonic vibrational Schrödinger equations are solved using the variational method. The energies of states of a three-dimensional vibrational system, anharmonic constants, and the frequencies and intensities of fundamental transitions are determined with the anharmonic interactions taken into account. The changes in the frequency and intensity of the C-O stretching vibration upon the formation of the complex are predicted.

  9. Monte Carlo calculated TG-60 dosimetry parameters for the {beta}{sup -} emitter {sup 153}Sm brachytherapy source

    SciTech Connect

    Sadeghi, Mahdi; Taghdiri, Fatemeh; Hamed Hosseini, S.; Tenreiro, Claudio

    2010-10-15

    Purpose: The formalism recommended by Task Group 60 (TG-60) of the American Association of Physicists in Medicine (AAPM) is applicable for {beta} sources. Radioactive biocompatible and biodegradable {sup 153}Sm glass seed without encapsulation is a {beta}{sup -} emitter radionuclide with a short half-life and delivers a high dose rate to the tumor in the millimeter range. This study presents the results of Monte Carlo calculations of the dosimetric parameters for the {sup 153}Sm brachytherapy source. Methods: Version 5 of the (MCNP) Monte Carlo radiation transport code was used to calculate two-dimensional dose distributions around the source. The dosimetric parameters of AAPM TG-60 recommendations including the reference dose rate, the radial dose function, the anisotropy function, and the one-dimensional anisotropy function were obtained. Results: The dose rate value at the reference point was estimated to be 9.21{+-}0.6 cGy h{sup -1} {mu}Ci{sup -1}. Due to the low energy beta emitted from {sup 153}Sm sources, the dose fall-off profile is sharper than the other beta emitter sources. The calculated dosimetric parameters in this study are compared to several beta and photon emitting seeds. Conclusions: The results show the advantage of the {sup 153}Sm source in comparison with the other sources because of the rapid dose fall-off of beta ray and high dose rate at the short distances of the seed. The results would be helpful in the development of the radioactive implants using {sup 153}Sm seeds for the brachytherapy treatment.

  10. Parameter Space Techniques for Robust Control System Design.

    DTIC Science & Technology

    1980-07-01

    been further investi- gated by Cruz [2] and Desoer and Wang [3]. In frequency design methods the concept to compensate the loop, such that high gains...of Feedback Systems, McGraw-Hill, New York, 1972. 3. C. A. Desoer and Y. T. Wang, "Foundations of Feedback Theory for Nonlinear Dynamical Systems

  11. Percutaneous multiple electrode connector, design parameters and fabrication (biomedical)

    NASA Technical Reports Server (NTRS)

    Myers, L. A.

    1977-01-01

    A percutaneous multielectrode connector was designed which utilizes an ultrapure carbon collar to provide an infection free biocompatible passage through the skin. The device provides reliable electrical continuity, mates and demates readily with the implant, and is fabricated with processes and materials oriented to commercial production.

  12. Data acquisition as a design parameter in the modern AEM

    SciTech Connect

    Zaluzec, N.J.

    1993-04-01

    The components of a modern analytical electron microscope (AEM) are not necessarily optimized. A pessimistic view is presented of an AEM system, particularly on the data acquisition end. The question of how to design the instrument to collect the data efficiently, is considered. Several points for doing this are outlined.

  13. Parallel calculation of sensitivity derivatives for aircraft design using automatic differentiation

    SciTech Connect

    Bischof, C.H.; Knauff, T.L. Jr.; Green, L.L.; Haigler, K.J.

    1994-01-01

    Realistic multidisciplinary design optimization (MDO) of advanced aircraft using state-of-the-art computers is an extremely challenging problem from both the physical modelling and computer science points of view. In order to produce an efficient aircraft design, many trade-offs must be made among the various physical design variables. Similarly, in order to produce an efficient design scheme, many trade-offs must be made among the various MDO implementation options. In this paper, we examine the effects of vectorization and coarse-grained parallelization on the SD calculation using a representative example taken from a transonic transport design problem.

  14. Decoupling interrelated parameters for designing high performance thermoelectric materials.

    PubMed

    Xiao, Chong; Li, Zhou; Li, Kun; Huang, Pengcheng; Xie, Yi

    2014-04-15

    The world's supply of fossil fuels is quickly being exhausted, and the impact of their overuse is contributing to both climate change and global political unrest. In order to help solve these escalating problems, scientists must find a way to either replace combustion engines or reduce their use. Thermoelectric materials have attracted widespread research interest because of their potential applications as clean and renewable energy sources. They are reliable, lightweight, robust, and environmentally friendly and can reversibly convert between heat and electricity. However, after decades of development, the energy conversion efficiency of thermoelectric devices has been hovering around 10%. This is far below the theoretical predictions, mainly due to the interdependence and coupling between electrical and thermal parameters, which are strongly interrelated through the electronic structure of the materials. Therefore, any strategy that balances or decouples these parameters, in addition to optimizing the materials' intrinsic electronic structure, should be critical to the development of thermoelectric technology. In this Account, we discuss our recently developed strategies to decouple thermoelectric parameters for the synergistic optimization of electrical and thermal transport. We first highlight the phase transition, which is accompanied by an abrupt change of electrical transport, such as with a metal-insulator and semiconductor-superionic conductor transition. This should be a universal and effective strategy to optimize the thermoelectric performance, which takes advantage of modulated electronic structure and critical scattering across phase transitions to decouple the power factor and thermal conductivity. We propose that solid-solution homojunction nanoplates with disordered lattices are promising thermoelectric materials to meet the "phonon glass electron crystal" approach. The formation of a solid solution, coupled with homojunctions, allows for

  15. Development of Design and Economic Parameters for Passive Solar Systems.

    DTIC Science & Technology

    1984-09-01

    42.50 35.02 29.73 ANNUAL 00 511 883 1394 2062 2888 3878 Soso Pk PARAMETER A .727 .700 .674 .680 .617 . 5684 .561 OFF SOUJTH VTN/DO 81 .008 .008 .008...23.47 16.11 12.21 9.83 8.23 V72/O 73.55 34.02 19.92 13.68 10.37 5.35 6.9e VT3/DD 63.77 29.50 17.21 11.36 8.99 7.24 6.06 ANNULL 0D 251 639 1313 2255

  16. Calculation of supercritical Dirac resonance parameters for heavy-ion systems from a coupled-differential-equation approach

    SciTech Connect

    Marsman, A.; Horbatsch, M.

    2011-09-15

    Previous work [E. Ackad and M. Horbatsch, Phys. Rev. A 78, 062711 (2008)] on supercritical Dirac resonance parameters from extrapolated analytic continuation, obtained with a Fourier grid method, is generalized by numerically solving the coupled Dirac radial equations to a high precision. The equations, which contain the multipole decomposition of the two-center potential, are augmented by a complex absorbing potential and truncated at various orders in the partial wave expansion to demonstrate convergence of the resonance parameters in the limit of vanishing absorber. The convergence of the partial-wave spinor and of the multipole potential expansions is demonstrated in the supercritical regime. The comparison of critical distances with literature values shows that the work provides benchmark results for future two-center calculations without multipole expansion.

  17. First-Principles Calculation of the Real-Space Order Parameter and Condensation Energy Density in Phonon-Mediated Superconductors.

    PubMed

    Linscheid, A; Sanna, A; Floris, A; Gross, E K U

    2015-08-28

    We show that the superconducting order parameter and condensation energy density of phonon-mediated superconductors can be calculated in real space from first principles density functional theory for superconductors. This method highlights the connection between the chemical bonding structure and the superconducting condensation and reveals new and interesting properties of superconducting materials. Understanding this connection is essential to describe nanostructured superconducting systems where the usual reciprocal space analysis hides the basic physical mechanism. In a first application we present results for MgB2, CaC6 and hole-doped graphane.

  18. Thermoluminescence of nanocrystalline CaSO{sub 4}: Dy for gamma dosimetry and calculation of trapping parameters using deconvolution method

    SciTech Connect

    Mandlik, Nandkumar; Patil, B. J.; Bhoraskar, V. N.; Dhole, S. D.; Sahare, P. D.

    2014-04-24

    Nanorods of CaSO{sub 4}: Dy having diameter 20 nm and length 200 nm have been synthesized by the chemical coprecipitation method. These samples were irradiated with gamma radiation for the dose varying from 0.1 Gy to 50 kGy and their TL characteristics have been studied. TL dose response shows a linear behavior up to 5 kGy and further saturates with increase in the dose. A Computerized Glow Curve Deconvolution (CGCD) program was used for the analysis of TL glow curves. Trapping parameters for various peaks have been calculated by using CGCD program.

  19. Thermoluminescence of nanocrystalline CaSO4: Dy for gamma dosimetry and calculation of trapping parameters using deconvolution method

    NASA Astrophysics Data System (ADS)

    Mandlik, Nandkumar; Patil, B. J.; Bhoraskar, V. N.; Sahare, P. D.; Dhole, S. D.

    2014-04-01

    Nanorods of CaSO4: Dy having diameter 20 nm and length 200 nm have been synthesized by the chemical coprecipitation method. These samples were irradiated with gamma radiation for the dose varying from 0.1 Gy to 50 kGy and their TL characteristics have been studied. TL dose response shows a linear behavior up to 5 kGy and further saturates with increase in the dose. A Computerized Glow Curve Deconvolution (CGCD) program was used for the analysis of TL glow curves. Trapping parameters for various peaks have been calculated by using CGCD program.

  20. Selection of excipients for melt extrusion with two poorly water-soluble drugs by solubility parameter calculation and thermal analysis.

    PubMed

    Forster, A; Hempenstall, J; Tucker, I; Rades, T

    2001-09-11

    The aim of this study was to determine the miscibility of drug and excipient to predict if glass solutions are likely to form when drug and excipient are melt extruded. Two poorly water-soluble drugs, indomethacin and lacidipine, were selected along with 11 excipients (polymeric and non-polymeric). Estimation of drug/excipient miscibility was performed using a combination of the Hoy and Hoftzyer/Van Krevelen methods for Hansen solubility parameter calculation. Miscibility was experimentally investigated with differential scanning calorimetry (DSC) and hot stage microscopy (HSM). Studies were performed at drug/excipient ratios, 1:4, 1:1 and 4:1. Analysis of the glass transition temperature (T(g)) was performed by quench cooling drug/excipient melts in the DSC. Differences in the drug/excipient solubility parameters of <7.0 MPa(1/2) were predicted to indicate significant miscibility and, therefore, glass solution formation on melt extrusion. In comparison, differences of >10 MPa(1/2) were expected to indicate a lack of miscibility and not form glass solutions when melt extruded. Experimentally, miscibility was shown by changes in drug/excipient melting endotherms and confirmed by HSM investigations. Experimental results were in agreement with solubility parameter predictions. In addition, drug/excipient combinations predicted to be largely immiscible often exhibited more than one T(g) upon reheating in the DSC. Melt extrusion of miscible components resulted in amorphous solid solution formation, whereas extrusion of an "immiscible" component led to amorphous drug dispersed in crystalline excipient. In conclusion, combining calculation of Hansen solubility parameters with thermal analysis of drug/excipient miscibility can be successfully applied to predict formation of glass solutions with melt extrusion.

  1. On the surviving fraction in irradiated multicellular tumour spheroids: calculation of overall radiosensitivity parameters, influence of hypoxia and volume effects.

    PubMed

    Horas, Jorge A; Olguin, Osvaldo R; Rizzotto, Marcos G

    2005-04-21

    We model the heterogeneous response to radiation of multicellular tumour spheroids assuming position- and volume-dependent radiosensitivity. We propose a method to calculate the overall radiosensitivity parameters to obtain the surviving fraction of tumours. A mathematical model of a spherical tumour with a hypoxic core and a viable rim which is a caricature of a real tumour is constructed. The model is embedded in a two-compartment linear-quadratic (LQ) model, assuming a mixed bivariated Gaussian distribution to attain the radiosensitivity parameters. Ergodicity, i.e., the equivalence between ensemble and volumetric averages is used to obtain the overall radiosensitivities for the two compartments. We obtain expressions for the overall radiosensitivity parameters resulting from the use of both a linear and a nonlinear dependence of the local radiosensitivity with position. The model's results are compared with experimental data of surviving fraction (SF) for multicellular spheroids of different sizes. We make one fit using only the smallest spheroid data and we are able to predict the SF for the larger spheroids. These predictions are acceptable particularly using bounded sensitivities. We conclude with the importance of taking into account the contribution of clonogenic hypoxic cells to radiosensitivity and with the convenience of using bounded local sensitivities to predict overall radiosensitivity parameters.

  2. Uranium Mill Tailings Remedial Action Project (UMTRAP), Slick Rock, Colorado, Revision 1. Volume 2, Calculations, Final design for construction

    SciTech Connect

    1995-09-01

    Volume two contains calculations for: embankment design--slope stability analysis; embankment design--excavation stability; embankment design--settlement and cover cracking analysis; radon barrier design--statistical analysis of ra-226 concentrations for North Continent and Union Carbide sites; radon barrier design--RAECOM input data; radon barrier design--design thickness; and cover design--frost penetration depth.

  3. Controller Design for Linear Stochastic Systems with Uncertain Parameters.

    DTIC Science & Technology

    1985-03-01

    example may be designed on a numerical basis. Also, the equivalence of this solution to the minimax solution may be analyzed numerically . Finally, in...must be such that Equation (3a) has a unique solution that is sample-path continuous, c) w must be such that the cost function, (5), is well-defined...problem can be reformulated as an optimization problem with equality constraints. 3.3. Problem Redefinition and Solution The system equations , (3

  4. Parameter Study of the LIFE Engine Nuclear Design

    SciTech Connect

    Kramer, K J; Meier, W R; Latkowski, J F; Abbott, R P

    2009-07-10

    LLNL is developing the nuclear fusion based Laser Inertial Fusion Energy (LIFE) power plant concept. The baseline design uses a depleted uranium (DU) fission fuel blanket with a flowing molten salt coolant (flibe) that also breeds the tritium needed to sustain the fusion energy source. Indirect drive targets, similar to those that will be demonstrated on the National Ignition Facility (NIF), are ignited at {approx}13 Hz providing a 500 MW fusion source. The DU is in the form of a uranium oxycarbide kernel in modified TRISO-like fuel particles distributed in a carbon matrix forming 2-cm-diameter pebbles. The thermal power is held at 2000 MW by continuously varying the 6Li enrichment in the coolants. There are many options to be considered in the engine design including target yield, U-to-C ratio in the fuel, fission blanket thickness, etc. Here we report results of design variations and compare them in terms of various figures of merit such as time to reach a desired burnup, full-power years of operation, time and maximum burnup at power ramp down and the overall balance of plant utilization.

  5. Calculating the System Efficiency of the NETL Gas-Turbine/Fuel-Cell Hybrid System Using a Fully Coupled Lumped Parameter System Model

    SciTech Connect

    VanOsdol, J.G.; Tucker, D.A.

    2006-11-01

    Thermodynamic efficiency must be considered in the effective analysis of gas turbine fuel cell power generation system performance. In most numerical simulations of hybrid systems, the use of compressor maps and turbine maps are neglected. It is assumed that the design criterion generated by the system model can be met by the manufacturer of these items. These system models may use partial information from a compressor map, or a turbine map, but they fail to match all the operating conditions of both maps in a hybrid configuration. Also, to simplify the calculations that are performed by the complex hybrid system models, the effects of heat transfer and fluid dynamic drag are often decoupled. When system calculations are done in this way, the resulting calculations for system efficiency may suffer error. Hybrid system designers need a simple method to calculate the system performance directly from the maps of real compressors and real turbines that currently exist, and that would be part of a hybrid system. In this work, a simple procedure is illustrated where a coupled analysis of the various system components is performed and included as part of the system model. This analysis is done using the compressor and turbine maps of the hybrid performance project hardware at the U.S. Department of Energy, National Energy Technology Laboratory (NETL). Model parameters are tuned using experimental conditions and results are obtained. The results show the importance of aerodynamic coupling in system models, and how this coupling affects the system efficiency calculations. This coupling becomes important especially for the variable density flows that are typically found in combustors, heat exchangers and fuel cells.

  6. Sample size/power calculation for stratified case-cohort design.

    PubMed

    Hu, Wenrong; Cai, Jianwen; Zeng, Donglin

    2014-10-15

    The case-cohort (CC) study design usually has been used for risk factor assessment in epidemiologic studies or disease prevention trials for rare diseases. The sample size/power calculation for a stratified CC (SCC) design has not been addressed before. This article derives such result based on a stratified test statistic. Simulation studies show that the proposed test for the SCC design utilizing small sub-cohort sampling fractions is valid and efficient for situations where the disease rate is low. Furthermore, optimization of sampling in the SCC design is discussed and compared with proportional and balanced sampling techniques. An epidemiological study is provided to illustrate the sample size calculation under the SCC design.

  7. Ab initio calculation of Hubbard parameters for Rydberg-dressed atoms in a one-dimensional optical lattice

    NASA Astrophysics Data System (ADS)

    Chougale, Yashwant; Nath, Rejish

    2016-07-01

    We obtain ab initio the Hubbard parameters for Rydberg-dressed atoms in a one-dimensional (1D) sinusoidal optical lattice on the basis of maximally-localized Wannier states. Finite range, soft-core interatomic interactions become the trait of Rydberg admixed atoms, which can be extended over many neighboring lattice sites. In contrast to dipolar gases, where the interactions follow an inverse cubic law, the key feature of Rydberg-dressed interactions is the possibility of making neighboring couplings to the same magnitude as that of the onsite ones. The maximally-localized Wannier functions (MLWFs) are typically calculated via a spread-minimization procedure (Marzari N and Vanderbilt D 1997 Phys. Rev. B 56 12847) and are always found to be real functions apart from a trivial global phase when an isolated set of Bloch bands are considered. For an isolated single Bloch band, the above procedure reduces to a simple quasi-momentum-dependent unitary phase transformation. Here, instead of minimizing the spread, we employ a diagonal phase transformation which eliminates the imaginary part of the Wannier functions. The resulting Wannier states are found to be maximally localized and in exact agreement with those obtained via a spread-minimization procedure. Using these findings, we calculate the Hubbard couplings from the Rydberg admixed interactions, including dominant density-assisted tunneling (DAT) coefficients. Finally, we provide realistic lattice parameters for the state-of-the-art experimental Rydberg-dressed rubidium setup.

  8. Computer program TRACK_TEST for calculating parameters and plotting profiles for etch pits in nuclear track materials

    NASA Astrophysics Data System (ADS)

    Nikezic, D.; Yu, K. N.

    2006-01-01

    A computer program called TRACK_TEST for calculating parameters (lengths of the major and minor axes) and plotting profiles in nuclear track materials resulted from light-ion irradiation and subsequent chemical etching is described. The programming steps are outlined, including calculations of alpha-particle ranges, determination of the distance along the particle trajectory penetrated by the chemical etchant, calculations of track coordinates, determination of the lengths of the major and minor axes and determination of the contour of the track opening. Descriptions of the program are given, including the built-in V functions for the two commonly employed nuclear track materials commercially known as LR 115 (cellulose nitrate) and CR-39 (poly allyl diglycol carbonate) irradiated by alpha particles. Program summaryTitle of the program:TRACK_TEST Catalogue identifier:ADWT Program obtainable from:CPC Program Library, Queen's University of Belfast, N. Ireland Program summary URL:http://cpc.cs.qub.ac.uk/summaries/ADWT Computer:Pentium PC Operating systems:Windows 95+ Programming language:Fortran 90 Memory required to execute with typical data:256 MB No. of lines in distributed program, including test data, etc.: 2739 No. of bytes in distributed program, including test data, etc.:204 526 Distribution format:tar.gz External subprograms used:The entire code must be linked with the MSFLIB library Nature of problem: Fast heavy charged particles (like alpha particles and other light ions etc.) create latent tracks in some dielectric materials. After chemical etching in aqueous NaOH or KOH solutions, these tracks become visible under an optical microscope. The growth of a track is based on the simultaneous actions of the etchant on undamaged regions (with the bulk etch rate V) and along the particle track (with the track etch rate V). Growth of the track is described satisfactorily by these two parameters ( V and V). Several models have been presented in the past describing

  9. Development of a neutronics calculation method for designing commercial type Japanese sodium-cooled fast reactor

    SciTech Connect

    Takeda, T.; Shimazu, Y.; Hibi, K.; Fujimura, K.

    2012-07-01

    Under the R and D project to improve the modeling accuracy for the design of fast breeder reactors the authors are developing a neutronics calculation method for designing a large commercial type sodium- cooled fast reactor. The calculation method is established by taking into account the special features of the reactor such as the use of annular fuel pellet, inner duct tube in large fuel assemblies, large core. The Verification and Validation, and Uncertainty Qualification (V and V and UQ) of the calculation method is being performed by using measured data from the prototype FBR Monju. The results of this project will be used in the design and analysis of the commercial type demonstration FBR, known as the Japanese Sodium fast Reactor (JSFR). (authors)

  10. Understanding facilities design parameters for a remanufacturing system

    NASA Astrophysics Data System (ADS)

    Topcu, Aysegul; Cullinane, Thomas

    2005-11-01

    Remanufacturing is rapidly becoming a very important element in the economies of the world. Products such as washing machines, clothes driers, automobile parts, cell phones and a wide range of consumer durable goods are being reclaimed and sent through processes that restore these products to levels of operating performance that are as good or better than their new product performance. The operations involved in the remanufacturing process add several new dimensions to the work that must be performed. Disassembly is an operation that rarely appears on the operations chart of a typical production facility. The inspection and test functions in remanufacturing most often involve several more tasks than those involved in the first time manufacturing cycle. A close evaluation of most any remanufacturing operation reveals several points in the process in which parts must be cleaned, tested and stored. Although several researchers have focused their work on optimizing the disassembly function and the inspection, test and store functions, very little research has been devoted to studying the impact of the facilities design on the effectiveness of the remanufacturing process. The purpose of this paper will be to delineate the differences between first time manufacturing operations and remanufacturing operations for durable goods and to identify the features of the facilities design that must be considered if the remanufacturing operations are to be effective.

  11. Learning Effects in the Block Design Task: A Stimulus Parameter-Based Approach

    ERIC Educational Resources Information Center

    Miller, Joseph C.; Ruthig, Joelle C.; Bradley, April R.; Wise, Richard A.; Pedersen, Heather A.; Ellison, Jo M.

    2009-01-01

    Learning effects were assessed for the block design (BD) task, on the basis of variation in 2 stimulus parameters: perceptual cohesiveness (PC) and set size uncertainty (U). Thirty-one nonclinical undergraduate students (19 female) each completed 3 designs for each of 4 varied sets of the stimulus parameters (high-PC/high-U, high-PC/low-U,…

  12. Sensitivity of optimum solutions to problem parameters. [in aircraft design

    NASA Technical Reports Server (NTRS)

    Sobieszczanski-Sobieski, J.; Riley, K. M.; Barthelemy, J.-F.

    1981-01-01

    In an aircraft configuration optimization, the information of interest is the sensitivity of optimal block fuel consumption and wing aspect ratio and area, to variations of required range and payload. The objectives of this study are: (1) to show how the equations capable of yielding the sensitivity derivatives (the sensitivity equations) can be obtained for a constrained optimum regardless of the type of optimization algorithm that was used to arrive at the optimum point, (2) to review the solvability of the sensitivity equations and (3) to report on applications on structural optimization. Numerical examples, which demonstrate the sensitivity analysis, include a tubular column and a three-bar truss for which closed form solutions are obtained, a ten-bar truss that requires the use of a finite element analysis, and a thin-walled beam characterized by strongly nonlinear constraints for local buckling. It is concluded that a practically significant extrapolation accuracy may be obtained for a reasonably broad range of parameter changes; and that accuracy does not depend strongly on the degree of convergence of the optimum solution from which the sensitivity derivatives are obtained.

  13. PYFLOW: A computer code for the calculation of the impact parameters of Dilute Pyroclastic Density Currents (DPDC) based on field data

    NASA Astrophysics Data System (ADS)

    Dioguardi, Fabio; Dellino, Pierfrancesco

    2014-05-01

    PYFLOW is a computer code designed for quantifying the hazard related to Dilute Pyroclastic Density Currents (DPDC). DPDCs are multiphase flows that form during explosive volcanic eruptions. They are the major source of hazard related to volcanic eruptions, as they exert a significant stress over buildings and transport significant amounts of volcanic ash, which is hot and unbreathable. The program calculates the DPDC's impact parameters (e.g. dynamic pressure and particle volumetric concentration) and is founded on the turbulent boundary layer theory adapted to a multiphase framework. Fluid-dynamic variables are searched with a probabilistic approach, meaning that for each variable the average, maximum and minimum solutions are calculated. From these values, PYFLOW creates probability functions that allow to calculate the parameter at a given percentile. The code is written in Fortran 90 and can be compiled and installed on Windows, Mac OS X, Linux operating systems (OS). A User's manual is provided, explaining the details of the theoretical background, the setup and running procedure and the input data. The model inputs are DPDC deposits data, e.g. particle grainsize, layer thickness, particles shape factor and density. PYFLOW reads input data from a specifically designed input file or from the user's direct typing by command lines. Guidelines for writing input data are also contained in the package. PYFLOW guides the user at each step of execution, asking for additional data and inputs. The program is a tool for DPDC hazard assessment and, as an example, an application to the DPDC deposits of the Agnano-Monte Spina eruption (4.1 ky BP) at Campi Flegrei (Italy) is presented.

  14. The Design Parameters for the MICE Tracker Solenoid

    SciTech Connect

    Green, Michael A.; Chen, C.Y.; Juang, Tiki; Lau, Wing W.; Taylor,Clyde; Virostek, Steve P.; Wahrer, Robert; Wang, S.T.; Witte, Holger; Yang, Stephanie Q.

    2006-08-20

    The first superconducting magnets to be installed in the muon ionization cooling experiment (MICE) will be the tracker solenoids. The tracker solenoid module is a five coil superconducting solenoid with a 400 mm diameter warm bore that is used to provide a 4 T magnetic field for the experiment tracker module. Three of the coils are used to produce a uniform field (up to 4 T with better than 1 percent uniformity) in a region that is 300 mm in diameter and 1000 mm long. The other two coils are used to match the muon beam into the MICE cooling channel. Two 2.94-meter long superconducting tracker solenoid modules have been ordered for MICE. The tracker solenoid will be cooled using two-coolers that produce 1.5 W each at 4.2 K. The magnet system is described. The decisions that drive the magnet design will be discussed in this report.

  15. Optimum design calculations for detectors based on ZnSe(Те,О) scintillators

    NASA Astrophysics Data System (ADS)

    Katrunov, K.; Ryzhikov, V.; Gavrilyuk, V.; Naydenov, S.; Lysetska, O.; Litichevskyi, V.

    2013-06-01

    Light collection in scintillators ZnSe(X), where X is an isovalent dopant, was studied using Monte Carlo calculations. Optimum design was determined for detectors of "scintillator—Si-photodiode" type, which can involve either one scintillation element or scintillation layers of large area made of small-crystalline grains. The calculations were carried out both for determination of the optimum scintillator shape and for design optimization of light guides, on the surface of which the layer of small-crystalline grains is formed.

  16. Inter-comparison of calculation techniques of the electron Boltzmann equation for the analysis of swarm parameters in CO2

    NASA Astrophysics Data System (ADS)

    Grofulović, M.; Pinhão, N.; Alves, Ll; Guerra, V.; Loffhagen, D.; Korolov, I.; Vass, M.; Donkó, Z.

    2016-09-01

    The plasma-based CO2 conversion is a promising route for achieving the reduction of fossil fuel consumption and of CO2 emission. An accurate description of the electron kinetics by solving the electron Boltzmann equation (EBE) is necessary for this application. This work is dedicated to the inter-comparison between various calculation techniques of the EBE (two-term, multi-term and space gradients of the electron density) and the Monte-Carlo reference technique for the analysis of swarm parameters and their comparison with previously available and present experimental data. We adopt the complete set of electron-impact cross sections for CO2, to be published on the IST-LISBON database with LXCat. Results show that despite the fact that the IST-LISBON cross sections were derived to fit measured swarm parameters when used in a two-term expansion Boltzmann code, good agreement with the other solution and simulation techniques is generally obtained for the electron swarm parameters under consideration. Work partially supported by grant OTKA-K-105476 and by Portuguese FCT, under project UID/FIS/50010/2013 and grant PD/BD/105884/2014 (PD-F APPLAuSE).

  17. Parameters for the RM1 Quantum Chemical Calculation of Complexes of the Trications of Thulium, Ytterbium and Lutetium.

    PubMed

    Filho, Manoel A M; Dutra, José Diogo L; Rocha, Gerd B; Simas, Alfredo M; Freire, Ricardo O

    2016-01-01

    The RM1 quantum chemical model for the calculation of complexes of Tm(III), Yb(III) and Lu(III) is advanced. Subsequently, we tested the models by fully optimizing the geometries of 126 complexes. We then compared the optimized structures with known crystallographic ones from the Cambridge Structural Database. Results indicate that, for thulium complexes, the accuracy in terms of the distances between the lanthanide ion and its directly coordinated atoms is about 2%. Corresponding results for ytterbium and lutetium are both 3%, levels of accuracy useful for the design of lanthanide complexes, targeting their countless applications.

  18. Parameters for the RM1 Quantum Chemical Calculation of Complexes of the Trications of Thulium, Ytterbium and Lutetium

    PubMed Central

    Filho, Manoel A. M.; Dutra, José Diogo L.; Rocha, Gerd B.; Simas, Alfredo M.

    2016-01-01

    The RM1 quantum chemical model for the calculation of complexes of Tm(III), Yb(III) and Lu(III) is advanced. Subsequently, we tested the models by fully optimizing the geometries of 126 complexes. We then compared the optimized structures with known crystallographic ones from the Cambridge Structural Database. Results indicate that, for thulium complexes, the accuracy in terms of the distances between the lanthanide ion and its directly coordinated atoms is about 2%. Corresponding results for ytterbium and lutetium are both 3%, levels of accuracy useful for the design of lanthanide complexes, targeting their countless applications. PMID:27223475

  19. Computer calculations of wire-rope tiedown designs for radioactive materials packages

    SciTech Connect

    Shappert, L.B.; Ratledge, J.E.; Moore, R.S.; Dorsey, E.A.

    1995-12-31

    This Regulatory Compliance Guide (RCG) provides guidance on the use and selection of appropriate wire rope type package tiedowns. It provides an effective way to encourage and to ensure uniform implementation of regulatory requirements applicable to tiedowns. It provides general guidelines for securing packages weighing 5,000 pounds or greater that contain radioactive materials onto legal weight trucks (exclusive of packagings having their own trailer with trunnion type tiedown). This RCG includes a computerized Tiedown Stress Calculation Program (TSCP) which calculates the stresses in the wire-rope tiedowns and specifies appropriate sizes of wire rope and associated hardware parameters (such as turnback length, number of cable clips, etc.).

  20. Parameter estimation and uncertainty quantification in a biogeochemical model using optimal experimental design methods

    NASA Astrophysics Data System (ADS)

    Reimer, Joscha; Piwonski, Jaroslaw; Slawig, Thomas

    2016-04-01

    The statistical significance of any model-data comparison strongly depends on the quality of the used data and the criterion used to measure the model-to-data misfit. The statistical properties (such as mean values, variances and covariances) of the data should be taken into account by choosing a criterion as, e.g., ordinary, weighted or generalized least squares. Moreover, the criterion can be restricted onto regions or model quantities which are of special interest. This choice influences the quality of the model output (also for not measured quantities) and the results of a parameter estimation or optimization process. We have estimated the parameters of a three-dimensional and time-dependent marine biogeochemical model describing the phosphorus cycle in the ocean. For this purpose, we have developed a statistical model for measurements of phosphate and dissolved organic phosphorus. This statistical model includes variances and correlations varying with time and location of the measurements. We compared the obtained estimations of model output and parameters for different criteria. Another question is if (and which) further measurements would increase the model's quality at all. Using experimental design criteria, the information content of measurements can be quantified. This may refer to the uncertainty in unknown model parameters as well as the uncertainty regarding which model is closer to reality. By (another) optimization, optimal measurement properties such as locations, time instants and quantities to be measured can be identified. We have optimized such properties for additional measurement for the parameter estimation of the marine biogeochemical model. For this purpose, we have quantified the uncertainty in the optimal model parameters and the model output itself regarding the uncertainty in the measurement data using the (Fisher) information matrix. Furthermore, we have calculated the uncertainty reduction by additional measurements depending on time

  1. Numerical algorithms for estimation and calculation of parameters in modeling pest population dynamics and evolution of resistance.

    PubMed

    Shi, Mingren; Renton, Michael

    2011-10-01

    Computational simulation models can provide a way of understanding and predicting insect population dynamics and evolution of resistance, but the usefulness of such models depends on generating or estimating the values of key parameters. In this paper, we describe four numerical algorithms generating or estimating key parameters for simulating four different processes within such models. First, we describe a novel method to generate an offspring genotype table for one- or two-locus genetic models for simulating evolution of resistance, and how this method can be extended to create offspring genotype tables for models with more than two loci. Second, we describe how we use a generalized inverse matrix to find a least-squares solution to an over-determined linear system for estimation of parameters in probit models of kill rates. This algorithm can also be used for the estimation of parameters of Freundlich adsorption isotherms. Third, we describe a simple algorithm to randomly select initial frequencies of genotypes either without any special constraints or with some pre-selected frequencies. Also we give a simple method to calculate the "stable" Hardy-Weinberg equilibrium proportions that would result from these initial frequencies. Fourth we describe how the problem of estimating the intrinsic rate of natural increase of a population can be converted to a root-finding problem and how the bisection algorithm can then be used to find the rate. We implemented all these algorithms using MATLAB and Python code; the key statements in both codes consist of only a few commands and are given in the appendices. The results of numerical experiments are also provided to demonstrate that our algorithms are valid and efficient.

  2. On the reliability of the temperature calculation code Linsourprepost suitable to design a HLW-repository

    SciTech Connect

    Mueller-Hoeppe, N.; Engelmann, H.J.; Biurrun, E.

    1994-12-31

    When designing a final repository for heat generating radioactive waste in rock salt, the temperature increase is of great importance with respect to the stability and long term safety of the repository. A highly efficient temperature calculation computer code is available which is verified and validated.

  3. The slope parameter approach to marine cathodic protection design and its application to impressed current systems

    SciTech Connect

    Hartt, W.H.

    1999-07-01

    The recently developed slope parameter approach to design of galvanic anode cathodic protection (cp) systems for marine structures constitutes an advancement in this technology compared to current practice, primarily because the former is first principles based and the latter is an empirical algorithm. In this paper, the slope parameter approach is reviewed; and related applications for which it can be utilized, including (1) design of new and retrofit cp systems, (2) evaluation of potential survey data, and (3) cp system design for complex geometries, are mentioned. The design current density is identified as the single remaining parameter for which values must be projected solely by experience or experimentation. In addition, the slope parameter approach is applied to the results of impressed current cp experiments, and it is shown how parameters for this can be interrelated with those of galvanic anode cp. Advantages of this capability are identified and discussed.

  4. A procedure for the calculation of alpha function coefficients for the attraction parameter of Van der Waals equations of state

    SciTech Connect

    Stamateris, B.; Olivera-Fuentes, C.

    1996-12-31

    A new procedure is proposed for the calculation and correlation of cohesion parameters in cubic equations of state of the Van der Waals type. In this method, the derivative (rather than the function itself) is computed subject to the Maxwell (equal area) and Clapeyron equations. Strong experimental evidence indicates that properly formulated a functions must generate negative values at high temperatures. A theoretical analysis demonstrates the correct, hard-body limiting behavior of the cohesion function at infinite temperatures. From this, the simplest possible form of the cohesion function follows as a two-constant expression that can be considered an extension of a functional form previously proposed by Martin. The proposed function`s performance is comparable to more complex expressions previously presented in the literature, predicting vapor pressures of polar and nonpolar fluids with relative deviations (i) of {+-} 1%. 14 refs., 2 figs., 1 tab.

  5. NASA battery testbed: A designed experiment for the optimization of LEO battery operational parameters

    SciTech Connect

    Deligiannis, F.; Perrone, D.; Distefano, S.

    1996-02-01

    Simulation of spacecraft battery operation is implemented. Robust design experiment to obtain optimum battery operational parameters is performed. It is found that short term tests using robust design of experiments can provide guidelines for optimum battery operation. It is decided to use robust design approach to provide guidelines for battery operation on current spacecraft in orbit as batteries age (GRO, UARS, EUVE, TOPEX).

  6. NASA battery testbed: A designed experiment for the optimization of LEO battery operational parameters

    NASA Technical Reports Server (NTRS)

    Deligiannis, F.; Perrone, D.; DiStefano, S.

    1996-01-01

    Simulation of spacecraft battery operation is implemented. Robust design experiment to obtain optimum battery operational parameters is performed. It is found that short term tests using robust design of experiments can provide guidelines for optimum battery operation. It is decided to use robust design approach to provide guidelines for battery operation on current spacecraft in orbit as batteries age (GRO, UARS, EUVE, TOPEX).

  7. Efficient method for calculating kinetic parameters using T1-weighted dynamic contrast-enhanced magnetic resonance imaging.

    PubMed

    Murase, Kenya

    2004-04-01

    It has become increasingly important to quantitatively estimate tissue physiological parameters such as perfusion, capillary permeability, and the volume of extravascular-extracellular space (EES) using T(1)-weighted dynamic contrast-enhanced MRI (DCE-MRI). A linear equation was derived by integrating the differential equation describing the kinetic behavior of contrast agent (CA) in tissue, from which K(1) (rate constant for the transfer of CA from plasma to EES), k(2) (rate constant for the transfer from EES to plasma), and V(p) (plasma volume) can be easily obtained by the linear least-squares (LLSQ) method. The usefulness of this method was investigated by means of computer simulations, in comparison with the nonlinear least-squares (NLSQ) method. The new method calculated the above parameters faster than the NLSQ method by a factor of approximately 6, and estimated them more accurately than the NLSQ method at a signal-to-noise ratio (SNR) of < approximately 10. This method will be useful for generating functional images of K(1), k(2), and V(p) from DCE-MRI data.

  8. Effect of Design Changes On Remote Handled Trench Waste Form Release Calculations

    SciTech Connect

    Bacon, Diana H.; McGrail, B. Peter

    2002-09-20

    A set of reactive chemical transport calculations was conducted with the Subsurface Transport Over Reactive Multi-phases (STORM) code to evaluate the long-term performance of a representative low-activity waste glass in a shallow subsurface disposal system located on the Hanford Site. One-dimensional simulations were conducted out to times of 20,000 yr. The simulations predict a lower release rate for the new trench design (0.605 ppm/yr) than for the old trench design (0.726 ppm/yr). Because the glass corrosion rate is significantly higher at the backfill/glass interfaces, having one less interface with the 3-layer design offsets the effect of the slightly higher pH relative to the 4-layer design. The differences between the old and new trench designs were much less significant than differences due to differences in recharge rate.

  9. Using design effects from previous cluster surveys to guide sample size calculation in emergency settings.

    PubMed

    Kaiser, Reinhard; Woodruff, Bradley A; Bilukha, Oleg; Spiegel, Paul B; Salama, Peter

    2006-06-01

    A good estimate of the design effect is critical for calculating the most efficient sample size for cluster surveys. We reviewed the design effects for seven nutrition and health outcomes from nine population-based cluster surveys conducted in emergency settings. Most of the design effects for outcomes in children, and one-half of the design effects for crude mortality, were below two. A reassessment of mortality data from Kosovo and Badghis, Afghanistan revealed that, given the same number of clusters, changing sample size had a relatively small impact on the precision of the estimate of mortality. We concluded that, in most surveys, assuming a design effect of 1.5 for acute malnutrition in children and two or less for crude mortality would produce a more efficient sample size. In addition, enhancing the sample size in cluster surveys without increasing the number of clusters may not result in substantial improvements in precision.

  10. A computer module used to calculate the horizontal control surface size of a conceptual aircraft design

    NASA Technical Reports Server (NTRS)

    Sandlin, Doral R.; Swanson, Stephen Mark

    1990-01-01

    The creation of a computer module used to calculate the size of the horizontal control surfaces of a conceptual aircraft design is discussed. The control surface size is determined by first calculating the size needed to rotate the aircraft during takeoff, and, second, by determining if the calculated size is large enough to maintain stability of the aircraft throughout any specified mission. The tail size needed to rotate during takeoff is calculated from a summation of forces about the main landing gear of the aircraft. The stability of the aircraft is determined from a summation of forces about the center of gravity during different phases of the aircraft's flight. Included in the horizontal control surface analysis are: downwash effects on an aft tail, upwash effects on a forward canard, and effects due to flight in close proximity to the ground. Comparisons of production aircraft with numerical models show good accuracy for control surface sizing. A modified canard design verified the accuracy of the module for canard configurations. Added to this stability and control module is a subroutine that determines one of the three design variables, for a stable vectored thrust aircraft. These include forward thrust nozzle position, aft thrust nozzle angle, and forward thrust split.

  11. Parameter-Level Data Flow Modeling Oriented to Product Design Process

    NASA Astrophysics Data System (ADS)

    Li, Shen; Shao, Xiao Dong; Zhang, Zhi Hua; Ge, Xiao Bo

    2015-12-01

    In this paper, a method of data flow modeling for a product design process oriented to data parameter is proposed. The data parameters are defined, which are classified as the basic data parameters and complex data parameters. The mechanism of the mapping relationship between different forms of documents and some basic data parameters, and a data transmission based on parameters, are constructed. Aiming at the characteristics of the iterative design process, the parameters version mechanism including node modification and iteration information is proposed. The data parameters transmission relationships are represented by a parameters network model (PNM) based on a directed graph. Finally, through the table of data parameters mapping onto the workflow node and PNM, the data ports and data links in the data flow model are generated automatically by the program. Validation in the 15-meter-diameter S/Ka frequency band antenna design process of the “Reflector, Back frame and Center part design” data flow model shows that the method can effectively shorten the time of data flow modeling and improve the data transmission efficiency.

  12. Calculation of alloying effect on formation enthalpy of TiCu intermetallics from first-principles calculations for designing Ti-Cu-system metallic glasses

    NASA Astrophysics Data System (ADS)

    Shirasawa, Naoya; Takigawa, Yorinobu; Uesugi, Tokuteru; Higashi, Kenji

    2016-01-01

    The effect of alloying on the formation enthalpy of TiCu intermetallics was investigated via first-principles calculations to propose a new design method for Ti-Cu-system metallic glasses. The calculation results showed good agreement with the reported experimental results that Ni, Pd, Sn and Zr improve this system's glass-forming ability. According to the calculation results, a Ti-Zr-Cu-Ga system was designed as a potential new bulk Ti-based metallic glass, and a bulk sample with a 2-mm diameter was fabricated.

  13. Review & Peer Review of “Parameters for Properly Designed and Operated Flares” Documents

    EPA Pesticide Factsheets

    This page contains two 2012 memoranda on the review of EPA's parameters for properly designed and operated flares. One details the process of peer review, and the other provides background information and specific charge questions to the panel.

  14. Numerical calculation of the parameters of the efflux from a helium dewar used for cooling of heat shields in a satellite

    NASA Technical Reports Server (NTRS)

    Brendley, K.; Chato, J. C.

    1982-01-01

    The parameters of the efflux from a helium dewar in space were numerically calculated. The flow was modeled as a one dimensional compressible ideal gas with variable properties. The primary boundary conditions are flow with friction and flow with heat transfer and friction. Two PASCAL programs were developed to calculate the efflux parameters: EFFLUZD and EFFLUXM. EFFLUXD calculates the minimum mass flow for the given shield temperatures and shield heat inputs. It then calculates the pipe lengths, diameter, and fluid parameters which satisfy all boundary conditions. Since the diameter returned by EFFLUXD is only rarely of nominal size, EFFLUXM calculates the mass flow and shield heat exchange for given pipe lengths, diameter, and shield temperatures.

  15. Reassessment of Human Performance Parameter Estimates for Respiratory Protection Design and Development

    DTIC Science & Technology

    2008-01-01

    Am. Ind. Hyg. Assoc. J. 1992, 53, pp 193-202. 4. Letowski, T.R.; Ricard, G.L.; Grieves, J.E. The Effect of the XM45 Gas Mask and Hood on Directional...Historical mask wear human performance research offers useful, albeit limited, insights on the relationships between design parameters and performance. The...purposes of the current task were to review and revise the existing human performance capabilities and mask design parameters databases and to derive new

  16. Quasi-three dimensional hydraulic design and performance calculation of high specific speed mixed-flow pump

    NASA Astrophysics Data System (ADS)

    Su, M.; Zhang, Y. X.; Zhang, J. Y.; Hou, H. C.

    2016-05-01

    According to the basic parameters of 211-80 high specific speed mixed-flow pump, based on the quasi-three dimensional flow theory, the hydraulic design of impeller and its matching spaced guide vanes for high specific speed mixed flow pump was completed, in which the iterative calculation of S 1, S 2 stream surfaces was employed to obtain meridional flow fields and the point-by-point integration method was employed to draw blade camber lines. Blades are thickened as well as blade leading edges are smoothed in the conformal mapping surface. Subsequently the internal fields of the whole flow passage of the designed pump were simulated by using RANS equations with RNG k-ε two-equation turbulent model. The results show that, compared with the 211-80 model, the hydraulic efficiency of the designed pump at the optimal flow rate increases 9.1%. The hydraulic efficiency of designed pump in low flow rate condition (78% designed flow rate) increases 6.46%. The hydraulic efficiency in high flow rate areas increases obviously and there is no bad phenomenon of suddenly decrease of hydraulic efficiency in model pump. From the distributions of velocity and pressure fields, it can be seen that the flow in impeller is uniform and the increase of pressure is gentle. There are no obvious impact phenomenon on impeller inlet and obvious wake shedding vortex phenomenon from impeller outlet to guide vanes inlet.

  17. Algorithms of D-optimal designs for Morgan Mercer Flodin (MMF) models with three parameters

    NASA Astrophysics Data System (ADS)

    Widiharih, Tatik; Haryatmi, Sri; Gunardi, Wilandari, Yuciana

    2016-02-01

    Morgan Mercer Flodin (MMF) model is used in many areas including biological growth studies, animal and husbandry, chemistry, finance, pharmacokinetics and pharmacodynamics. Locally D-optimal designs for Morgan Mercer Flodin (MMF) models with three parameters are investigated. We used the Generalized Equivalence Theorem of Kiefer and Wolvowitz to determine D-optimality criteria. Number of roots for standardized variance are determined using Tchebysheff system concept and it is used to decide that the design is minimally supported design. In these models, designs are minimally supported designs with uniform weight on its support, and the upper bound of the design region is a support point.

  18. The Structure and Molecular Parameters of Camphene Determined by Fourier Transform Microwave Spectroscopy and Quantum Chemical Calculations

    NASA Astrophysics Data System (ADS)

    Neeman, Elias M.; Dréan, Pascal; Huet, T. R.

    2016-06-01

    The emission of volatile organic compounds, from plants has strong revelance for plant physiology, plant ecology and atmospheric chemistry. Camphene (C10H16) is a bicyclic monoterpene which is emitted in the atmosphere by biogenic sources. The structure of the unique stable conformer was optimized using density functional theory and ab initio calculations. The rotational spectrum of camphene was recorded in a supersonic jet expansion with a Fourier transform microwave spectrometer over the range 2-20 GHz. Signals from the parent species and from the ten 13C isotopomers were observed in natural abundance. The rotational and centrifugal distortion parameters were fitted to a Watson's Hamiltonian in the A-reduction. A magnetic hyperfine structure associated with the pairs of hydrogen nuclei in the methylene groups was observed and modeled.The rotational constants coupled to the equilibrium structure calculations were used to determine the r_0 and the r_m(1) gas-phase geometries of the carbon skeleton. The present work provides the first spectroscopic characterization of camphene in the gas phase and these results are also relevant for ozonolysis kinetics study through Criegee intermediates. R. Baraldi, F. Rapparini, O. Facini, D. Spano and P. Duce, Journal of Mediterranean Ecology, Vol.6, No.1, (2005). A. Bracho-Nunez, N. M. Knothe, S. Welter, M. Staudt, W. R. Costa, M. A. R. Liberato, M. T. F. Piedade, and J. Kesselmeier Biogeosciences, 10, 5855-5873, (2013). Minna Kivimäenpää, Narantsetseg Magsarjav, Rajendra Ghimire, Juha-Matti Markkanen, Juha Heijari, Martti Vuorinen and Jarmo K. Holopainen, Atmospheric Environment, 60, 477-485, (2012). R.C. de M. Oliveira and G. F. Bauerfeldt, J. Phys. Chem. A, 119 2802-2812 (2015)

  19. Proposed design of SAMUS (small angle muon spectrometer) toroid and its magnetic field calculation

    SciTech Connect

    Yamada, R.

    1988-06-09

    Presently the D/null/ detector has three big toroidal magnets; one Central Toroid (CF) and two End Wall Toroids (EF). The EF toroids have central openings 72'' x 72''. Originally, this opening was meant for possible future end-plug calorimeters. Instead we are now designing Small Angle Muon Spectrometer (SAMUS) for the opening. The major component will be built at Serpukhov. The design of the toroid magnets and its magnetic field calculations is being done by exchanging information between Serpukhov and Fermilab. 2 refs., 4 figs., 1 tab.

  20. Design and Properties Prediction of AMCO3F by First-Principles Calculations.

    PubMed

    Tian, Meng; Gao, Yurui; Ouyang, Chuying; Wang, Zhaoxiang; Chen, Liquan

    2017-04-10

    Computer simulation accelerates the rate of identification and application of new materials. To search for new materials to meet the increasing demands of secondary batteries with higher energy density, the properties of some transition-metal fluorocarbonates ([CO3F](3-)) were simulated in this work as cathode materials for Li- and Na-ion batteries based on first-principles calculations. These materials were designed by substituting the K(+) ions in KCuCO3F with Li(+) or Na(+) ions and the Cu(2+) ions with transition-metal ions such as Fe(2+), Co(2+), Ni(2+), and Mn(2+) ions, respectively. The phase stability, electronic conductivity, ionic diffusion, and electrochemical potential of these materials were calculated by first-principles calculations. After taking comprehensive consideration of the kinetic and thermodynamic properties, LiCoCO3F and LiFeCO3F are believed to be promising novel cathode materials in all of the calculated AMCO3F (A = Li and Na; M = Fe, Mn, Co, and Ni). These results will help the design and discovery of new materials for secondary batteries.

  1. Theoretical calculations of spin-Hamiltonian parameters for the square planer CuCl4 2 - cluster in Cs2ZrCl6 crystal

    NASA Astrophysics Data System (ADS)

    Liu, Gang; Mei, Yang; Zhang, Xin-Xin; Zheng, Wen-Chen

    2015-05-01

    The high-order perturbation formulas based on a two-mechanism model (where in addition to the contributions from the crystal-field (CF) mechanism in the usually-applied CF theory, those from the generally-neglected charge-transfer (CT) mechanism are also contained) are employed to calculate the spin-Hamiltonian parameters (g factors g//, g⊥ and the hyperfine structure constants A//, A⊥) of the square planar CuCl4 2 - clusters in Cs2ZrCl6 crystal. The needed CF energy levels in the calculations are obtained from the observed optical spectra. The calculated results show reasonable agreement with the experimented values. The negative sign of A// and positive sign of A⊥ are proposed from the calculations. The calculations also suggest that one should take account of the contributions due to both the CF and CT mechanisms for the exact and rational calculations of spin-Hamiltonian parameters of Cu2+-Cl- combination in crystals.

  2. Calculs ab initio de structures electroniques pour un meilleur design de polymeres photovoltaiques

    NASA Astrophysics Data System (ADS)

    Berube, Nicolas

    This thesis focuses on the role of density functional theory in the design of polymers for photovoltaic applications. Theoretical calculations are first studied in the characterization of polymers in the context of collaborations between theory and experiment. The stability and the energy levels of some organic molecules are studied before and after a sulfurization of their carbonyl groups, a process destined to lower the band gaps. The dynamics of the electronic processes and the Raman vibration spectra are also explored in a polycarbazole-based polymer. From then, the usefulness of theoretical calculations in the design of polymers before their syntheses is explored. Density functional theory calculations are studied under the Scharber model in order to predict the efficiency of organic solar cells. Then, a new approach for the design of low band gap polymer based on the aromatic or quinoid structures is established, whose efficiency surpasses the actual donor-acceptor approach. These studies are used in the exploration of the chemical space and several candidate for polymers with interesting electronic properties are presented.

  3. Calculating a parameter space to smoothly transport magnetically-trapped suspended superparamagnetic microbeads with electric-field domain wall control

    NASA Astrophysics Data System (ADS)

    McLellan, Brenda; Nowakowski, Mark; Bokor, Jeffrey; Liang, Cheng-Yen; Hockel, Joshua; Wetzlar, Kyle; Keller, Scott; Sohn, Hyunmin; Carman, Gregory; Young, Anthony; Doran, Andrew; Marcus, Matthew; Klaui, Mathias; Candler, Robert

    2015-03-01

    We demonstrate the capture and electrically-driven piecewise transport of superparamagnetic microbeads trapped in a magnetostatic potential energy well produced by the magnetic domain walls of Ni microrings on a [Pb(Mg1/3Nb2/3) O3]0.66-[PbTiO3]0.34 (PMN-PT) substrate. Here I present micromagnetic simulations that illustrate the formation of field-initialized domain walls in Ni microrings and calculate the approximate force of attraction experienced by superparamagnetic microbeads near the domain walls. This force is estimated as a function of the ring geometry, bead diameter, and distance from the domain wall, and provides an upper bound for the strain-mediated, electrically-induced domain wall velocity that can be implemented to smoothly transport coupled microbeads within a fluidic environment. These results provide an initial estimate for important technological parameters and set a foundation for the optimization of this microfluidic magnetic control scheme. Supported by E3S and TANMS.

  4. 10 CFR 60.141 - Confirmation of geotechnical and design parameters.

    Code of Federal Regulations, 2010 CFR

    2010-01-01

    ... 10 Energy 2 2010-01-01 2010-01-01 false Confirmation of geotechnical and design parameters. 60.141 Section 60.141 Energy NUCLEAR REGULATORY COMMISSION (CONTINUED) DISPOSAL OF HIGH-LEVEL RADIOACTIVE WASTES... engineering features are within design limits....

  5. Criteria for calculating the efficiency of deep-pleated HEPA filters with aluminum separators during and after design basis accidents

    SciTech Connect

    Bergman, W.; First, M.W.; Anderson, W.L.

    1995-02-01

    We have reviewed the literature on the performance of HEPA filters under normal and abnormal conditions to establish criteria for calculating the efficiency of HEPA filters in a DOE nonreactor nuclear facility during and after a Design Basis Accident (DBA). This study is only applicable to the standard deep-pleated HEPA filter with aluminum separators as specified in ASME N509[1]. Other HEPA filter designs such as the mini-pleat and separatorless filters are not included in this study. The literature review included the performance of new filters and parameters that may cause deterioration in the filter performance such as filter age, radiation, corrosive chemicals, seismic and rough handling, high temperature, moisture, particle clogging, high air flow and pressure pulses. The deterioration of the filter efficiency depends on the exposure parameters; in severe exposure conditions the filter will be damaged and have a residual efficiency of 0%. There are large gaps and limitations in the data that introduce significant error in the estimates of HEPA filter efficiencies under DBA conditions. Because of this limitation, conservative values of filter efficiency were chosen. The estimation of the efficiency of the HEPA filters under DBA conditions involves three steps: (1) The filter pressure drop and environmental parameters are determined during and after the DBA, (2) Comparing the filter pressure drop to a set of threshold values above which the filter is damaged. There is a different threshold value for each combination of environmental parameters, and (3) Determining the filter efficiency. If the filter pressure drop is greater than the threshold value, the filter is damaged and is assigned 0% efficiency. If the pressure drop is less, then the filter is not damaged and the efficiency is determined from literature values of the efficiency at the environmental conditions.

  6. Design parameters and source terms: Volume 2, Source terms: Revision 0

    SciTech Connect

    Not Available

    1987-10-01

    The Design Parameters and Source Terms Document was prepared in accordance with DOE request and to provide data for the environmental impact study to be performed in the future for the Deaf Smith County, Texas site for a nuclear waste repository in salt. This document updates a previous unpublished report by Stearns Catalytic Corporation (SCC), entitled ''Design Parameters and Source Terms for a Two-Phase Repository Salt,'' 1985, to the level of the Site Characterization Plan - Conceptual Design Report. The previous unpublished SCC Study identifies the data needs for the Environmental Assessment effort for seven possible Salt Repository sites. 2 tabs.

  7. Sample size calculations for the design of cluster randomized trials: A summary of methodology.

    PubMed

    Gao, Fei; Earnest, Arul; Matchar, David B; Campbell, Michael J; Machin, David

    2015-05-01

    Cluster randomized trial designs are growing in popularity in, for example, cardiovascular medicine research and other clinical areas and parallel statistical developments concerned with the design and analysis of these trials have been stimulated. Nevertheless, reviews suggest that design issues associated with cluster randomized trials are often poorly appreciated and there remain inadequacies in, for example, describing how the trial size is determined and the associated results are presented. In this paper, our aim is to provide pragmatic guidance for researchers on the methods of calculating sample sizes. We focus attention on designs with the primary purpose of comparing two interventions with respect to continuous, binary, ordered categorical, incidence rate and time-to-event outcome variables. Issues of aggregate and non-aggregate cluster trials, adjustment for variation in cluster size and the effect size are detailed. The problem of establishing the anticipated magnitude of between- and within-cluster variation to enable planning values of the intra-cluster correlation coefficient and the coefficient of variation are also described. Illustrative examples of calculations of trial sizes for each endpoint type are included.

  8. Development of a parameter optimization technique for the design of automatic control systems

    NASA Technical Reports Server (NTRS)

    Whitaker, P. H.

    1977-01-01

    Parameter optimization techniques for the design of linear automatic control systems that are applicable to both continuous and digital systems are described. The model performance index is used as the optimization criterion because of the physical insight that can be attached to it. The design emphasis is to start with the simplest system configuration that experience indicates would be practical. Design parameters are specified, and a digital computer program is used to select that set of parameter values which minimizes the performance index. The resulting design is examined, and complexity, through the use of more complex information processing or more feedback paths, is added only if performance fails to meet operational specifications. System performance specifications are assumed to be such that the desired step function time response of the system can be inferred.

  9. Multiobjective optimization in structural design with uncertain parameters and stochastic processes

    NASA Technical Reports Server (NTRS)

    Rao, S. S.

    1984-01-01

    The application of multiobjective optimization techniques to structural design problems involving uncertain parameters and random processes is studied. The design of a cantilever beam with a tip mass subjected to a stochastic base excitation is considered for illustration. Several of the problem parameters are assumed to be random variables and the structural mass, fatigue damage, and negative of natural frequency of vibration are considered for minimization. The solution of this three-criteria design problem is found by using global criterion, utility function, game theory, goal programming, goal attainment, bounded objective function, and lexicographic methods. It is observed that the game theory approach is superior in finding a better optimum solution, assuming the proper balance of the various objective functions. The procedures used in the present investigation are expected to be useful in the design of general dynamic systems involving uncertain parameters, stochastic process, and multiple objectives.

  10. End-point parameter adjustment on a small desk-top programmable calculator for logit-log analysis of radioimmunoassay data.

    PubMed

    Hatch, K F; Coles, E; Busey, H; Goldman, S C

    1976-08-01

    We describe an improved method of logit-log curve fitting, by adjusting end-point parameters in radioimmunoassay studies, for use with a small desk-top programmable calculator. Straight logit-log analyses are often deficient because of their high sensitivity to small errors in the end-point parametes B0 and NSB (the actual measured activity in the tubes). The literature suggests techniques for adjusting these end-point parameters, but they require too much computing time and programming space to be used with a desk-top programmable calculator. The extension to the logit-log model presented here is easily handled by the programmable calculator and provides a good estimate of the change required in B0 and NSB to obtain a better fit. The program requires 1.5 min to run on our desk-top programmable calculator, and has resulted in improved data analysis for all of the 11 types of radioimmunoassay studied.

  11. Achievements and challenges in automated parameter, shape and topology optimization for divertor design

    NASA Astrophysics Data System (ADS)

    Baelmans, M.; Blommaert, M.; Dekeyser, W.; Van Oevelen, T.

    2017-03-01

    Plasma edge transport codes play a key role in the design of future divertor concepts. Their long simulation times in combination with a large number of control parameters turn the design into a challenging task. In aerodynamics and structural mechanics, adjoint-based optimization techniques have proven successful to tackle similar design challenges. This paper provides an overview of achievements and remaining challenges with these techniques for complex divertor design. It is shown how these developments pave the way for fast sensitivity analysis and improved design from different perspectives.

  12. Design of Si-photonic structures to evaluate their radiation hardness dependence on design parameters

    NASA Astrophysics Data System (ADS)

    Zeiler, M.; Detraz, S.; Olantera, L.; Pezzullo, G.; Seif El Nasr-Storey, S.; Sigaud, C.; Soos, C.; Troska, J.; Vasey, F.

    2016-01-01

    Particle detectors for future experiments at the HL-LHC will require new optical data transmitters that can provide high data rates and be resistant against high levels of radiation. Furthermore, new design paths for future optical readout systems for HL-LHC could be opened if there was a possibility to integrate the optical components with their driving electronics and possibly also the silicon particle sensors themselves. All these functionalities could potentially be combined in the silicon photonics technology which currently receives a lot of attention for conventional optical link systems. Silicon photonic test chips were designed in order to assess the suitability of this technology for deployment in high-energy physics experiments. The chips contain custom-designed Mach-Zehnder modulators, pre-designed ``building-block'' modulators, photodiodes and various other passive test structures. The simulation and design flow of the custom designed Mach-Zehnder modulators and some first measurement results of the chips are presented.

  13. Design principle and calculations of a Scheffler fixed focus concentrator for medium temperature applications

    SciTech Connect

    Munir, A.; Hensel, O.; Scheffler, W.

    2010-08-15

    Scheffler fixed focus concentrators are successfully used for medium temperature applications in different parts of the world. These concentrators are taken as lateral sections of paraboloids and provide fixed focus away from the path of incident beam radiations throughout the year. The paper presents a complete description about the design principle and construction details of an 8 m{sup 2} surface area Scheffler concentrator. The first part of the paper presents the mathematical calculations to design the reflector parabola curve and reflector elliptical frame with respect to equinox (solar declination = 0) by selecting a specific lateral part of a paraboloid. Crossbar equations and their ellipses, arc lengths and their radii are also calculated to form the required lateral section of the paraboloid. Thereafter, the seasonal parabola equations are calculated for two extreme positions of summer and winter in the northern hemisphere (standing reflectors). The slopes of the parabola equations for equinox (solar declination = 0), summer (solar declination = +23.5) and winter (solar declination = -23.5) for the Scheffler reflector (8 m{sup 2} surface area) are calculated to be 0.17, 0.28, and 0.13 respectively. The y-intercepts of the parabola equations for equinox, summer and winter are calculated as 0, 0.54, and -0.53 respectively. By comparing with the equinox parabola curve, the summer parabola is found to be smaller in size and uses the top part of the parabola curve while the winter parabola is bigger in size and uses the lower part of the parabola curve to give the fixed focus. For this purpose, the reflector assembly is composed of flexible crossbars and a frame to induce the required change of the parabola curves with the changing solar declination. The paper also presents the calculation procedure of seasonal parabola equations for standing reflectors in the southern hemisphere as well as for laying reflectors in the northern and southern hemispheres. Highly

  14. Parallel Calculation of Sensitivity Derivatives for Aircraft Design using Automatic Differentiation

    NASA Technical Reports Server (NTRS)

    Bischof, c. H.; Green, L. L.; Haigler, K. J.; Knauff, T. L., Jr.

    1994-01-01

    Sensitivity derivative (SD) calculation via automatic differentiation (AD) typical of that required for the aerodynamic design of a transport-type aircraft is considered. Two ways of computing SD via code generated by the ADIFOR automatic differentiation tool are compared for efficiency and applicability to problems involving large numbers of design variables. A vector implementation on a Cray Y-MP computer is compared with a coarse-grained parallel implementation on an IBM SP1 computer, employing a Fortran M wrapper. The SD are computed for a swept transport wing in turbulent, transonic flow; the number of geometric design variables varies from 1 to 60 with coupling between a wing grid generation program and a state-of-the-art, 3-D computational fluid dynamics program, both augmented for derivative computation via AD. For a small number of design variables, the Cray Y-MP implementation is much faster. As the number of design variables grows, however, the IBM SP1 becomes an attractive alternative in terms of compute speed, job turnaround time, and total memory available for solutions with large numbers of design variables. The coarse-grained parallel implementation also can be moved easily to a network of workstations.

  15. The simulative calculation and optimum design for FOA, the purge gas sweeping system

    NASA Astrophysics Data System (ADS)

    Wang, Liquan; Jing, Yukun; Feng, Bing; Li, Fuquan; Xiang, Yong; Han, Wei; Wang, Fang

    2016-01-01

    This paper first studies the structure effect law in order to design a reasonable option in theory for the Final Optics Assembly(FOA)' harmonic converter module, involved in the design of the fluid theory, including the basic equations of fluid motion, the form of fluid motion and fluid movement in the small hole. Optimizing the structure need to be applied to the simulation software, which requires the Fluent simulation principle. Then, combined with theoretical knowledge to design the overall structure of the multiplier module, It will apply the simulation software to optimize structural parameters of the board and use control system to realize it for verifying the law obtained by simulation under various conditions whether consistent with the law in actual work of the sweeping system.

  16. Substantiation of parameters of the geometric model of the research reactor core for the calculation using the Monte Carlo method

    NASA Astrophysics Data System (ADS)

    Radaev, A. I.; Schurovskaya, M. V.

    2015-12-01

    The choice of the spatial nodalization for the calculation of the power density and burnup distribution in a research reactor core with fuel assemblies of the IRT-3M and VVR-KN type using the program based on the Monte Carlo code is described. The influence of the spatial nodalization on the results of calculating basic neutronic characteristics and calculation time is investigated.

  17. Substantiation of parameters of the geometric model of the research reactor core for the calculation using the Monte Carlo method

    SciTech Connect

    Radaev, A. I. Schurovskaya, M. V.

    2015-12-15

    The choice of the spatial nodalization for the calculation of the power density and burnup distribution in a research reactor core with fuel assemblies of the IRT-3M and VVR-KN type using the program based on the Monte Carlo code is described. The influence of the spatial nodalization on the results of calculating basic neutronic characteristics and calculation time is investigated.

  18. A design of a DICOM-RT-based tool box for nonrigid 4D dose calculation.

    PubMed

    Wong, Victy Y W; Baker, Colin R; Leung, T W; Tung, Stewart Y

    2016-03-08

    The study was aimed to introduce a design of a DICOM-RT-based tool box to facilitate 4D dose calculation based on deformable voxel-dose registration. The computational structure and the calculation algorithm of the tool box were explicitly discussed in the study. The tool box was written in MATLAB in conjunction with CERR. It consists of five main functions which allow a) importation of DICOM-RT-based 3D dose plan, b) deformable image registration, c) tracking voxel doses along breathing cycle, d) presentation of temporal dose distribution at different time phase, and e) derivation of 4D dose. The efficacy of using the tool box for clinical application had been verified with nine clinical cases on retrospective-study basis. The logistic and the robustness of the tool box were tested with 27 applications and the results were shown successful with no computational errors encountered. In the study, the accumulated dose coverage as a function of planning CT taken at end-inhale, end-exhale, and mean tumor position were assessed. The results indicated that the majority of the cases (67%) achieved maximum target coverage, while the planning CT was taken at the temporal mean tumor position and 56% at the end-exhale position. The comparable results to the literature imply that the studied tool box can be reliable for 4D dose calculation. The authors suggest that, with proper application, 4D dose calculation using deformable registration can provide better dose evaluation for treatment with moving target.

  19. Calibration of Discrete Element Heat Transfer Parameters by Central Composite Design

    NASA Astrophysics Data System (ADS)

    Deng, Zongquan; Cui, Jinsheng; Hou, Xuyan; Jiang, Shengyuan

    2017-03-01

    The efficiency and precision of parameter calibration in discrete element method (DEM) are not satisfactory, and parameter calibration for granular heat transfer is rarely involved. Accordingly, parameter calibration for granular heat transfer with the DEM is studied. The heat transfer in granular assemblies is simulated with DEM, and the effective thermal conductivity (ETC) of these granular assemblies is measured with the transient method in simulations. The measurement testbed is designed to test the ETC of the granular assemblies under normal pressure and a vacuum based on the steady method. Central composite design (CCD) is used to simulate the impact of the DEM parameters on the ETC of granular assemblies, and the heat transfer parameters are calibrated and compared with experimental data. The results show that, within the scope of the considered parameters, the ETC of the granular assemblies increases with an increasing particle thermal conductivity and decreases with an increasing particle shear modulus and particle diameter. The particle thermal conductivity has the greatest impact on the ETC of granular assemblies followed by the particle shear modulus and then the particle diameter. The calibration results show good agreement with the experimental results. The error is less than 4%, which is within a reasonable range for the scope of the CCD parameters. The proposed research provides high efficiency and high accuracy parameter calibration for granular heat transfer in DEM.

  20. Maximum Likelihood Estimation of the Broken Power Law Spectral Parameters with Detector Design Applications

    NASA Technical Reports Server (NTRS)

    Howell, Leonard W.; Whitaker, Ann F. (Technical Monitor)

    2001-01-01

    The maximum likelihood procedure is developed for estimating the three spectral parameters of an assumed broken power law energy spectrum from simulated detector responses and their statistical properties investigated. The estimation procedure is then generalized for application to real cosmic-ray data. To illustrate the procedure and its utility, analytical methods were developed in conjunction with a Monte Carlo simulation to explore the combination of the expected cosmic-ray environment with a generic space-based detector and its planned life cycle, allowing us to explore various detector features and their subsequent influence on estimating the spectral parameters. This study permits instrument developers to make important trade studies in design parameters as a function of the science objectives, which is particularly important for space-based detectors where physical parameters, such as dimension and weight, impose rigorous practical limits to the design envelope.

  1. First-order method of zoom lens design by means of generalized parameters.

    PubMed

    Khorokhorov, Alexei M; Piskunov, Dmitry E; Shirankov, Alexander F

    2016-08-01

    A method of paraxial zoom lens design is proposed that makes it possible to determine the optical powers and component movements of a zoom lens with the required zoom ratio. The method is based on the theory of generalized parameters, which can be used to analyze a zoom system by varying only one parameter. All possible zoom lenses with two movable components are considered for an object at infinity.

  2. A simple method of calculating Stirling engines for engine design optimization

    NASA Technical Reports Server (NTRS)

    Martini, W. R.

    1978-01-01

    A calculation method is presented for a rhombic drive Stirling engine with a tubular heater and cooler and a screen type regenerator. Generally the equations presented describe power generation and consumption and heat losses. It is the simplest type of analysis that takes into account the conflicting requirements inherent in Stirling engine design. The method itemizes the power and heat losses for intelligent engine optimization. The results of engine analysis of the GPU-3 Stirling engine are compared with more complicated engine analysis and with engine measurements.

  3. Optimal Input Design for Aircraft Parameter Estimation using Dynamic Programming Principles

    NASA Technical Reports Server (NTRS)

    Morelli, Eugene A.; Klein, Vladislav

    1990-01-01

    A new technique was developed for designing optimal flight test inputs for aircraft parameter estimation experiments. The principles of dynamic programming were used for the design in the time domain. This approach made it possible to include realistic practical constraints on the input and output variables. A description of the new approach is presented, followed by an example for a multiple input linear model describing the lateral dynamics of a fighter aircraft. The optimal input designs produced by the new technique demonstrated improved quality and expanded capability relative to the conventional multiple input design method.

  4. Optimal input design for aircraft parameter estimation using dynamic programming principles

    NASA Technical Reports Server (NTRS)

    Klein, Vladislav; Morelli, Eugene A.

    1990-01-01

    A new technique was developed for designing optimal flight test inputs for aircraft parameter estimation experiments. The principles of dynamic programming were used for the design in the time domain. This approach made it possible to include realistic practical constraints on the input and output variables. A description of the new approach is presented, followed by an example for a multiple input linear model describing the lateral dynamics of a fighter aircraft. The optimal input designs produced by the new technique demonstrated improved quality and expanded capability relative to the conventional multiple input design method.

  5. Final Report for "Design calculations for high-space-charge beam-to-RF conversion".

    SciTech Connect

    David N Smithe

    2008-10-17

    Accelerator facility upgrades, new accelerator applications, and future design efforts are leading to novel klystron and IOT device concepts, including multiple beam, high-order mode operation, and new geometry configurations of old concepts. At the same time, a new simulation capability, based upon finite-difference “cut-cell” boundaries, has emerged and is transforming the existing modeling and design capability with unparalleled realism, greater flexibility, and improved accuracy. This same new technology can also be brought to bear on a difficult-to-study aspect of the energy recovery linac (ERL), namely the accurate modeling of the exit beam, and design of the beam dump for optimum energy efficiency. We have developed new capability for design calculations and modeling of a broad class of devices which convert bunched beam kinetic energy to RF energy, including RF sources, as for example, klystrons, gyro-klystrons, IOT's, TWT’s, and other devices in which space-charge effects are important. Recent advances in geometry representation now permits very accurate representation of the curved metallic surfaces common to RF sources, resulting in unprecedented simulation accuracy. In the Phase I work, we evaluated and demonstrated the capabilities of the new geometry representation technology as applied to modeling and design of output cavity components of klystron, IOT's, and energy recovery srf cavities. We identified and prioritized which aspects of the design study process to pursue and improve in Phase II. The development and use of the new accurate geometry modeling technology on RF sources for DOE accelerators will help spark a new generational modeling and design capability, free from many of the constraints and inaccuracy associated with the previous generation of “stair-step” geometry modeling tools. This new capability is ultimately expected to impact all fields with high power RF sources, including DOE fusion research, communications, radar and

  6. Multiobjective sampling design for parameter estimation and model discrimination in groundwater solute transport

    USGS Publications Warehouse

    Knopman, D.S.; Voss, C.I.

    1989-01-01

    Optimal design of a sampling network is a sequential process in which the next phase of sampling is designed on the basis of all available physical knowledge of the system. Three objectives are considered: model discrimination, parameter estimation, and cost minimization. For the first two objectives, physically based measures of the value of information obtained from a set of observations are specified. In model discrimination, value of information of an observation point is measured in terms of the difference in solute concentration predicted by hypothesized models of transport. Points of greatest difference in predictions can contribute the most information to the discriminatory power of a sampling design. Sensitivity of solute concentration to a change in a parameter contributes information on the relative variance of a parameter estimate. Inclusion of points in a sampling design with high sensitivities to parameters tends to reduce variance in parameter estimates. Cost minimization accounts for both the capital cost of well installation and the operating costs of collection and analysis of field samples. -from Authors

  7. Maximum Likelihood Estimation of the Broken Power Law Spectral Parameters with Detector Design Applications

    NASA Technical Reports Server (NTRS)

    Howell, Leonard W.

    2002-01-01

    The method of Maximum Likelihood (ML) is used to estimate the spectral parameters of an assumed broken power law energy spectrum from simulated detector responses. This methodology, which requires the complete specificity of all cosmic-ray detector design parameters, is shown to provide approximately unbiased, minimum variance, and normally distributed spectra information for events detected by an instrument having a wide range of commonly used detector response functions. The ML procedure, coupled with the simulated performance of a proposed space-based detector and its planned life cycle, has proved to be of significant value in the design phase of a new science instrument. The procedure helped make important trade studies in design parameters as a function of the science objectives, which is particularly important for space-based detectors where physical parameters, such as dimension and weight, impose rigorous practical limits to the design envelope. This ML methodology is then generalized to estimate broken power law spectral parameters from real cosmic-ray data sets.

  8. Effects of toothless stator design on dynamic model parameters of permanent magnet generators

    SciTech Connect

    Arkadan, A.A.; Vyas, R. . Electrical and Computer Engineering Dept.)

    1993-06-01

    The effects of toothless stator design on the dynamic model parameters of permanent magnet (PM) generators are presented. These parameters which include inductances and induced back emfs are determines for a 75 kVA, 208 V, 400 Hz, two-pole, permanent magnet generator. Two particular stator designs, a toothless stator and a conventional type stator (with iron teeth), are considered. The method which is used to determine these parameters is general in nature and is based on the use of a series of magnetic field solutions. A validation of the computed emf and inductance values based on experimentally obtained data is given in the paper. The results of using these parameters in a state space model in the abc frame of reference to study the effects of a toothless stator design on the PM generator synchronous inductances are presented. Based on that, it is demonstrated that the effects of rotor saliency and armature loading on the machine parameters are minimized in the case of the toothless design.

  9. Development of bright fluorescent quadracyclic adenine analogues: TDDFT-calculation supported rational design

    PubMed Central

    Foller Larsen, Anders; Dumat, Blaise; Wranne, Moa S.; Lawson, Christopher P.; Preus, Søren; Bood, Mattias; Gradén, Henrik; Marcus Wilhelmsson, L.; Grøtli, Morten

    2015-01-01

    Fluorescent base analogues (FBAs) comprise a family of increasingly important molecules for the investigation of nucleic acid structure and dynamics. We recently reported the quantum chemical calculation supported development of four microenvironment sensitive analogues of the quadracyclic adenine (qA) scaffold, the qANs, with highly promising absorptive and fluorescence properties that were very well predicted by TDDFT calculations. Herein, we report on the efficient synthesis, experimental and theoretical characterization of nine novel quadracyclic adenine derivatives. The brightest derivative, 2-CNqA, displays a 13-fold increased brightness (εΦF = 4500) compared with the parent compound qA and has the additional benefit of being a virtually microenvironment-insensitive fluorophore, making it a suitable candidate for nucleic acid incorporation and use in quantitative FRET and anisotropy experiments. TDDFT calculations, conducted on the nine novel qAs a posteriori, successfully describe the relative fluorescence quantum yield and brightness of all qA derivatives. This observation suggests that the TDDFT-based rational design strategy may be employed for the development of bright fluorophores built up from a common scaffold to reduce the otherwise costly and time-consuming screening process usually required to obtain useful and bright FBAs. PMID:26227585

  10. Development of bright fluorescent quadracyclic adenine analogues: TDDFT-calculation supported rational design.

    PubMed

    Foller Larsen, Anders; Dumat, Blaise; Wranne, Moa S; Lawson, Christopher P; Preus, Søren; Bood, Mattias; Gradén, Henrik; Wilhelmsson, L Marcus; Grøtli, Morten

    2015-07-31

    Fluorescent base analogues (FBAs) comprise a family of increasingly important molecules for the investigation of nucleic acid structure and dynamics. We recently reported the quantum chemical calculation supported development of four microenvironment sensitive analogues of the quadracyclic adenine (qA) scaffold, the qANs, with highly promising absorptive and fluorescence properties that were very well predicted by TDDFT calculations. Herein, we report on the efficient synthesis, experimental and theoretical characterization of nine novel quadracyclic adenine derivatives. The brightest derivative, 2-CNqA, displays a 13-fold increased brightness (εΦF = 4500) compared with the parent compound qA and has the additional benefit of being a virtually microenvironment-insensitive fluorophore, making it a suitable candidate for nucleic acid incorporation and use in quantitative FRET and anisotropy experiments. TDDFT calculations, conducted on the nine novel qAs a posteriori, successfully describe the relative fluorescence quantum yield and brightness of all qA derivatives. This observation suggests that the TDDFT-based rational design strategy may be employed for the development of bright fluorophores built up from a common scaffold to reduce the otherwise costly and time-consuming screening process usually required to obtain useful and bright FBAs.

  11. Growth parameters of Penicillium expansum calculated from mixed inocula as an alternative to account for intraspecies variability.

    PubMed

    Garcia, Daiana; Ramos, Antonio J; Sanchis, Vicente; Marín, Sonia

    2014-09-01

    The aim of this work was to compare the radial growth rate (μ) and the lag time (λ) for growth of 25 isolates of Penicillium expansum at 1 and 20 ºC with those of the mixed inoculum of the 25 isolates. Moreover, the evolution of probability of growth through time was also compared for the single strains and mixed inoculum. Working with a mixed inoculum would require less work, time and consumables than if a range of single strains has to be used in order to represent a given species. Suitable predictive models developed for a given species should represent as much as possible the behavior of all strains belonging to this species. The results suggested, on one hand, that the predictions based on growth parameters calculated on the basis of mixed inocula may not accurately predict the behavior of all possible strains but may represent a percentage of them, and the median/mean values of μ and λ obtained by the 25 strains may be substituted by the value obtained with the mixed inoculum. Moreover, the predictions may be biased, in particular, the predictions of λ which may be underestimated (fail-safe). Moreover, the prediction of time for a given probability of growth through a mixed inoculum may not be accurate for all single inocula, but it may represent 92% and 60% of them at 20 and 1 ºC, respectively, and also their overall mean and median values. In conclusion, mixed inoculum could be a good alternative to estimate the mean or median values of high number of isolates, but not to account for those strains with marginal behavior. In particular, estimation of radial growth rate, and time for 0.10 and 0.50 probability of growth using a cocktail inoculum accounted for the estimates of most single isolates tested. For the particular case of probability models, this is an interesting result as for practical applications in the food industry the estimation of t10 or lower probability may be required.

  12. Accelerated materials design of fast oxygen ionic conductors based on first principles calculations

    NASA Astrophysics Data System (ADS)

    He, Xingfeng; Mo, Yifei

    Over the past decades, significant research efforts have been dedicated to seeking fast oxygen ion conductor materials, which have important technological applications in electrochemical devices such as solid oxide fuel cells, oxygen separation membranes, and sensors. Recently, Na0.5Bi0.5TiO3 (NBT) was reported as a new family of fast oxygen ionic conductor. We will present our first principles computation study aims to understand the O diffusion mechanisms in the NBT material and to design this material with enhanced oxygen ionic conductivity. Using the NBT materials as an example, we demonstrate the computation capability to evaluate the phase stability, chemical stability, and ionic diffusion of the ionic conductor materials. We reveal the effects of local atomistic configurations and dopants on oxygen diffusion and identify the intrinsic limiting factors in increasing the ionic conductivity of the NBT materials. Novel doping strategies were predicted and demonstrated by the first principles calculations. In particular, the K doped NBT compound achieved good phase stability and an order of magnitude increase in oxygen ionic conductivity of up to 0.1 S cm-1 at 900 K compared to the experimental Mg doped compositions. Our results provide new avenues for the future design of the NBT materials and demonstrate the accelerated design of new ionic conductor materials based on first principles techniques. This computation methodology and workflow can be applied to the materials design of any (e.g. Li +, Na +) fast ion-conducting materials.

  13. Calculation of rotor impedance for use in design analysis of helicopter airframe vibrations

    NASA Technical Reports Server (NTRS)

    Nygren, Kip P.

    1990-01-01

    Excessive vibration is one of the most prevalent technical obstacles encountered in the development of new rotorcraft. The inability to predict these vibrations is primarily due to deficiencies in analysis and simulation tools. The Langley Rotorcraft Structural Dynamics Program was instituted in 1984 to meet long term industry needs in the area of rotorcraft vibration prediction. As a part of the Langley program, this research endeavors to develop an efficient means of coupling the rotor to the airframe for preliminary design analysis of helicopter airframe vibrations. The main effort was to modify the existing computer program for modeling the dynamic and aerodynamic behavior of rotorcraft called DYSCO (DYnamic System COupler) to calculate the rotor impedance. DYSCO was recently developed for the U.S. Army and has proven to be adaptable for the inclusion of new solution methods. The solution procedure developed to use DYSCO for the calculation of rotor impedance is presented. Verification of the procedure by comparison with a known solution for a simple wind turbine model is about 75 percent completed, and initial results are encouraging. After the wind turbine impedance is confirmed, the verification effort will continue by comparison to solutions of a more sophisticated rotorcraft model. Future work includes determination of the sensitivity of the rotorcraft airframe vibrations to helicopter flight conditions and rotor modeling assumptions. When completed, this research will ascertain the feasibility and efficiency of the impedance matching method of rotor-airframe coupling for use in the analysis of airframe vibrations during the preliminary rotorcraft design process.

  14. Technology Solutions Case Study: Calculating Design Heating Loads for Superinsulated Buildings

    SciTech Connect

    2015-08-01

    Designing a superinsulated home has many benefits including improved comfort, reduced exterior noise penetration, lower energy bills, and the ability to withstand power and fuel outages under much more comfortable conditions than a typical home. Extremely low heating and cooling loads equate to much smaller HVAC equipment than conventionally required. Sizing the mechanical system to these much lower loads reduces first costs and the size of the distribution system needed. While these homes aren't necessarily constructed with excessive mass in the form of concrete floors and walls, the amount of insulation and the increase in the thickness of the building envelope can lead to a mass effect, resulting in the structures ability to store much more heat than a code built home. This results in a very low thermal inertia making the building much less sensitive to drastic temperature swings thereby decreasing the peak heating load demand. Alternative methods that take this inertia into account along with solar and internal gains result in smaller more appropriate design loads than those calculated using Manual J version 8. During the winter of 2013/2014, the Consortium for Advanced Residential Buildings team monitored the energy use of three homes in climate zone 6 in an attempt to evaluate the accuracy of two different mechanical system sizing methods for low load homes. Based on the results, it is recommended that internal and solar gains be included and some credit for thermal inertia be used in sizing calculations for superinsulated homes.

  15. Aromaticity Parameters in Asphalt Binders Calculated From Profile Fitting X-ray Line Spectra Using Pearson VII and Pseudo-Voigt Functions

    NASA Astrophysics Data System (ADS)

    Shirokoff, J.; Lewis, J. Courtenay

    2010-10-01

    The aromaticity and crystallite parameters in asphalt binders are calculated from data obtained after profile fitting x-ray line spectra using Pearson VII and pseudo-Voigt functions. The results are presented and discussed in terms of the peak profile fit parameters used, peak deconvolution procedure, and differences in calculated values that can arise owing to peak shape and additional peaks present in the pattern. These results have implications concerning the evaluation and performance of asphalt binders used in highways and road applications.

  16. The impact of registration accuracy on imaging validation study design: A novel statistical power calculation.

    PubMed

    Gibson, Eli; Fenster, Aaron; Ward, Aaron D

    2013-10-01

    Novel imaging modalities are pushing the boundaries of what is possible in medical imaging, but their signal properties are not always well understood. The evaluation of these novel imaging modalities is critical to achieving their research and clinical potential. Image registration of novel modalities to accepted reference standard modalities is an important part of characterizing the modalities and elucidating the effect of underlying focal disease on the imaging signal. The strengths of the conclusions drawn from these analyses are limited by statistical power. Based on the observation that in this context, statistical power depends in part on uncertainty arising from registration error, we derive a power calculation formula relating registration error, number of subjects, and the minimum detectable difference between normal and pathologic regions on imaging, for an imaging validation study design that accommodates signal correlations within image regions. Monte Carlo simulations were used to evaluate the derived models and test the strength of their assumptions, showing that the model yielded predictions of the power, the number of subjects, and the minimum detectable difference of simulated experiments accurate to within a maximum error of 1% when the assumptions of the derivation were met, and characterizing sensitivities of the model to violations of the assumptions. The use of these formulae is illustrated through a calculation of the number of subjects required for a case study, modeled closely after a prostate cancer imaging validation study currently taking place at our institution. The power calculation formulae address three central questions in the design of imaging validation studies: (1) What is the maximum acceptable registration error? (2) How many subjects are needed? (3) What is the minimum detectable difference between normal and pathologic image regions?

  17. A design of a DICOM-RT-based tool box for nonrigid 4D dose calculation.

    PubMed

    Wong, Victy Y W; Baker, Colin R; Leung, T W; Tung, Stewart Y

    2016-03-01

    The study was aimed to introduce a design of a DICOM-RT-based tool box to facilitate 4D dose calculation based on deformable voxel-dose registration. The computational structure and the calculation algorithm of the tool box were explicitly discussed in the study. The tool box was written in MATLAB in conjunction with CERR. It consists of five main functions which allow a) importation of DICOM-RT-based 3D dose plan, b) deformable image registration, c) tracking voxel doses along breathing cycle, d) presentation of temporal dose distribution at different time phase, and e) derivation of 4D dose. The efficacy of using the tool box for clinical application had been verified with nine clinical cases on retrospective-study basis. The logistic and the robustness of the tool box were tested with 27 applications and the results were shown successful with no computational errors encountered. In the study, the accumulated dose coverage as a function of planning CT taken at end-inhale, end-exhale, and mean tumor position were assessed. The results indicated that the majority of the cases (67%) achieved maximum target coverage, while the planning CT was taken at the temporal mean tumor position and 56% at the end-exhale position. The comparable results to the literature imply that the studied tool box can be reliable for 4D dose calculation. The authors suggest that, with proper application, 4D dose calculation using deformable registration can provide better dose evaluation for treatment with moving target. PACS number(s): 87.55.kh.

  18. Application of the MCNPX-McStas interface for shielding calculations and guide design at ESS

    NASA Astrophysics Data System (ADS)

    Klinkby, E. B.; Knudsen, E. B.; Willendrup, P. K.; Lauritzen, B.; Nonbøl, E.; Bentley, P.; Filges, U.

    2014-07-01

    Recently, an interface between the Monte Carlo code MCNPX and the neutron ray-tracing code MCNPX was developed [1, 2]. Based on the expected neutronic performance and guide geometries relevant for the ESS, the combined MCNPX-McStas code is used to calculate dose rates along neutron beam guides. The generation and moderation of neutrons is simulated using a full scale MCNPX model of the ESS target monolith. Upon entering the neutron beam extraction region, the individual neutron states are handed to McStas via the MCNPX-McStas interface. McStas transports the neutrons through the beam guide, and by using newly developed event logging capability, the neutron state parameters corresponding to un-reflected neutrons are recorded at each scattering. This information is handed back to MCNPX where it serves as neutron source input for a second MCNPX simulation. This simulation enables calculation of dose rates in the vicinity of the guide. In addition the logging mechanism is employed to record the scatterings along the guides which is exploited to simulate the supermirror quality requirements (i.e. m-values) needed at different positions along the beam guide to transport neutrons in the same guide/source setup.

  19. The Limitations of Model-Based Experimental Design and Parameter Estimation in Sloppy Systems

    PubMed Central

    Tolman, Malachi; Thames, Howard D.; Mason, Kathy A.

    2016-01-01

    We explore the relationship among experimental design, parameter estimation, and systematic error in sloppy models. We show that the approximate nature of mathematical models poses challenges for experimental design in sloppy models. In many models of complex biological processes it is unknown what are the relevant physical mechanisms that must be included to explain system behaviors. As a consequence, models are often overly complex, with many practically unidentifiable parameters. Furthermore, which mechanisms are relevant/irrelevant vary among experiments. By selecting complementary experiments, experimental design may inadvertently make details that were ommitted from the model become relevant. When this occurs, the model will have a large systematic error and fail to give a good fit to the data. We use a simple hyper-model of model error to quantify a model’s discrepancy and apply it to two models of complex biological processes (EGFR signaling and DNA repair) with optimally selected experiments. We find that although parameters may be accurately estimated, the discrepancy in the model renders it less predictive than it was in the sloppy regime where systematic error is small. We introduce the concept of a sloppy system–a sequence of models of increasing complexity that become sloppy in the limit of microscopic accuracy. We explore the limits of accurate parameter estimation in sloppy systems and argue that identifying underlying mechanisms controlling system behavior is better approached by considering a hierarchy of models of varying detail rather than focusing on parameter estimation in a single model. PMID:27923060

  20. Software design to calculate and simulate the mechanical response of electromechanical lifts

    NASA Astrophysics Data System (ADS)

    Herrera, I.; Romero, E.

    2016-05-01

    Lift engineers and lift companies which are involved in the design process of new products or in the research and development of improved components demand a predictive tool of the lift slender system response before testing expensive prototypes. A method for solving the movement of any specified lift system by means of a computer program is presented. The mechanical response of the lift operating in a user defined installation and configuration, for a given excitation and other configuration parameters of real electric motors and its control system, is derived. A mechanical model with 6 degrees of freedom is used. The governing equations are integrated step by step through the Meden-Kutta algorithm in the MATLAB platform. Input data consists on the set point speed for a standard trip and the control parameters of a number of controllers and lift drive machines. The computer program computes and plots very accurately the vertical displacement, velocity, instantaneous acceleration and jerk time histories of the car, counterweight, frame, passengers/loads and lift drive in a standard trip between any two floors of the desired installation. The resulting torque, rope tension and deviation of the velocity plot with respect to the setpoint speed are shown. The software design is implemented in a demo release of the computer program called ElevaCAD. Further on, the program offers the possibility to select the configuration of the lift system and the performance parameters of each component. In addition to the overall system response, detailed information of transients, vibrations of the lift components, ride quality levels, modal analysis and frequency spectrum (FFT) are plotted.

  1. 10 CFR 60.141 - Confirmation of geotechnical and design parameters.

    Code of Federal Regulations, 2011 CFR

    2011-01-01

    ... 10 Energy 2 2011-01-01 2011-01-01 false Confirmation of geotechnical and design parameters. 60.141 Section 60.141 Energy NUCLEAR REGULATORY COMMISSION (CONTINUED) DISPOSAL OF HIGH-LEVEL RADIOACTIVE WASTES IN GEOLOGIC REPOSITORIES Performance Confirmation Program § 60.141 Confirmation of geotechnical...

  2. 10 CFR 63.132 - Confirmation of geotechnical and design parameters.

    Code of Federal Regulations, 2010 CFR

    2010-01-01

    ... 10 Energy 2 2010-01-01 2010-01-01 false Confirmation of geotechnical and design parameters. 63.132 Section 63.132 Energy NUCLEAR REGULATORY COMMISSION (CONTINUED) DISPOSAL OF HIGH-LEVEL RADIOACTIVE WASTES IN A GEOLOGIC REPOSITORY AT YUCCA MOUNTAIN, NEVADA Performance Confirmation Program §...

  3. 10 CFR 63.132 - Confirmation of geotechnical and design parameters.

    Code of Federal Regulations, 2011 CFR

    2011-01-01

    ... 10 Energy 2 2011-01-01 2011-01-01 false Confirmation of geotechnical and design parameters. 63.132 Section 63.132 Energy NUCLEAR REGULATORY COMMISSION (CONTINUED) DISPOSAL OF HIGH-LEVEL RADIOACTIVE WASTES IN A GEOLOGIC REPOSITORY AT YUCCA MOUNTAIN, NEVADA Performance Confirmation Program §...

  4. 10 CFR 63.132 - Confirmation of geotechnical and design parameters.

    Code of Federal Regulations, 2014 CFR

    2014-01-01

    ... 10 Energy 2 2014-01-01 2014-01-01 false Confirmation of geotechnical and design parameters. 63.132 Section 63.132 Energy NUCLEAR REGULATORY COMMISSION (CONTINUED) DISPOSAL OF HIGH-LEVEL RADIOACTIVE WASTES IN A GEOLOGIC REPOSITORY AT YUCCA MOUNTAIN, NEVADA Performance Confirmation Program §...

  5. 10 CFR 63.132 - Confirmation of geotechnical and design parameters.

    Code of Federal Regulations, 2013 CFR

    2013-01-01

    ... 10 Energy 2 2013-01-01 2013-01-01 false Confirmation of geotechnical and design parameters. 63.132 Section 63.132 Energy NUCLEAR REGULATORY COMMISSION (CONTINUED) DISPOSAL OF HIGH-LEVEL RADIOACTIVE WASTES IN A GEOLOGIC REPOSITORY AT YUCCA MOUNTAIN, NEVADA Performance Confirmation Program §...

  6. 10 CFR 63.132 - Confirmation of geotechnical and design parameters.

    Code of Federal Regulations, 2012 CFR

    2012-01-01

    ... 10 Energy 2 2012-01-01 2012-01-01 false Confirmation of geotechnical and design parameters. 63.132 Section 63.132 Energy NUCLEAR REGULATORY COMMISSION (CONTINUED) DISPOSAL OF HIGH-LEVEL RADIOACTIVE WASTES IN A GEOLOGIC REPOSITORY AT YUCCA MOUNTAIN, NEVADA Performance Confirmation Program §...

  7. Optimal experiment design: Link between the concentration and the accuracy of estimation of aggregation parameters

    NASA Astrophysics Data System (ADS)

    Evstigneev, Vladislav P.; Pashkova, Irina S.; Kostjukov, Viktor V.; Hernandez Santiago, Adrian A.; Evstigneev, Maxim P.

    2016-11-01

    The principal condition for optimal experiment design, required for getting reasonable error for equilibrium aggregation constant, K, determination is obtained. This condition states that the selected concentration range for performing titration experiment should be inversely proportional to the expected value of K. As a consequence, the choice of physico-chemical methods for determination of aggregation parameters must obey this condition.

  8. Design Parameters of Paraboloid-Hyperboloid Telescopes for X-ray Astronomy.

    PubMed

    Vanspeybroeck, L P; Chase, R C

    1972-02-01

    We have evaluated the principal optical characteristics of paraboloid-hyperboloid x-ray telescopes by a ray-tracing procedure; we find that our results for resolution, focal plane curvature, and finite source distance effects may be approximated in terms of the design parameters by simple empirical formulas.

  9. Technically Extended MultiParameter Optimization (TEMPO): An Advanced Robust Scoring Scheme To Calculate Central Nervous System Druggability and Monitor Lead Optimization.

    PubMed

    Ghose, Arup K; Ott, Gregory R; Hudkins, Robert L

    2017-01-18

    At the discovery stage, it is important to understand the drug design concepts for a CNS drug compared to those for a non-CNS drug. Previously, we published on ideal CNS drug property space and defined in detail the physicochemical property distribution of CNS versus non-CNS oral drugs, the application of radar charting (a graphical representation of multiple physicochemical properties used during CNS lead optimization), and a recursive partition classification tree to differentiate between CNS- and non-CNS drugs. The objective of the present study was to further understand the differentiation of physicochemical properties between CNS and non-CNS oral drugs by the development and application of a new CNS scoring scheme: Technically Extended MultiParameter Optimization (TEMPO). In this multiparameter method, we identified eight key physicochemical properties critical for accurately assessing CNS druggability: (1) number of basic amines, (2) carbon-heteroatom (non-carbon, non-hydrogen) ratio, (3) number of aromatic rings, (4) number of chains, (5) number of rotatable bonds, (6) number of H-acceptors, (7) computed octanol/water partition coefficient (AlogP), and (8) number of nonconjugated C atoms in nonaromatic rings. Significant features of the CNS-TEMPO penalty score are the extension of the multiparameter approach to generate an accurate weight factor for each physicochemical property, the use of limits on both sides of the computed property space range during the penalty calculation, and the classification of CNS and non-CNS drug scores. CNS-TEMPO significantly outperformed CNS-MPO and the Schrödinger QikProp CNS parameter (QP_CNS) in evaluating CNS drugs and has been extensively applied in support of CNS lead optimization programs.

  10. Improvement of the technique of calculating the energy-force parameters of pinch-pass mills for increasing the efficiency of producing cold-rolled strips

    NASA Astrophysics Data System (ADS)

    Garber, E. A.; Timofeeva, M. A.

    2016-11-01

    New propositions are introduced into the technique of energy-force calculation of pinch-pass mills in order to determine the energy-force and technological parameters of skin rolling of cold-rolled steel strips at the minimum errors. The application of these propositions decreases the errors of calculating the forces and torques in a working stand by a factor of 3-5 as compared to the calculation according to the well-known technique, saves the electric power in the existing mills, and demonstrates the possibility of decreasing the dimensions of working stands and the power of the rolling mill engine.

  11. Development and validation of a computer program to design and calculate ROPS.

    PubMed

    Mangado, J; Arana, I; Jarén, C; Arnal, P; Arazuri, S; Ponce de León, J L

    2007-01-01

    In Spain, there are more than 250,000 tractors built before 1980, when it became mandatory for all new tractors to be equipped with a rollover protective structure (ROPS). A similar situation is found in the European Union, but the situation is worse in the U.S. and in developing countries. Directive 2003/37/EEC establishes that tractors over 800 kg weight can be homologated by using the OECD standard code for the official testing of protective structures on agricultural and forestry tractors (static test), called Code 4. A ROPS attachable to the rear axle of different tractor models has been designed, and a computer program for the calculation of the ROPS design has been developed. The program, named ESTREMA, is available at: www.cfnavarra.es/insl. Using this program, it has been possible to design a ROPS for the Massey Ferguson model 178 tractor, one of the most common tractor models without a ROPS in Spain. After the tractor was equipped with the designed ROPS, it was tested at the Spanish Authorized Station for testing ROPS and passed the homologation test (OECD Code 4), the main results being a maximum distortion of 21.3 cm when the absorbed energy was 5437 N and the maximum force applied was 34 kN during loading from the side. The ROPS was improved, redesigned, and remounted on the tractor, the tractor was tested in a real overturn, and no part of the structure intruded on the driver's clearance zone during the test. In conclusion, the ESTREMA program worked correctly, and the designed ROPS was able to pass the authorized test and provide adequate protection to the operator during a real overturn.

  12. How to design a good photoresist solvent package using solubility parameters and high-throughput research

    NASA Astrophysics Data System (ADS)

    Tate, Michael P.; Cutler, Charlotte; Sakillaris, Mike; Kaufman, Michael; Estelle, Thomas; Mohler, Carol; Tucker, Chris; Thackeray, Jim

    2014-03-01

    Understanding fundamental properties of photoresists and how interactions between photoresist components affect performance targets are crucial to the continued success of photoresists. More specifically, polymer solubility is critical to the overall performance capability of the photoresist formulation. While several theories describe polymer solvent solubility, the most common industrially applied method is Hansen's solubility parameters. Hansen's method, based on regular solution theory, describes a solute's ability to dissolve in a solvent or solvent blend using four physical properties determined experimentally through regression of solubility data in many known solvents. The four physical parameters are dispersion, polarity, hydrogen bonding, and radius of interaction. Using these parameters a relative cohesive energy difference (RED), which describes a polymer's likelihood to dissolve in a given solvent blend, may be calculated. Leveraging a high throughput workflow to prepare and analyze the thousands of samples necessary to calculate the Hansen's solubility parameters from many different methacrylate-based polymers, we compare the physical descriptors to reveal a large range of polarities and hydrogen bonding. Further, we find that Hansen's model correctly predicts the soluble/insoluble state of 3-component solvent blends where the dispersion, polar, hydrogen-bonding, and radius of interaction values were determined through regression of experimental values. These modeling capabilities have allowed for optimization of the photoresist solubility from initial blending through application providing valuable insights into the nature of photoresist.

  13. User's manual for an aerodynamic optimization scheeme that updates flow variables and design parameters simultaneously

    NASA Technical Reports Server (NTRS)

    Rizk, Magdi H.

    1988-01-01

    This user's manual is presented for an aerodynamic optimization program that updates flow variables and design parameters simultaneously. The program was developed for solving constrained optimization problems in which the objective function and the constraint function are dependent on the solution of the nonlinear flow equations. The program was tested by applying it to the problem of optimizing propeller designs. Some reference to this particular application is therefore made in the manual. However, the optimization scheme is suitable for application to general aerodynamic design problems. A description of the approach used in the optimization scheme is first presented, followed by a description of the use of the program.

  14. On the Incorrect Statistical Calculations of the Kinetica Software Package in Imbalanced Designs.

    PubMed

    Morales-Alcelay, S; de la Torre de Alvarado, J M; García-Arieta, A

    2015-07-01

    This regulatory note supports the previous findings that suggest that the software package Kinetica, up to version 5.0.10, provides incorrect results for the 90% confidence intervals for the ratio test/reference where the groups are imbalanced in 2 × 2 crossover designs and parallel designs. The incorrect calculation results from using the simplified formula that is shown as an example in the Canadian guideline for a balanced dataset, but which provides an erroneous point estimate and confidence interval width in cases of imbalanced designs. Importantly, this software is rarely used for regulatory submissions in the European Union according to the search conducted in the Spanish Agency for Medicines and Health Care Products. According to our data, the error is minor if the imbalance between groups is small. However, the error may be relevant if the sample size is small and the imbalance is large. Therefore, bioequivalence studies should be reanalyzed by regulatory agencies to confirm the submitted results.

  15. Intelligent, Robust Control of Deteriorated Turbofan Engines via Linear Parameter Varying Quadratic Lyapunov Function Design

    NASA Technical Reports Server (NTRS)

    Turso, James A.; Litt, Jonathan S.

    2004-01-01

    A method for accommodating engine deterioration via a scheduled Linear Parameter Varying Quadratic Lyapunov Function (LPVQLF)-Based controller is presented. The LPVQLF design methodology provides a means for developing unconditionally stable, robust control of Linear Parameter Varying (LPV) systems. The controller is scheduled on the Engine Deterioration Index, a function of estimated parameters that relate to engine health, and is computed using a multilayer feedforward neural network. Acceptable thrust response and tight control of exhaust gas temperature (EGT) is accomplished by adjusting the performance weights on these parameters for different levels of engine degradation. Nonlinear simulations demonstrate that the controller achieves specified performance objectives while being robust to engine deterioration as well as engine-to-engine variations.

  16. Design of a multi beam klystron cavity from its single beam parameters

    NASA Astrophysics Data System (ADS)

    Kant, Deepender; Joshi, L. M.; Janyani, Vijay

    2016-03-01

    The klystron is a well-known microwave amplifier which uses kinetic energy of an electron beam for amplification of the RF signal. There are some limitations of conventional single beam klystron such as high operating voltage, low efficiency and bulky size at higher power levels, which are very effectively handled in Multi Beam Klystron (MBK) that uses multiple low purveyance electron beams for RF interaction. Each beam propagates along its individual transit path through a resonant cavity structure. Multi-Beam klystron cavity design is a critical task due to asymmetric cavity structure and can be simulated by 3D code only. The present paper shall discuss the design of multi beam RF cavities for klystrons operating at 2856 MHz (S-band) and 5 GHz (C-band) respectively. The design approach uses some scaling laws for finding the electron beam parameters of the multi beam device from their single beam counter parts. The scaled beam parameters are then used for finding the design parameters of the multi beam cavities. Design of the desired multi beam cavity can be optimized through iterative simulations in CST Microwave Studio.

  17. Influence of design parameters of discharge passage on the performance of shaft tubular pumping system

    NASA Astrophysics Data System (ADS)

    Zhu, H. G.; Zhang, R. T.; Xia, J.; Zhou, H. B.; Tang, X. C.

    2013-12-01

    Shaft tubular pumping systems with straight discharge passage are more widely adopted because they possesses many advantages such as easier installation of pump sets, better ventilation for motor and transmission devices, open access to inspect pump sets and lower cost for maintenance. The design parameters of a straight discharge passage will directly affect hydraulic loss and energy performance of the shaft pumping system. The optimal hydraulic design of discharge passages is carried out under the guideline of Pump Station Design Code to satisfy optimal design objectives. Computational fluid dynamics is applied to simulate the internal flow of a shaft pumping system the influence of its design parameter on the system performance is investigated. Keeping the shaft and suction box unchanged, six discharge passage design schemes with different length and outlet width are compared based on CFD to analyze the internal flow fields and their energy performances are predicted. The computed results indicate that when the outlet width of discharge passage is fixed, the longer the discharge passage, the better the internal flow fields with smaller backflow and vortex zone inside the passage. When the length of discharge passage is determined, the axial velocity distribution uniformity and bias angle in the outlet section will vary with the value of the outlet width. Optimal hydraulic design of discharge passages can achieve better internal flow and higher pumping efficiency.

  18. CONTROL OF LASER RADIATION PARAMETERS: Method for calculating a negative-dispersion resonator-type multilayer mirror

    NASA Astrophysics Data System (ADS)

    Kholokhonova, Polina A.; Erg, G. V.

    2005-11-01

    A method is proposed for the calculation of negative-dispersion mirrors with resonator cavities. The mirror optimisation algorithm combines the capabilities of the gradient method and the random search method. A multilayer mirror structure with a reflectivity R>99.9% and a group delay dispersion of -60±10 fs2 in the 930-1070 nm wavelength range was calculated. The sensitivity of the obtained structure to random variations of layer thicknesses was analysed.

  19. Calculation of the transverse Nernst-Ettingshausen effect of semiconductor with standard zone by using one-parameter Fermi functions

    NASA Astrophysics Data System (ADS)

    Mamedov, Bahtiyar Akber; Askerov, Iskender M.; Akkuş, Adem

    2017-02-01

    A new analytical approach is proposed for the evaluation of the transverse Nernst-Ettingshausen effect of semiconductor with standard zone in the case of weak magnetic field. The obtained formula is expressed in terms of the one-parameter Fermi functions. One of the authors proposed efficient formulae for accurate evaluation of the one-parameter Fermi functions. This method gives satisfying results for arbitrary values of parameters and allows us to evaluate accurately of the Nernst-Ettingshausen transverse effect. The results show that proposed algorithm has high efficiency and accuracy for theoretical evaluations of the Nernst-Ettingshausen transverse effect.

  20. Correlation of Electric Field and Critical Design Parameters for Ferroelectric Tunable Microwave Filters

    NASA Technical Reports Server (NTRS)

    Subramanyam, Guru; VanKeuls, Fred W.; Miranda, Felix A.; Canedy, Chadwick L.; Aggarwal, Sanjeev; Venkatesan, Thirumalai; Ramesh, Ramamoorthy

    2000-01-01

    The correlation of electric field and critical design parameters such as the insertion loss, frequency ability return loss, and bandwidth of conductor/ferroelectric/dielectric microstrip tunable K-band microwave filters is discussed in this work. This work is based primarily on barium strontium titanate (BSTO) ferroelectric thin film based tunable microstrip filters for room temperature applications. Two new parameters which we believe will simplify the evaluation of ferroelectric thin films for tunable microwave filters, are defined. The first of these, called the sensitivity parameter, is defined as the incremental change in center frequency with incremental change in maximum applied electric field (EPEAK) in the filter. The other, the loss parameter, is defined as the incremental or decremental change in insertion loss of the filter with incremental change in maximum applied electric field. At room temperature, the Au/BSTO/LAO microstrip filters exhibited a sensitivity parameter value between 15 and 5 MHz/cm/kV. The loss parameter varied for different bias configurations used for electrically tuning the filter. The loss parameter varied from 0.05 to 0.01 dB/cm/kV at room temperature.

  1. Experimental design for estimating parameters of rate-limited mass transfer: Analysis of stream tracer studies

    USGS Publications Warehouse

    Wagner, B.J.; Harvey, J.W.

    1997-01-01

    Tracer experiments are valuable tools for analyzing the transport characteristics of streams and their interactions with shallow groundwater. The focus of this work is the design of tracer studies in high-gradient stream systems subject to advection, dispersion, groundwater inflow, and exchange between the active channel and zones in surface or subsurface water where flow is stagnant or slow moving. We present a methodology for (1) evaluating and comparing alternative stream tracer experiment designs and (2) identifying those combinations of stream transport properties that pose limitations to parameter estimation and therefore a challenge to tracer test design. The methodology uses the concept of global parameter uncertainty analysis, which couples solute transport simulation with parameter uncertainty analysis in a Monte Carlo framework. Two general conclusions resulted from this work. First, the solute injection and sampling strategy has an important effect on the reliability of transport parameter estimates. We found that constant injection with sampling through concentration rise, plateau, and fall provided considerably more reliable parameter estimates than a pulse injection across the spectrum of transport scenarios likely encountered in high-gradient streams. Second, for a given tracer test design, the uncertainties in mass transfer and storage-zone parameter estimates are strongly dependent on the experimental Damkohler number, DaI, which is a dimensionless combination of the rates of exchange between the stream and storage zones, the stream-water velocity, and the stream reach length of the experiment. Parameter uncertainties are lowest at DaI values on the order of 1.0. When DaI values are much less than 1.0 (owing to high velocity, long exchange timescale, and/or short reach length), parameter uncertainties are high because only a small amount of tracer interacts with storage zones in the reach. For the opposite conditions (DaI >> 1.0), solute exchange

  2. Controller design for wind turbine load reduction via multiobjective parameter synthesis

    NASA Astrophysics Data System (ADS)

    Hoffmann, A. F.; Weiβ, F. A.

    2016-09-01

    During the design process for a wind turbine load reduction controller many different, sometimes conflicting requirements must be fulfilled simultaneously. If the requirements can be expressed as mathematical criteria, such a design problem can be solved by a criterion-vector and multi-objective design optimization. The software environment MOPS (Multi-Objective Parameter Synthesis) supports the engineer for such a design optimization. In this paper MOPS is applied to design a multi-objective load reduction controller for the well-known DTU 10 MW reference wind turbine. A significant reduction in the fatigue criteria especially the blade damage can be reached by the use of an additional Individual Pitch Controller (IPC) and an additional tower damper. This reduction is reached as a trade-off with an increase of actuator load.

  3. Calculation of the Thermal Parameters and Change in The Share of Emissions of Harmful Substances During Combustion of Water-Fuel Emulsion

    NASA Astrophysics Data System (ADS)

    Toropov, S. Y.; Berg, V. I.; Petryakov, V. A.; Mostovaya, N. A.

    2016-10-01

    The article investigates the possibility to improve efficiency and ecological compatibility of fuel oil with use water-fuel emulsion. The calculation of the thermal parameters and change in the share of emissions of harmful substances during combustion of water-fuel emulsion and optimal water content in water-fuel emulsion.

  4. D0 Silicon Upgrade: West End Assembly Hall Platform Design Calculations

    SciTech Connect

    Rucinski, Russ; /Fermilab

    1996-01-03

    This engineering note documents design calculations done for the bayonet feed can platform installed at the far west end of the assembly hall. The platform is mounted off of a cast concrete wall directly south of where the shielding block wall is stacked. A summary of the loading, reaction forces and stresses is shown on the page 3. As can be seen, the calculated stresses are very small, maximum value = 2540 psi. The material used is structural steel tubing, ASTM A500 Gr. B, with a minimum yield strength of 46 ksi and minimum ultimate tensile strength of 58 ksi. The reaction forces for the upper two members will be carried together by a 1/2-inch mounting plate. The mounting plate is attached to the wall by four 1/2-inch Hilti wedge anchors. The allowables for each wedge anchor are 2400 lbs. tensile, 1960 lbs. shear. The major reaction load for the top members is a combined 3627 lbs. tensile load which can easily be handled by the four bolt pattern. Some small moment reactions not listed on the summary page add negligible (400 lbs.) force couples to the axial loading. The bottom members are also attached to a mounting plate that is bolted to the wall. See page 15 for Hilti wedge anchor data.

  5. Program GROUPIE (version 79-1): calculation of Bondarenko self-shielded neutron cross sections and multiband parameters from data in the ENDF/B format

    SciTech Connect

    Cullen, D.E.

    1980-07-04

    Program GROUPIE reads evaluated data in the ENDF/B format and uses these data to calculate Bondarenko self-shielded cross sections and multiband parameters. To give as much generality as possible, the program allows the user to specify arbitrary energy groups and an arbitrary energy groups and an arbitrary energy-dependent neutron spectrum (weighing function). To guarantee the accuracy of the results, all integrals are performed analytically; in no case is iteration or any approximate form of integration used. The output from this program includes both listings and multiband parameters suitable for use either in a normal multigroup transport calculation or in a multiband transport calculation. A listing of the source deck is available on request.

  6. Crystal Field Parameters and Energy Levels Calculations for Fe{sup 3+}:ZnGa{sub 2}O{sub 4}

    SciTech Connect

    Vaida, M.; Brik, M. G.; Avram, N. M.

    2010-08-04

    In this paper, we present a theoretical study of the energy levels structure for the zinc gallate normal spinel, ZnGa{sub 2}O{sub 4}, doped with Fe{sup 3+}(3d{sup 5} configuration) ions. The calculations have been performed in the framework of the exchange charge model (ECM) of the crystal field. After calculating the CFPs, based on the geometrical structure of the host matrix, the crystal field Hamiltonian was diagonalized in the space spanned by the wave functions of all 16 LS terms of the 3d{sup 5} electron configurations. The Racah parameters B, C and G parameter of the exchange charge model have been estimated. The results of the theoretical calculations are in satisfactory agreement with the experimental data.

  7. Interpretation and application of reaction class transition state theory for accurate calculation of thermokinetic parameters using isodesmic reaction method.

    PubMed

    Wang, Bi-Yao; Li, Ze-Rong; Tan, Ning-Xin; Yao, Qian; Li, Xiang-Yuan

    2013-04-25

    We present a further interpretation of reaction class transition state theory (RC-TST) proposed by Truong et al. for the accurate calculation of rate coefficients for reactions in a class. It is found that the RC-TST can be interpreted through the isodesmic reaction method, which is usually used to calculate reaction enthalpy or enthalpy of formation for a species, and the theory can also be used for the calculation of the reaction barriers and reaction enthalpies for reactions in a class. A correction scheme based on this theory is proposed for the calculation of the reaction barriers and reaction enthalpies for reactions in a class. To validate the scheme, 16 combinations of various ab initio levels with various basis sets are used as the approximate methods and CCSD(T)/CBS method is used as the benchmarking method in this study to calculate the reaction energies and energy barriers for a representative set of five reactions from the reaction class: R(c)CH(R(b))CR(a)CH2 + OH(•) → R(c)C(•)(R(b))CR(a)CH2 + H2O (R(a), R(b), and R(c) in the reaction formula represent the alkyl or hydrogen). Then the results of the approximate methods are corrected by the theory. The maximum values of the average deviations of the energy barrier and the reaction enthalpy are 99.97 kJ/mol and 70.35 kJ/mol, respectively, before correction and are reduced to 4.02 kJ/mol and 8.19 kJ/mol, respectively, after correction, indicating that after correction the results are not sensitive to the level of the ab initio method and the size of the basis set, as they are in the case before correction. Therefore, reaction energies and energy barriers for reactions in a class can be calculated accurately at a relatively low level of ab initio method using our scheme. It is also shown that the rate coefficients for the five representative reactions calculated at the BHandHLYP/6-31G(d,p) level of theory via our scheme are very close to the values calculated at CCSD(T)/CBS level. Finally, reaction

  8. AbsParEB and InPeVEB: Software for the Calculation of Absolute and Orbital Period Changes Parameters of Eclipsing Binaries

    NASA Astrophysics Data System (ADS)

    Liakos, A.

    2015-07-01

    The software ABSPAREB (Absolute Parameters of Eclipsing Binaries) calculates the absolute parameters and their formal errors for three different modes: a) double-lined spectroscopic eclipsing binary, b) single-lined spectroscopic eclipsing binary, and c) for an eclipsing binary for which there is no spectroscopic information. In addition, the positions of the binary's members on the mass-radius and color-magnitude diagrams can be also plotted. INPEVEB (Interpretation of Period Variations of Eclipsing Binaries) calculates the parameters as well as their formal errors for several orbital period modulating mechanisms in eclipsing binaries (i.e., LITE, the Applegate mechanism, mass transfer/loss, apsidal motion, magnetic braking) using from an analysis of their O-C diagrams. Both programs are available online (free of charge) in Graphical User Interface form and were written in PYTHON.

  9. Engineering Parameters in Bioreactor's Design: A Critical Aspect in Tissue Engineering

    PubMed Central

    Amoabediny, Ghassem; Pouran, Behdad; Tabesh, Hadi; Shokrgozar, Mohammad Ali; Haghighipour, Nooshin; Khatibi, Nahid; Mottaghy, Khosrow; Zandieh-Doulabi, Behrouz

    2013-01-01

    Bioreactors are important inevitable part of any tissue engineering (TE) strategy as they aid the construction of three-dimensional functional tissues. Since the ultimate aim of a bioreactor is to create a biological product, the engineering parameters, for example, internal and external mass transfer, fluid velocity, shear stress, electrical current distribution, and so forth, are worth to be thoroughly investigated. The effects of such engineering parameters on biological cultures have been addressed in only a few preceding studies. Furthermore, it would be highly inefficient to determine the optimal engineering parameters by trial and error method. A solution is provided by emerging modeling and computational tools and by analyzing oxygen, carbon dioxide, and nutrient and metabolism waste material transports, which can simulate and predict the experimental results. Discovering the optimal engineering parameters is crucial not only to reduce the cost and time of experiments, but also to enhance efficacy and functionality of the tissue construct. This review intends to provide an inclusive package of the engineering parameters together with their calculation procedure in addition to the modeling techniques in TE bioreactors. PMID:24000327

  10. Influence of Various Material Design Parameters on Deformation Behaviors of TRIP Steels

    SciTech Connect

    Choi, Kyoo Sil; Soulami, Ayoub; Liu, Wenning N.; Sun, Xin; Khaleel, Mohammad A.

    2010-11-02

    In this paper, the microstructure-based finite element modeling method is used as a virtual design tool in investigating the respective influence of various material design parameters on the deformation behaviors of transformation induced plasticity (TRIP) steels. For this purpose, the separate effects of several different material design parameters, such as the volume fraction and stability of austenite phase and the strengths of the constituent phases, on the ultimate tensile strength (UTS) and ductility/formability of TRIP steels are quantitatively examined using different representative volume elements (RVEs) representing different TRIP steels. The computational results suggest that higher austenite stability is helpful in enhancing the ductility and formability of TRIP steels by delaying the martensitic transformation to a later stage, whereas increase of austenite volume fraction and/or ferrite strength alone is not beneficial to improve the performance of TRIP steels. The results in this study also indicate that various material design parameters must be adjusted concurrently to develop high performance TRIP steels. For example, the austenite strength should increase over the ferrite strength in order to induce the gradual/smooth martensitic transformation, and the strength disparity between the ferrite and the freshly-formed martensite phases should decrease in order to avoid higher stress/strain concentration along the phase boundaries. The modeling approach and results presented in this paper can be helpful in providing the deformation fundamentals for the development of high performance TRIP steels.

  11. Uranium Mill Tailings Remedial Action Project (UMTRAP), Slick Rock, Colorado, Revision 1. Volume 1, Calculations, Final design for construction

    SciTech Connect

    1995-09-01

    Volume one contains calculations for: embankment design--embankment material properties; Union Carbide site--bedrock contours; vicinity properties--origin of contamination; North Continent and Union Carbide sites contaminated materials--excavation quantities; and demolition debris--quantity estimate.

  12. SU-E-T-454: Impact of Calculation Grid Size On Dosimetry and Radiobiological Parameters for Head and Neck IMRT

    SciTech Connect

    Srivastava, S; Das, I; Cheng, C

    2014-06-01

    Purpose: IMRT has become standard of care for complex treatments to optimize dose to target and spare normal tissues. However, the impact of calculation grid size is not widely known especially dose distribution, tumor control probability (TCP) and normal tissue complication probability (NTCP) which is investigated in this study. Methods: Ten head and neck IMRT patients treated with 6 MV photons were chosen for this study. Using Eclipse TPS, treatment plans were generated for different grid sizes in the range 1–5 mm for the same optimization criterion with specific dose-volume constraints. The dose volume histogram (DVH) was calculated for all IMRT plans and dosimetric data were compared. ICRU-83 dose points such as D2%, D50%, D98%, as well as the homogeneity and conformity indices (HI, CI) were calculated. In addition, TCP and NTCP were calculated from DVH data. Results: The PTV mean dose and TCP decreases with increasing grid size with an average decrease in mean dose by 2% and TCP by 3% respectively. Increasing grid size from 1–5 mm grid size, the average mean dose and NTCP for left parotid was increased by 6.0% and 8.0% respectively. Similar patterns were observed for other OARs such as cochlea, parotids and spinal cord. The HI increases up to 60% and CI decreases on average by 3.5% between 1 and 5 mm grid that resulted in decreased TCP and increased NTCP values. The number of points meeting the gamma criteria of ±3% dose difference and ±3mm DTA was higher with a 1 mm on average (97.2%) than with a 5 mm grid (91.3%). Conclusion: A smaller calculation grid provides superior dosimetry with improved TCP and reduced NTCP values. The effect is more pronounced for smaller OARs. Thus, the smallest possible grid size should be used for accurate dose calculation especially in H and N planning.

  13. Development of a turbomachinery design optimization procedure using a multiple-parameter nonlinear perturbation method

    NASA Technical Reports Server (NTRS)

    Stahara, S. S.

    1984-01-01

    An investigation was carried out to complete the preliminary development of a combined perturbation/optimization procedure and associated computational code for designing optimized blade-to-blade profiles of turbomachinery blades. The overall purpose of the procedures developed is to provide demonstration of a rapid nonlinear perturbation method for minimizing the computational requirements associated with parametric design studies of turbomachinery flows. The method combines the multiple parameter nonlinear perturbation method, successfully developed in previous phases of this study, with the NASA TSONIC blade-to-blade turbomachinery flow solver, and the COPES-CONMIN optimization procedure into a user's code for designing optimized blade-to-blade surface profiles of turbomachinery blades. Results of several design applications and a documented version of the code together with a user's manual are provided.

  14. Effect of absorption parameters on calculation of the dose coefficient: example of classification of industrial uranium compounds.

    PubMed

    Chazel, V; Houpert, P; Paquet, F; Ansoborlo, E

    2001-01-01

    In the Human Respiratory Tract Model (HRTM) described in ICRP Publication 66, time-dependent dissolution is described by three parameters: the fraction dissolved rapidly, fr, and the rapid and slow dissolution rates sr and ss. The effect of these parameters on the dose coefficient has been studied. A theoretical analysis was carried out to determine the sensitivity of the dose coefficient to variations in the values of these absorption parameters. Experimental values of the absorption parameters and the doses per unit intake (DPUI) were obtained from in vitro dissolution tests, or from in vivo experiments with rats, for five industrial uranium compounds UO2, U3O8, UO4, UF4 and a mixture of uranium oxides. These compounds were classified in terms of absorption types (F, M or S) according to ICRP. The overall result was that the factor which has the greatest influence on the dose coefficient was the slow dissolution rate ss. This was verified experimentally, with a variation of 20% to 55% for the DPUI according to the absorption type of the compound. In contrast, the rapid dissolution rate sr had little effect on the dose coefficient, excepted for Type F compounds.

  15. Estimation Model of Spacecraft Parameters and Cost Based on a Statistical Analysis of COMPASS Designs

    NASA Technical Reports Server (NTRS)

    Gerberich, Matthew W.; Oleson, Steven R.

    2013-01-01

    The Collaborative Modeling for Parametric Assessment of Space Systems (COMPASS) team at Glenn Research Center has performed integrated system analysis of conceptual spacecraft mission designs since 2006 using a multidisciplinary concurrent engineering process. The set of completed designs was archived in a database, to allow for the study of relationships between design parameters. Although COMPASS uses a parametric spacecraft costing model, this research investigated the possibility of using a top-down approach to rapidly estimate the overall vehicle costs. This paper presents the relationships between significant design variables, including breakdowns of dry mass, wet mass, and cost. It also develops a model for a broad estimate of these parameters through basic mission characteristics, including the target location distance, the payload mass, the duration, the delta-v requirement, and the type of mission, propulsion, and electrical power. Finally, this paper examines the accuracy of this model in regards to past COMPASS designs, with an assessment of outlying spacecraft, and compares the results to historical data of completed NASA missions.

  16. Selection of parameters in the design of a naval fire control radar

    NASA Astrophysics Data System (ADS)

    As, Bengt-Olof; Tilfors, Einar

    The rationale and tradeoff considerations involved in the definition of a new generation of high-performance tracking radar are described. The radar is the primary sensor for control of surface-to-air missiles, antiaircraft or dual-purpose guns, and close-in weapons, and is designed for all sizes of ships from 150 tons up. Operational requirements are outlined broadly and optimization investigations accounted for on a number of parameters: wavelengths, type of transmitter and waveforms, pulse compression principle, receiver and signal processing, and antenna. Data for the completed standard design are given.

  17. Design parameters and source terms: Volume 2, Source terms: Revision 0

    SciTech Connect

    Not Available

    1987-09-01

    The Design Parameters and Source Terms Document was prepared in accordance with DOE request and to provide data for the environmental impact study to be performed in the future for the Deaf Smith County, Texas site for a nuclear waste repository in salt. This document updates a previous unpublished report to the level of the Site Characterization Plan---Conceptual Design Report SCP-CDR. The previous study identifies the data needs for the Environmental Assessment effort for seven possible salt repository sites. Volume 2 contains tables of source terms.

  18. Design parameters and source terms: Volume 3, Source terms: Revision 0

    SciTech Connect

    Not Available

    1987-09-01

    The Design Parameters and Source Terms Document was prepared in accordance with DOE request and to provide data for the environmental impact study to be performed in the future for the Deaf Smith County, Texas site for a nuclear waste repository in salt. This document updates a previous unpublished report to the level of the Site Characterization Plan /endash/ Conceptual Design Report, SCP-CDR. The previous unpublished SCC Study identifies the data needs for the Environmental Assessment effort for seven possible salt repository sites.

  19. Analysis of suitable geometrical parameters for designing a tendon-driven under-actuated mechanical finger

    NASA Astrophysics Data System (ADS)

    Penta, Francesco; Rossi, Cesare; Savino, Sergio

    2016-06-01

    This study aims to optimize the geometrical parameters of an under-actuated mechanical finger by conducting a theoretical analysis of these parameters. The finger is actuated by a flexion tendon and an extension tendon. The considered parameters are the tendon guide positions with respect to the hinges. By applying such an optimization, the correct kinematical and dynamical behavior of the closing cycle of the finger can be obtained. The results of this study are useful for avoiding the snapthrough and the single joint hyperflexion, which are the two breakdowns most frequently observed during experimentation on prototypes. Diagrams are established to identify the optimum values for the tendon guides position of a finger with specified dimensions. The findings of this study can serve as guide for future finger design.

  20. Optimal Design of Material and Process Parameters in Powder Injection Molding

    NASA Astrophysics Data System (ADS)

    Ayad, G.; Barriere, T.; Gelin, J. C.; Song, J.; Liu, B.

    2007-04-01

    The paper is concerned with optimization and parametric identification for the different stages in Powder Injection Molding process that consists first in injection of powder mixture with polymer binder and then to the sintering of the resulting powders part by solid state diffusion. In the first part, one describes an original methodology to optimize the process and geometry parameters in injection stage based on the combination of design of experiments and an adaptive Response Surface Modeling. Then the second part of the paper describes the identification strategy that one proposes for the sintering stage, using the identification of sintering parameters from dilatometeric curves followed by the optimization of the sintering process. The proposed approaches are applied to the optimization of material and process parameters for manufacturing a ceramic femoral implant. One demonstrates that the proposed approach give satisfactory results.

  1. Controller design and parameter identifiability studies for a large space antenna

    NASA Technical Reports Server (NTRS)

    Joshi, S. M.

    1985-01-01

    The problem of control systems synthesis and parameter identifiability are considered for a large, space-based antenna. Two methods are considered for control system synthesis, the first of which uses torque actuators and collocated attitude and rate sensors, and the second method is based on the linear-quadratic-Gaussian (LQG) control theory. The predicted performance obtained by computing variances of pointing, surface and feed misalignment errors in the presence of sensor noise indicates that the LQG-based controller yields superior results. Since controller design requires the knowledge of the system parameters, the identifiability of the structural parameters is investigated by obtaining Cramer-Rao lower bounds. The modal frequencies are found to have the best identifiability, followed by damping ratios, and mode-slopes.

  2. Classical Control System Design: A non-Graphical Method for Finding the Exact System Parameters

    NASA Astrophysics Data System (ADS)

    Hussein, Mohammed Tawfik

    2008-06-01

    The Root Locus method of control system design was developed in the 1940's. It is a set of rules that helps in sketching the path traced by the roots of the closed loop characteristic equation of the system, as a parameter such as a controller gain, k, is varied. The procedure provides approximate sketching guidelines. Designs on control systems using the method are therefore not exact. This paper aims at a non-graphical method for finding the exact system parameters to place a pair of complex conjugate poles on a specified damping ratio line. The overall procedure is based on the exact solution of complex equations on the PC using numerical methods.

  3. Design of GLP lab environment parameters monitor system based on Schneider PLC

    NASA Astrophysics Data System (ADS)

    Lian, Xiaoqin; Xu, Huihui; Duan, Zhengang; Zhang, Yong

    2008-10-01

    According to the technological process and the requirement for system control of the GLP Laboratory, an automatic system is designed to monitor and control over the environment parameters of the GLP laboratory. The system is composed of a programmable controller and touching screen as the processing unit. The Schneider PLC TSX P57303 controller with its counterpart input/output modules is adopted as the hardware platform and the Schneider PL7-MICRO/WIN as the software platform. This paper presents the main flow process design of the control system. The test results show that the control system can run automatically and switch mutually under different modes, and the functions such as monitor and control over the environment parameters of the GLP laboratory are realized.

  4. Design of Multi-Parameter Steerable Functions Using Cascade Basis Reduction

    NASA Technical Reports Server (NTRS)

    Teo, P.; Hel-Or, Y.; Null, Cynthia H. (Technical Monitor)

    1996-01-01

    A new cascade basis reduction method of computing the optimal least-squares set of basis functions steering a given function is presented. The method combines the Lie group-theoretic and the singular value decomposition approaches in such a way that their respective strengths complement each other. Since the Lie group-theoretic approach is used, the set of basis and steering functions computed can be expressed analytically. Because the singular value decomposition method is used, this set of basis and steering functions is optimal in the least-squares sense. Furthermore, the computational complexity in designing basis functions for transformation groups with large numbers of parameters is significantly reduced. The efficiency of the cascade basis reduction method is demonstrated by designing a set of basis functions that steers a Gabor function under the four-parameter linear transformation group.

  5. Design of experiment for earth rotation and baseline parameter determination from very long baseline interferometry

    NASA Technical Reports Server (NTRS)

    Dermanis, A.

    1977-01-01

    The possibility of recovering earth rotation and network geometry (baseline) parameters are emphasized. The numerical simulated experiments performed are set up in an environment where station coordinates vary with respect to inertial space according to a simulated earth rotation model similar to the actual but unknown rotation of the earth. The basic technique of VLBI and its mathematical model are presented. The parametrization of earth rotation chosen is described and the resulting model is linearized. A simple analysis of the geometry of the observations leads to some useful hints on achieving maximum sensitivity of the observations with respect to the parameters considered. The basic philosophy for the simulation of data and their analysis through standard least squares adjustment techniques is presented. A number of characteristic network designs based on present and candidate station locations are chosen. The results of the simulations for each design are presented together with a summary of the conclusions.

  6. Theoretical calculations of spin-Hamiltonian parameters for the (MoOX5)2- (X=Cl, Br) metallic complexes in solution or frozen-glass

    NASA Astrophysics Data System (ADS)

    Mei, Yang; Zheng, Wen-Chen; Zhang, Lin; Chen, Bo-Wei

    2014-11-01

    The spin-Hamiltonian parameters (g factors g//, g⊥ and hyperfine structure constants A//, A⊥) of the (MoOX5)2- (X=Cl, Br) metallic complexes in solution or frozen-glass are calculated from the high-order perturbation formulas based on the two-mechanism model. In these formulas, the contributions to spin-Hamiltonian parameters due to both the widely-applied crystal-field (CF) mechanism and the charge-transfer (CT) mechanism (which is neglected in CF theory) are taken into account, and the needed CF and CT energy levels are obtained from the optical spectra. The calculated results with two adjustable parameters are in reasonable agreement with the experimental values. The calculations show that (i) the relative importance of CT mechanism in (MoOBr5)2- metallic complexes is larger than that in (MoOCl5)2- ones because of the stronger covalence of Mo5+-Br- combination, and (ii) in both (MoOCl5)2- and (MoOBr5)2- metallic complexes, the contributions to spin-Hamiltonian parameters due to CT mechanism should also be taken into account because of the high valence state of Mo5+ ion.

  7. How to Develop, Validate, and Compare Clinical Prediction Models Involving Radiological Parameters: Study Design and Statistical Methods

    PubMed Central

    Han, Kyunghwa; Choi, Byoung Wook

    2016-01-01

    Clinical prediction models are developed to calculate estimates of the probability of the presence/occurrence or future course of a particular prognostic or diagnostic outcome from multiple clinical or non-clinical parameters. Radiologic imaging techniques are being developed for accurate detection and early diagnosis of disease, which will eventually affect patient outcomes. Hence, results obtained by radiological means, especially diagnostic imaging, are frequently incorporated into a clinical prediction model as important predictive parameters, and the performance of the prediction model may improve in both diagnostic and prognostic settings. This article explains in a conceptual manner the overall process of developing and validating a clinical prediction model involving radiological parameters in relation to the study design and statistical methods. Collection of a raw dataset; selection of an appropriate statistical model; predictor selection; evaluation of model performance using a calibration plot, Hosmer-Lemeshow test and c-index; internal and external validation; comparison of different models using c-index, net reclassification improvement, and integrated discrimination improvement; and a method to create an easy-to-use prediction score system will be addressed. This article may serve as a practical methodological reference for clinical researchers. PMID:27134523

  8. Modeling and Simulation of Reliability & Maintainability Parameters for Reusable Launch Vehicles using Design of Experiments

    NASA Technical Reports Server (NTRS)

    Unal, Resit; Morris, W. Douglas; White, Nancy H.; Lepsch, Roger A.

    2004-01-01

    This paper describes the development of a methodology for estimating reliability and maintainability distribution parameters for a reusable launch vehicle. A disciplinary analysis code and experimental designs are used to construct approximation models for performance characteristics. These models are then used in a simulation study to estimate performance characteristic distributions efficiently. The effectiveness and limitations of the developed methodology for launch vehicle operations simulations are also discussed.

  9. Parametric estimation of R&M parameters during the conceptual design of space vehicles

    NASA Technical Reports Server (NTRS)

    Ebeling, Charles E.

    1992-01-01

    Reliability and maintainability parameters of proposed space vehicles are estimated based on a comparability analysis of similar aircraft subsystems. Using multiple regression techniques, parametric equations are developed for each subsystem to predict mean flying hours between failure as a function of vehicle design and performance specifications. These estimates are then adjusted to account for reliability growth, environmental differences, and new technologies. Overall vehicle mission reliability may then be computed from subsystem reliability estimates.

  10. Optimum Design of Forging Process Parameters and Preform Shape under Uncertainties

    NASA Astrophysics Data System (ADS)

    Repalle, Jalaja; Grandhi, Ramana V.

    2004-06-01

    Forging is a highly complex non-linear process that is vulnerable to various uncertainties, such as variations in billet geometry, die temperature, material properties, workpiece and forging equipment positional errors and process parameters. A combination of these uncertainties could induce heavy manufacturing losses through premature die failure, final part geometric distortion and production risk. Identifying the sources of uncertainties, quantifying and controlling them will reduce risk in the manufacturing environment, which will minimize the overall cost of production. In this paper, various uncertainties that affect forging tool life and preform design are identified, and their cumulative effect on the forging process is evaluated. Since the forging process simulation is computationally intensive, the response surface approach is used to reduce time by establishing a relationship between the system performance and the critical process design parameters. Variability in system performance due to randomness in the parameters is computed by applying Monte Carlo Simulations (MCS) on generated Response Surface Models (RSM). Finally, a Robust Methodology is developed to optimize forging process parameters and preform shape. The developed method is demonstrated by applying it to an axisymmetric H-cross section disk forging to improve the product quality and robustness.

  11. Analysis on the effect of geometrical design parameters on maximum shear stresses in an electromagnetic micropump

    NASA Astrophysics Data System (ADS)

    Al-Halhouli, A. T.

    2010-02-01

    In this work, the concept of recently introduced electromagnetic pump has been presented. This pump has been proposed for pumping biomedical fluids carrying particles sensitive to shear stresses. Its working concept depends on controlling the rotation of two pistons placed in a circular channel in opposing polarity under the influence of a moving electromagnetic field. Analytical and numerical investigations on the effect of pump geometrical parameters on shear stresses at different boundary conditions are performed. The geometrical parameters include: channel aspect ratio (channel width to height) and channel radius ratio (inner to outer radius). Non-dimensional simple analytical shear stress expressions that are valid for a wide range of geometrical design parameters and variety of fluids are derived. CFD simulations have been used to verify the analytical expressions within the range of studied parameters. Obtained results showed that the analytical models predict the wall maximum shear stresses with an error less than 5% for w / h<=1.0 at high radius ratios and with an error less than10% for Ri / Ro >=0.3. These results help the designer in fabricating the micropump to be suitable for biomedical applications, where saving the particles carried in fluids from damage is of high importance.

  12. Gradient Theory simulations of pure fluid interfaces using a generalized expression for influence parameters and a Helmholtz energy equation of state for fundamentally consistent two-phase calculations.

    PubMed

    Dahms, Rainer N

    2015-05-01

    The fidelity of Gradient Theory simulations depends on the accuracy of saturation properties and influence parameters, and require equations of state (EoS) which exhibit a fundamentally consistent behavior in the two-phase regime. Widely applied multi-parameter EoS, however, are generally invalid inside this region. Hence, they may not be fully suitable for application in concert with Gradient Theory despite their ability to accurately predict saturation properties. The commonly assumed temperature-dependence of pure component influence parameters usually restricts their validity to subcritical temperature regimes. This may distort predictions for general multi-component interfaces where temperatures often exceed the critical temperature of vapor phase components. Then, the calculation of influence parameters is not well defined. In this paper, one of the first studies is presented in which Gradient Theory is combined with a next-generation Helmholtz energy EoS which facilitates fundamentally consistent calculations over the entire two-phase regime. Illustrated on pentafluoroethane as an example, reference simulations using this method are performed. They demonstrate the significance of such high-accuracy and fundamentally consistent calculations for the computation of interfacial properties. These reference simulations are compared to corresponding results from cubic PR EoS, widely-applied in combination with Gradient Theory, and mBWR EoS. The analysis reveals that neither of those two methods succeeds to consistently capture the qualitative distribution of obtained key thermodynamic properties in Gradient Theory. Furthermore, a generalized expression of the pure component influence parameter is presented. This development is informed by its fundamental definition based on the direct correlation function of the homogeneous fluid and by presented high-fidelity simulations of interfacial density profiles. The new model preserves the accuracy of previous temperature

  13. Gradient Theory simulations of pure fluid interfaces using a generalized expression for influence parameters and a Helmholtz energy equation of state for fundamentally consistent two-phase calculations

    DOE PAGES

    Dahms, Rainer N.

    2014-12-31

    The fidelity of Gradient Theory simulations depends on the accuracy of saturation properties and influence parameters, and require equations of state (EoS) which exhibit a fundamentally consistent behavior in the two-phase regime. Widely applied multi-parameter EoS, however, are generally invalid inside this region. Hence, they may not be fully suitable for application in concert with Gradient Theory despite their ability to accurately predict saturation properties. The commonly assumed temperature-dependence of pure component influence parameters usually restricts their validity to subcritical temperature regimes. This may distort predictions for general multi-component interfaces where temperatures often exceed the critical temperature of vapor phasemore » components. Then, the calculation of influence parameters is not well defined. In this paper, one of the first studies is presented in which Gradient Theory is combined with a next-generation Helmholtz energy EoS which facilitates fundamentally consistent calculations over the entire two-phase regime. Illustrated on pentafluoroethane as an example, reference simulations using this method are performed. They demonstrate the significance of such high-accuracy and fundamentally consistent calculations for the computation of interfacial properties. These reference simulations are compared to corresponding results from cubic PR EoS, widely-applied in combination with Gradient Theory, and mBWR EoS. The analysis reveals that neither of those two methods succeeds to consistently capture the qualitative distribution of obtained key thermodynamic properties in Gradient Theory. Furthermore, a generalized expression of the pure component influence parameter is presented. This development is informed by its fundamental definition based on the direct correlation function of the homogeneous fluid and by presented high-fidelity simulations of interfacial density profiles. As a result, the new model preserves the accuracy of

  14. Gradient Theory simulations of pure fluid interfaces using a generalized expression for influence parameters and a Helmholtz energy equation of state for fundamentally consistent two-phase calculations

    SciTech Connect

    Dahms, Rainer N.

    2014-12-31

    The fidelity of Gradient Theory simulations depends on the accuracy of saturation properties and influence parameters, and require equations of state (EoS) which exhibit a fundamentally consistent behavior in the two-phase regime. Widely applied multi-parameter EoS, however, are generally invalid inside this region. Hence, they may not be fully suitable for application in concert with Gradient Theory despite their ability to accurately predict saturation properties. The commonly assumed temperature-dependence of pure component influence parameters usually restricts their validity to subcritical temperature regimes. This may distort predictions for general multi-component interfaces where temperatures often exceed the critical temperature of vapor phase components. Then, the calculation of influence parameters is not well defined. In this paper, one of the first studies is presented in which Gradient Theory is combined with a next-generation Helmholtz energy EoS which facilitates fundamentally consistent calculations over the entire two-phase regime. Illustrated on pentafluoroethane as an example, reference simulations using this method are performed. They demonstrate the significance of such high-accuracy and fundamentally consistent calculations for the computation of interfacial properties. These reference simulations are compared to corresponding results from cubic PR EoS, widely-applied in combination with Gradient Theory, and mBWR EoS. The analysis reveals that neither of those two methods succeeds to consistently capture the qualitative distribution of obtained key thermodynamic properties in Gradient Theory. Furthermore, a generalized expression of the pure component influence parameter is presented. This development is informed by its fundamental definition based on the direct correlation function of the homogeneous fluid and by presented high-fidelity simulations of interfacial density profiles. As a result, the new model preserves the accuracy of previous

  15. Periodic ab initio calculation of nuclear quadrupole parameters as an assignment tool in solid-state NMR spectroscopy: applications to 23Na NMR spectra of crystalline materials.

    PubMed

    Johnson, Clive; Moore, Elaine A; Mortimer, Michael

    2005-05-01

    Periodic ab initio HF calculations using the CRYSTAL code have been used to calculate (23)Na NMR quadrupole parameters for a wide range of crystalline sodium compounds including Na(3)OCl. An approach is developed that can be used routinely as an alternative to point-charge modelling schemes for the assignment of distinct lines in (23)Na NMR spectra to specific crystallographic sodium sites. The calculations are based on standard 3-21 G and 6-21 G molecular basis sets and in each case the same modified basis set for sodium is used for all compounds. The general approach is extendable to other quadrupolar nuclei. For the 3-21 G calculations a 1:1 linear correlation between experimental and calculated values of C(Q)((23)Na) is obtained. The 6-21 G calculations, including the addition of d-polarisation functions, give better accuracy in the calculation of eta((23)Na). The sensitivity of eta((23)Na) to hydrogen atom location is shown to be useful in testing the reported hydrogen-bonded structure of Na(2)HPO(4).

  16. TR-LIF LIFETIME MEASUREMENTS AND HFR+CPOL CALCULATIONS OF RADIATIVE PARAMETERS IN VANADIUM ATOM (V I)

    SciTech Connect

    Wang, Q.; Jiang, L. Y.; Shang, X.; Tian, Y. S.; Dai, Z. W.; Quinet, P.; Palmeri, P.; Zhang, W. E-mail: Pascal.quinet@umons.ac.be

    2014-04-01

    Radiative lifetimes of 79 levels belonging to the 3d {sup 3}4s4p, 3d {sup 4}4p, 3d {sup 3}4s5p, 3d {sup 4}5p, and 3d {sup 3}4s4d configurations of V I with energy from 26,604.807 to 46,862.786 cm{sup –1} have been measured using time-resolved laser-induced fluorescence (TR-LIF) spectroscopy in laser-produced plasma. The lifetime values reported in this paper are in the range of 3.3-494 ns, and the uncertainties of these measurements are within ±10%. A good agreement was obtained with previous data. HFR+CPOL calculations have been performed and used to combine the calculated branching fractions with the available experimental lifetimes to determine semi-empirical transition probabilities for 784 V I transitions.

  17. Optimal Parameter Design of Coarse Alignment for Fiber Optic Gyro Inertial Navigation System.

    PubMed

    Lu, Baofeng; Wang, Qiuying; Yu, Chunmei; Gao, Wei

    2015-06-25

    Two different coarse alignment algorithms for Fiber Optic Gyro (FOG) Inertial Navigation System (INS) based on inertial reference frame are discussed in this paper. Both of them are based on gravity vector integration, therefore, the performance of these algorithms is determined by integration time. In previous works, integration time is selected by experience. In order to give a criterion for the selection process, and make the selection of the integration time more accurate, optimal parameter design of these algorithms for FOG INS is performed in this paper. The design process is accomplished based on the analysis of the error characteristics of these two coarse alignment algorithms. Moreover, this analysis and optimal parameter design allow us to make an adequate selection of the most accurate algorithm for FOG INS according to the actual operational conditions. The analysis and simulation results show that the parameter provided by this work is the optimal value, and indicate that in different operational conditions, the coarse alignment algorithms adopted for FOG INS are different in order to achieve better performance. Lastly, the experiment results validate the effectiveness of the proposed algorithm.

  18. Optimal input experiment design and parameter estimation in core-scale pressure oscillation experiments

    NASA Astrophysics Data System (ADS)

    Potters, M. G.; Mansoori, M.; Bombois, X.; Jansen, J. D.; Van den Hof, P. M. J.

    2016-03-01

    This paper considers Pressure Oscillation (PO) experiments for which we find the minimum experiment time that guarantees user-imposed parameter variance upper bounds and honours actuator limits. The parameters permeability and porosity are estimated with a classical least-squares estimation method for which an expression of the covariance matrix of the estimates is calculated. This expression is used to tackle the optimization problem. We study the Dynamic Darcy Cell experiment set-up (Heller et al., 2002) and focus on data generation using square wave actuator signals, which, as we shall prove, deliver shorter experiment times than sinusoidal ones. Parameter identification is achieved using either inlet pressure/outlet pressure measurements (Heller et al., 2002) or actuator position/outlet pressure measurements, where the latter is a novel approach. The solution to the optimization problem reveals that for both measurement methods an optimal excitation frequency, an optimal inlet volume, and an optimal outlet volume exist. We find that under the same parameter variance bounds and actuator constraints, actuator position/outlet pressure measurements result in required experiment times that are a factor fourteen smaller compared to inlet pressure/outlet pressure measurements. This result is analysed in detail and we find that the dominant effect driving this difference originates from an identifiability problem when using inlet-outlet pressure measurements for joint estimation of permeability and porosity. We illustrate our results with numerical simulations, and show excellent agreement with theoretical expectations.

  19. The influence of selected design and operating parameters on the dynamics of the steam micro-turbine

    NASA Astrophysics Data System (ADS)

    Żywica, Grzegorz; Kiciński, Jan

    2015-10-01

    The topic of the article is the analysis of the influence of selected design parameters and operating conditions on the radial steam micro-turbine, which was adapted to operate with low-boiling agent in the Organic Rankine Cycle (ORC). In the following parts of this article the results of the thermal load analysis, the residual unbalance and the stiffness of bearing supports are discussed. Advanced computational methods and numerical models have been used. Computational analysis showed that the steam micro-turbine is characterized by very good dynamic properties and is resistant to extreme operating conditions. The prototype of micro-turbine has passed a series of test calculations. It has been found that it can be subjected to experimental research in the micro combined heat and power system.

  20. Monte Carlo calculations and experimental measurements of dosimetric parameters of the IRA-{sup 103}Pd brachytherapy source

    SciTech Connect

    Sadeghi, Mahdi; Raisali, Gholamreza; Hosseini, S. Hamed; Shavar, Arzhang

    2008-04-15

    This article presents a brachytherapy source having {sup 103}Pd adsorbed onto a cylindrical silver rod that has been developed by the Agricultural, Medical, and Industrial Research School for permanent implant applications. Dosimetric characteristics (radial dose function, anisotropy function, and anisotropy factor) of this source were experimentally and theoretically determined in terms of the updated AAPM Task group 43 (TG-43U1) recommendations. Monte Carlo simulations were used to calculate the dose rate constant. Measurements were performed using TLD-GR200A circular chip dosimeters using standard methods employing thermoluminescent dosimeters in a Perspex phantom. Precision machined bores in the phantom located the dosimeters and the source in a reproducible fixed geometry, providing for transverse-axis and angular dose profiles over a range of distances from 0.5 to 5 cm. The Monte Carlo N-particle (MCNP) code, version 4C simulation techniques have been used to evaluate the dose-rate distributions around this model {sup 103}Pd source in water and Perspex phantoms. The Monte Carlo calculated dose rate constant of the IRA-{sup 103}Pd source in water was found to be 0.678 cGy h{sup -1} U{sup -1} with an approximate uncertainty of {+-}0.1%. The anisotropy function, F(r,{theta}), and the radial dose function, g(r), of the IRA-{sup 103}Pd source were also measured in a Perspex phantom and calculated in both Perspex and liquid water phantoms.

  1. A general method to derive tissue parameters for Monte Carlo dose calculation with multi-energy CT.

    PubMed

    Lalonde, Arthur; Bouchard, Hugo

    2016-11-21

    To develop a general method for human tissue characterization with dual- and multi-energy CT and evaluate its performance in determining elemental compositions and quantities relevant to radiotherapy Monte Carlo dose calculation. Ideal materials to describe human tissue are obtained applying principal component analysis on elemental weight and density data available in literature. The theory is adapted to elemental composition for solving tissue information from CT data. A novel stoichiometric calibration method is integrated to the technique to make it suitable for a clinical environment. The performance of the method is compared with two techniques known in literature using theoretical CT data. In determining elemental weights with dual-energy CT, the method is shown to be systematically superior to the water-lipid-protein material decomposition and comparable to the parameterization technique. In determining proton stopping powers and energy absorption coefficients with dual-energy CT, the method generally shows better accuracy and unbiased results. The generality of the method is demonstrated simulating multi-energy CT data to show the potential to extract more information with multiple energies. The method proposed in this paper shows good performance to determine elemental compositions from dual-energy CT data and physical quantities relevant to radiotherapy dose calculation. The method is particularly suitable for Monte Carlo calculations and shows promise in using more than two energies to characterize human tissue with CT.

  2. The quantum-chemical approach to calculations of thermodynamic and structural parameters of formation of fatty acid monolayers with hexagonal packing at the air/water interface.

    PubMed

    Vysotsky, Yu B; Belyaeva, E A; Fomina, E S; Vollhardt, D; Fainerman, V B; Miller, R

    2014-02-21

    The structural parameters of fatty acid (with formula CnH2n+1COOH, n = 7-16) monolayers at the air/water interface were modeled within quantum-chemical semiempirical program complex Mopac 2012 (PM3 method). On the basis of quantum-chemical calculations it was shown that molecules in the highly ordered monolayer can be oriented at the angle ∼16° (tilted monolayer), or at the angle ∼0° to the normal to the air/water interface (untilted monolayer). The structural parameters of both tilted and untilted monolayers correspond well to the experimental data. The parameters of the unit cell of the modelled tilted monolayer are: a = 8.0-8.2 Å and b = 4.2-4.5 Å (with the corresponding experimental data 8.4-8.7 Å and 4.9-5.0 Å). For the modelled untilted monolayer these parameters are: a = 7.7-8.0 Å; b = 4.6 Å (with the corresponding experimental data 8.4 Å and 4.8-4.9 Å). Enthalpy, entropy and Gibbs' energy of clusterization were calculated for both structures. The correlation dependencies of the calculated parameters on the number of pair intermolecular CHHC interactions in the clusters and the pair interactions between functional groups were obtained. It was shown that the spontaneous clusterization of the fatty carboxylic acids at the air/water interface under standard conditions is energetically preferable for molecules which have 13 or more carbon atoms in the alkyl chain and this result also agrees with the corresponding experimental parameters.

  3. Central suboptimal H ∞ controller design for linear time-varying systems with unknown parameters

    NASA Astrophysics Data System (ADS)

    Basin, Michael V.; Soto, Pedro; Calderon-Alvarez, Dario

    2011-05-01

    This article presents the central finite-dimensional H ∞ controller for linear time-varying systems with unknown parameters, that is suboptimal for a given threshold γ with respect to a modified Bolza-Meyer quadratic criterion including the attenuation control term with the opposite sign. In contrast to the previously obtained results, this article reduces the original H ∞ controller problem to the corresponding H 2 controller problem, using the technique proposed in Doyle et al. [Doyle, J.C., Glover, K., Khargonekar, P.P., and Francis, B.A. (1989), 'State-space Solutions to Standard H 2 and H Infinity Control Problems', IEEE Transactions Automatic Control, 34, 831-847]. This article yields the central suboptimal H ∞ controller for linear systems with unknown parameters in a closed finite-dimensional form, based on the corresponding H 2 controller obtained in Basin and Calderon-Alvarez [Basin, M.V., and Calderon-Alvarez, D. (2008), 'Optimal LQG Controller for Linear Systems with Unknown Parameters', Journal of The Franklin Institute, 345, 293-302]. Numerical simulations are conducted to verify performance of the designed central suboptimal controller for uncertain linear systems with unknown parameters against the conventional central suboptimal H ∞ controller for linear systems with exactly known parameter values.

  4. Lennard-Jones parameters for small diameter carbon nanotubes and water for molecular mechanics simulations from van der Waals density functional calculations.

    PubMed

    Kaukonen, M; Gulans, A; Havu, P; Kauppinen, E

    2012-03-05

    Lennard-Jones (LJ) parameters are derived for classical nonpolarizable force fields for carbon nanotubes (CNTs) and for CNT-water interaction from van der Waals (vdW) enhanced density functional calculations. The new LJ parameters for carbon-carbon interactions are of the same order as those previously used in the literature but differ significantly for CNT-water interactions. This may partially originate from the fact that in addition to pure vdW interactions the polarization and other quantum mechanics effects are embedded into the LJ-potential.

  5. Biological basis for space-variant sensor design I: parameters of monkey and human spatial vision

    NASA Astrophysics Data System (ADS)

    Rojer, Alan S.; Schwartz, Eric L.

    1991-02-01

    Biological sensor design has long provided inspiration for sensor design in machine vision. However relatively little attention has been paid to the actual design parameters provided by biological systems as opposed to the general nature of biological vision architectures. In the present paper we will provide a review of current knowledge of primate spatial vision design parameters and will present recent experimental and modeling work from our lab which demonstrates that a numerical conformal mapping which is a refinement of our previous complex logarithmic model provides the best current summary of this feature of the primate visual system. In this paper we will review recent work from our laboratory which has characterized some of the spatial architectures of the primate visual system. In particular we will review experimental and modeling studies which indicate that: . The global spatial architecture of primate visual cortex is well summarized by a numerical conformal mapping whose simplest analytic approximation is the complex logarithm function . The columnar sub-structure of primate visual cortex can be well summarized by a model based on a band-pass filtered white noise. We will also refer to ongoing work in our lab which demonstrates that: . The joint columnar/map structure of primate visual cortex can be modeled and summarized in terms of a new algorithm the ''''proto-column'''' algorithm. This work provides a reference-point for current engineering approaches to novel architectures for

  6. The STATFLUX code: a statistical method for calculation of flow and set of parameters, based on the Multiple-Compartment Biokinetical Model

    NASA Astrophysics Data System (ADS)

    Garcia, F.; Mesa, J.; Arruda-Neto, J. D. T.; Helene, O.; Vanin, V.; Milian, F.; Deppman, A.; Rodrigues, T. E.; Rodriguez, O.

    2007-03-01

    The code STATFLUX, implementing a new and simple statistical procedure for the calculation of transfer coefficients in radionuclide transport to animals and plants, is proposed. The method is based on the general multiple-compartment model, which uses a system of linear equations involving geometrical volume considerations. Flow parameters were estimated by employing two different least-squares procedures: Derivative and Gauss-Marquardt methods, with the available experimental data of radionuclide concentrations as the input functions of time. The solution of the inverse problem, which relates a given set of flow parameter with the time evolution of concentration functions, is achieved via a Monte Carlo simulation procedure. Program summaryTitle of program:STATFLUX Catalogue identifier:ADYS_v1_0 Program summary URL:http://cpc.cs.qub.ac.uk/summaries/ADYS_v1_0 Program obtainable from: CPC Program Library, Queen's University of Belfast, N. Ireland Licensing provisions: none Computer for which the program is designed and others on which it has been tested:Micro-computer with Intel Pentium III, 3.0 GHz Installation:Laboratory of Linear Accelerator, Department of Experimental Physics, University of São Paulo, Brazil Operating system:Windows 2000 and Windows XP Programming language used:Fortran-77 as implemented in Microsoft Fortran 4.0. NOTE: Microsoft Fortran includes non-standard features which are used in this program. Standard Fortran compilers such as, g77, f77, ifort and NAG95, are not able to compile the code and therefore it has not been possible for the CPC Program Library to test the program. Memory required to execute with typical data:8 Mbytes of RAM memory and 100 MB of Hard disk memory No. of bits in a word:16 No. of lines in distributed program, including test data, etc.:6912 No. of bytes in distributed program, including test data, etc.:229 541 Distribution format:tar.gz Nature of the physical problem:The investigation of transport mechanisms for

  7. Inductive Powering of Subcutaneous Stimulators: Key Parameters and Their Impact on the Design Methodology.

    PubMed

    Godfraind, Carmen; Debelle, Adrien; Lonys, Laurent; Acuña, Vicente; Doguet, Pascal; Nonclercq, Antoine

    2016-06-13

    Inductive powering of implantable medical devices involves numerous factors acting on the system efficiency and safety in adversarial ways. This paper lightens up their role and identifies a procedure enabling the system design. The latter enables the problem to be decoupled into four principal steps: the frequency choice, the magnetic link optimization, the secondary circuit and then finally the primary circuit designs. The methodology has been tested for the powering system of a device requirering a power of 300mW and implanted at a distance of 15 to 30mm from the outside power source. It allowed the identification of the most critical parameters. A satisfying efficiency of 34% was reached at 21mm and tend to validate the proposed design procedure.

  8. Inductive Powering of Subcutaneous Stimulators: Key Parameters and Their Impact on the Design Methodology

    PubMed Central

    Godfraind, Carmen; Debelle, Adrien; Lonys, Laurent; Acuña, Vicente; Doguet, Pascal; Nonclercq, Antoine

    2016-01-01

    Inductive powering of implantable medical devices involves numerous factors acting on the system efficiency and safety in adversarial ways. This paper lightens up their role and identifies a procedure enabling the system design. The latter enables the problem to be decoupled into four principal steps: the frequency choice, the magnetic link optimization, the secondary circuit and then finally the primary circuit designs. The methodology has been tested for the powering system of a device requirering a power of 300mW and implanted at a distance of 15 to 30mm from the outside power source. It allowed the identification of the most critical parameters. A satisfying efficiency of 34% was reached at 21mm and tend to validate the proposed design procedure. PMID:27478572

  9. Guidelines for the Selection of Near-Earth Thermal Environment Parameters for Spacecraft Design

    NASA Technical Reports Server (NTRS)

    Anderson, B. J.; Justus, C. G.; Batts, G. W.

    2001-01-01

    Thermal analysis and design of Earth orbiting systems requires specification of three environmental thermal parameters: the direct solar irradiance, Earth's local albedo, and outgoing longwave radiance (OLR). In the early 1990s data sets from the Earth Radiation Budget Experiment were analyzed on behalf of the Space Station Program to provide an accurate description of these parameters as a function of averaging time along the orbital path. This information, documented in SSP 30425 and, in more generic form in NASA/TM-4527, enabled the specification of the proper thermal parameters for systems of various thermal response time constants. However, working with the engineering community and SSP-30425 and TM-4527 products over a number of years revealed difficulties in interpretation and application of this material. For this reason it was decided to develop this guidelines document to help resolve these issues of practical application. In the process, the data were extensively reprocessed and a new computer code, the Simple Thermal Environment Model (STEM) was developed to simplify the process of selecting the parameters for input into extreme hot and cold thermal analyses and design specifications. In the process, greatly improved values for the cold case OLR values for high inclination orbits were derived. Thermal parameters for satellites in low, medium, and high inclination low-Earth orbit and with various system thermal time constraints are recommended for analysis of extreme hot and cold conditions. Practical information as to the interpretation and application of the information and an introduction to the STEM are included. Complete documentation for STEM is found in the user's manual, in preparation.

  10. Comparison of dosimetric and radiobiological parameters on plans for prostate stereotactic body radiotherapy using an endorectal balloon for different dose-calculation algorithms and delivery-beam modes

    NASA Astrophysics Data System (ADS)

    Kang, Sang-Won; Suh, Tae-Suk; Chung, Jin-Beom; Eom, Keun-Yong; Song, Changhoon; Kim, In-Ah; Kim, Jae-Sung; Lee, Jeong-Woo; Cho, Woong

    2017-02-01

    The purpose of this study was to evaluate the impact of dosimetric and radiobiological parameters on treatment plans by using different dose-calculation algorithms and delivery-beam modes for prostate stereotactic body radiation therapy using an endorectal balloon. For 20 patients with prostate cancer, stereotactic body radiation therapy (SBRT) plans were generated by using a 10-MV photon beam with flattening filter (FF) and flattening-filter-free (FFF) modes. The total treatment dose prescribed was 42.7 Gy in 7 fractions to cover at least 95% of the planning target volume (PTV) with 95% of the prescribed dose. The dose computation was initially performed using an anisotropic analytical algorithm (AAA) in the Eclipse treatment planning system (Varian Medical Systems, Palo Alto, CA) and was then re-calculated using Acuros XB (AXB V. 11.0.34) with the same monitor units and multileaf collimator files. The dosimetric and the radiobiological parameters for the PTV and organs at risk (OARs) were analyzed from the dose-volume histogram. An obvious difference in dosimetric parameters between the AAA and the AXB plans was observed in the PTV and rectum. Doses to the PTV, excluding the maximum dose, were always higher in the AAA plans than in the AXB plans. However, doses to the other OARs were similar in both algorithm plans. In addition, no difference was observed in the dosimetric parameters for different delivery-beam modes when using the same algorithm to generate plans. As a result of the dosimetric parameters, the radiobiological parameters for the two algorithm plans presented an apparent difference in the PTV and the rectum. The average tumor control probability of the AAA plans was higher than that of the AXB plans. The average normal tissue complication probability (NTCP) to rectum was lower in the AXB plans than in the AAA plans. The AAA and the AXB plans yielded very similar NTCPs for the other OARs. In plans using the same algorithms, the NTCPs for delivery

  11. Atmospheric water parameters in mid-latitude cyclones observed by microwave radiometry and compared to model calculations

    NASA Technical Reports Server (NTRS)

    Katsaros, Kristina B.; Hammarstrand, Ulla; Petty, Grant W.

    1990-01-01

    Existing and experimental algorithms for various parameters of atmospheric water content such as integrated water vapor, cloud water, precipitation, are used to examine the distribution of these quantities in mid latitude cyclones. The data was obtained from signals given by the special sensor microwave/imager (SSM/I) and compared with data from the nimbus scanning multichannel microwave radiometer (SMMR) for North Atlantic cyclones. The potential of microwave remote sensing for enhancing knowledge of the horizontal structure of these storms and to aid the development and testing of the cloud and precipitation aspects of limited area numerical models of cyclonic storms is investigated.

  12. Methods for calculation of engineering parameters for gas separation. [vapor pressure and solubility of gases in organic liquids

    NASA Technical Reports Server (NTRS)

    Lawson, D. D.

    1979-01-01

    A group additivity method is generated which allows estimation, from the structural formulas alone, of the energy of vaporization and the molar volume at 25 C of many nonpolar organic liquids. Using these two parameters and appropriate thermodynamic relations, the vapor pressure of the liquid phase and the solubility of various gases in nonpolar organic liquids are predicted. It is also possible to use the data to evaluate organic and some inorganic liquids for use in gas separation stages or liquids as heat exchange fluids in prospective thermochemical cycles for hydrogen production.

  13. Mean-field calculation of critical parameters and log-periodic characterization of an aperiodic-modulated model.

    PubMed

    Oliveira, T P; Branco, N S

    2012-01-01

    We employ a mean-field approximation to study the Ising model with aperiodic modulation of its interactions in one spatial direction. Two different values for the exchange constant, J(A) and J(B), are present, according to the Fibonacci sequence. We calculate the pseudocritical temperatures for finite systems and extrapolate them to the thermodynamic limit. We explicitly obtain the exponents β, δ, and γ and, from the usual scaling relations for anisotropic models at the upper critical dimension (assumed to be 4 for the model we treat), we calculate α, ν, ν(∥), η, and η(∥). Within the framework of a renormalization-group approach, the Fibonacci sequence is a marginal one and we obtain exponents that depend on the ratio r≡J(B)/J(A), as expected; however, the scaling relation γ=β(δ-1) is obeyed for all values of r we studied. We characterize some thermodynamic functions as log-periodic functions of their arguments, as expected for aperiodic-modulated models, and obtain precise values for the exponents from this characterization.

  14. MEMS 3-DoF gyroscope design, modeling and simulation through equivalent circuit lumped parameter model

    NASA Astrophysics Data System (ADS)

    Mian, Muhammad Umer; Dennis, John Ojur; Khir, M. H. Md.; Riaz, Kashif; Iqbal, Abid; Bazaz, Shafaat A.; Tang, T. B.

    2015-07-01

    Pre-fabrication, behavioural and performance analysis with computer aided design (CAD) tools is a common and fabrication cost effective practice. In light of this we present a simulation methodology for a dual-mass oscillator based 3 Degree of Freedom (3-DoF) MEMS gyroscope. 3-DoF Gyroscope is modeled through lumped parameter models using equivalent circuit elements. These equivalent circuits consist of elementary components which are counterpart of their respective mechanical components, used to design and fabricate 3-DoF MEMS gyroscope. Complete designing of equivalent circuit model, mathematical modeling and simulation are being presented in this paper. Behaviors of the equivalent lumped models derived for the proposed device design are simulated in MEMSPRO T-SPICE software. Simulations are carried out with the design specifications following design rules of the MetalMUMPS fabrication process. Drive mass resonant frequencies simulated by this technique are 1.59 kHz and 2.05 kHz respectively, which are close to the resonant frequencies found by the analytical formulation of the gyroscope. The lumped equivalent circuit modeling technique proved to be a time efficient modeling technique for the analysis of complex MEMS devices like 3-DoF gyroscopes. The technique proves to be an alternative approach to the complex and time consuming couple field analysis Finite Element Analysis (FEA) previously used.

  15. MEMS 3-DoF gyroscope design, modeling and simulation through equivalent circuit lumped parameter model

    SciTech Connect

    Mian, Muhammad Umer Khir, M. H. Md.; Tang, T. B.; Dennis, John Ojur; Riaz, Kashif; Iqbal, Abid; Bazaz, Shafaat A.

    2015-07-22

    Pre-fabrication, behavioural and performance analysis with computer aided design (CAD) tools is a common and fabrication cost effective practice. In light of this we present a simulation methodology for a dual-mass oscillator based 3 Degree of Freedom (3-DoF) MEMS gyroscope. 3-DoF Gyroscope is modeled through lumped parameter models using equivalent circuit elements. These equivalent circuits consist of elementary components which are counterpart of their respective mechanical components, used to design and fabricate 3-DoF MEMS gyroscope. Complete designing of equivalent circuit model, mathematical modeling and simulation are being presented in this paper. Behaviors of the equivalent lumped models derived for the proposed device design are simulated in MEMSPRO T-SPICE software. Simulations are carried out with the design specifications following design rules of the MetalMUMPS fabrication process. Drive mass resonant frequencies simulated by this technique are 1.59 kHz and 2.05 kHz respectively, which are close to the resonant frequencies found by the analytical formulation of the gyroscope. The lumped equivalent circuit modeling technique proved to be a time efficient modeling technique for the analysis of complex MEMS devices like 3-DoF gyroscopes. The technique proves to be an alternative approach to the complex and time consuming couple field analysis Finite Element Analysis (FEA) previously used.

  16. International Conference on Quantum Chemical Calculations of NMR and EPR Parameters Held in Castle Smolenice, Slovak Republic on September 14-18 1998

    DTIC Science & Technology

    1998-10-21

    Density functional calculations of ESR parameters in the zero order regular approximation for relativis- tic effects Erik van Lenthe, Paul E.S. Wormer...which facilitates structural studies of 4anhydrothymidines REFERENCES 1. V. G. Malkin, 0. L. Malkina, L. A. Erikson , and R. D. Salahub, In Density...1332 Fax: +46-13-132-285 FAX: +358-8-553-1287 vahtras@ifm.liu.se jvaara@sun3.oulu.fi Erik van Lenthe Veronique van Speybroeck Scheikundig Laboratorium

  17. Calculation set for design and optimization of vegetative soil covers Sandia National Laboratories, Albuquerque, New Mexico.

    SciTech Connect

    Peace, Gerald L.; Goering, Timothy James (GRAM, Inc., Albuquerque, NM)

    2005-02-01

    This study demonstrates that containment of municipal and hazardous waste in arid and semiarid environments can be accomplished effectively without traditional, synthetic materials and complex, multi-layer systems. This research demonstrates that closure covers combining layers of natural soil, native plant species, and climatic conditions to form a sustainable, functioning ecosystem will meet the technical equivalency criteria prescribed by the U. S. Environmental Protection Agency. In this study, percolation through a natural analogue and an engineered cover is simulated using the one-dimensional, numerical code UNSAT-H. UNSAT-H is a Richards. equation-based model that simulates soil water infiltration, unsaturated flow, redistribution, evaporation, plant transpiration, and deep percolation. This study incorporates conservative, site-specific soil hydraulic and vegetation parameters. Historical meteorological data are used to simulate percolation through the natural analogue and an engineered cover, with and without vegetation. This study indicates that a 3-foot (ft) cover in arid and semiarid environments is the minimum design thickness necessary to meet the U. S. Environmental Protection Agency-prescribed technical equivalency criteria of 31.5 millimeters/year and 1 x 10{sup -7} centimeters/second for net annual percolation and average flux, respectively. Increasing cover thickness to 4 or 5 ft results in limited additional improvement in cover performance.

  18. Design and parameter estimation of hybrid magnetic bearings for blood pump applications

    NASA Astrophysics Data System (ADS)

    Lim, Tau Meng; Zhang, Dongsheng; Yang, Juanjuan; Cheng, Shanbao; Low, Sze Hsien; Chua, Leok Poh; Wu, Xiaowei

    2009-10-01

    This paper discusses the design and parameter estimation of the dynamics characteristics of a high-speed hybrid magnetic bearings (HMBs) system for axial flow blood pump applications. The rotor/impeller of the pump is driven by a three-phase permanent magnet (PM) brushless and sensorless DC motor. It is levitated by two HMBs at both ends in five-degree-of-freedom with proportional-integral-derivative (PID) controllers; among which four radial directions are actively controlled and one axial direction is passively controlled. Test results show that the rotor can be stably supported to speeds of 14,000 rpm. The frequency domain parameter estimation technique with statistical analysis is adopted to validate the stiffness and damping coefficients of the HMBs system. A specially designed test rig facilitated the estimation of the bearing's coefficients in air—in both the radial and axial directions. The radial stiffness of the HMBs is compared to the Ansoft's Maxwell 2D/3D finite element magnetostatic results. Experimental estimation showed that the dynamics characteristics of the HMBs system are dominated by the frequency-dependent stiffness coefficients. The actuator gain was also successfully calibrated and may potentially extend the parameter estimation technique developed in the study of identification and monitoring of the pump's dynamics properties under normal operating conditions with fluid.

  19. Estimating Cosmic-Ray Spectral Parameters from Simulated Detector Responses with Detector Design Implications

    NASA Technical Reports Server (NTRS)

    Howell, L. W.

    2001-01-01

    A simple power law model consisting of a single spectral index (alpha-1) is believed to be an adequate description of the galactic cosmic-ray (GCR) proton flux at energies below 10(exp 13) eV, with a transition at knee energy (E(sub k)) to a steeper spectral index alpha-2 > alpha-1 above E(sub k). The maximum likelihood procedure is developed for estimating these three spectral parameters of the broken power law energy spectrum from simulated detector responses. These estimates and their surrounding statistical uncertainty are being used to derive the requirements in energy resolution, calorimeter size, and energy response of a proposed sampling calorimeter for the Advanced Cosmic-ray Composition Experiment for the Space Station (ACCESS). This study thereby permits instrument developers to make important trade studies in design parameters as a function of the science objectives, which is particularly important for space-based detectors where physical parameters, such as dimension and weight, impose rigorous practical limits to the design envelope.

  20. Calculation of spectroscopic constants and radiative parameters for the A 1Σ+- X 1Σ+ electronic transitions of the CsLi and CsRb molecules

    NASA Astrophysics Data System (ADS)

    Smirnov, A. D.

    2016-12-01

    Vibrational, rotational, and centrifugal spectroscopic constants; radiative parameters (the Einstein coefficients for spontaneous emission, the oscillator strengths for absorption, and the Franck-Condon factors), the r v' v″-centroids; the wavenumbers of rotational lines of rovibronic transitions in the systems of bands A 1Σ+- X 1Σ+ of CsLi (0 ≤ v' ≤ 25, 0 ≤ v″ ≤ 51, j = 0, 30, 50, 70, 100) and CsRb (0 ≤ v' ≤ 30, 0 ≤ v″ ≤ 64, j = 0, 50, 100) molecules; and the radiative lifetimes for excited electronic states are calculated. The calculations are carried out on the basis of semiempirical potential curves constructed in this work. The calculated spectroscopic constants are compared with the experimental data. The lifetimes have been obtained for the first time.

  1. Use of different parameters and equations for calculation of IC₅₀ values in efflux assays: potential sources of variability in IC₅₀ determination.

    PubMed

    Volpe, Donna A; Hamed, Salaheldin S; Zhang, Lei K

    2014-01-01

    Drug interactions due to efflux transporters may result in one drug increasing or decreasing the systemic exposure of a second drug. The potential for in vivo drug interactions is estimated through in vitro cell assays. Variability in in vitro parameter determination (e.g., IC₅₀ values) among laboratories may lead to different conclusions in in vivo interaction predictions. The objective of this study was to investigate variability in in vitro inhibition potency determination that may be due to calculation methods. In a Caco-2 cell assay, the absorptive and secretive permeability of digoxin was measured in the presence of spironolactone, itraconazole and vardenafil. From the permeability data, the efflux ratio and net secretory flux where calculated for each inhibitor. IC₅₀ values were then calculated using a variety of equations and software programs. All three drugs decreased the secretory transport of digoxin in a concentration-dependent manner while increasing digoxin's absorption to a lesser extent. The resulting IC₅₀ values varied according to the parameter evaluated, whether percent inhibition or percent control was applied, and the computational IC₅₀ equation. This study has shown that multiple methods used to quantitate the inhibition of drug efflux in a cell assay can result in different IC₅₀ values. The variability in the results in this study points to a need to standardize any transporter assay and calculation methods within a laboratory and to validate the assay with a set of known inhibitors and non-inhibitors against a clinically relevant substrate.

  2. Measurement and calculation of the Stark-broadening parameters for the resonance lines of singly ionized calcium and magnesium.

    NASA Technical Reports Server (NTRS)

    Jones, W. W.; Sanchez, A.; Greig, J. R.; Griem, H. R.

    1972-01-01

    The electron-impact-broadened profiles of the resonance lines of singly ionized calcium and magnesium have been measured using an electromagnetically driven shock tube and a rapid-scanning Fabry-Perot spectrometer. For an electron density of 10 to the 17th power per cu cm and a temperature of 19,000 K, we found the Lorentzian half-width of the Ca+ line to be 0.086 A plus or minus 10% and of the Mg+ line to be 0.044 A plus or minus 10%. Using the quantum-mechanical theory of Barnes and Peach and our semiclassical calculation for the calcium lines, we found that the temperature dependence of the theoretical curves is close to that measured, although both theories predict actual values which are somewhat large.

  3. An improved algorithm for automatic detection of saccades in eye movement data and for calculating saccade parameters.

    PubMed

    Behrens, F; Mackeben, M; Schröder-Preikschat, W

    2010-08-01

    This analysis of time series of eye movements is a saccade-detection algorithm that is based on an earlier algorithm. It achieves substantial improvements by using an adaptive-threshold model instead of fixed thresholds and using the eye-movement acceleration signal. This has four advantages: (1) Adaptive thresholds are calculated automatically from the preceding acceleration data for detecting the beginning of a saccade, and thresholds are modified during the saccade. (2) The monotonicity of the position signal during the saccade, together with the acceleration with respect to the thresholds, is used to reliably determine the end of the saccade. (3) This allows differentiation between saccades following the main-sequence and non-main-sequence saccades. (4) Artifacts of various kinds can be detected and eliminated. The algorithm is demonstrated by applying it to human eye movement data (obtained by EOG) recorded during driving a car. A second demonstration of the algorithm detects microsleep episodes in eye movement data.

  4. The CO2 laser parameter optimization design and practical verification for a touch panel conductive film

    NASA Astrophysics Data System (ADS)

    Jeffrey Kuo, Chung-Feng; Chiu, Hsuan-Yen; Syu, Sheng-Siang; Huy Vu, Quang

    2014-01-01

    This study investigated the touch panel conductive film processing quality by using a CO2 laser system. The processing material chooses ethylene terephthalate with a size of 10 cm×4 cm. Experimental results measuring the three characteristics included line width, heat-affected zone and bump height. It further analyzed the relationship between the control parameters of a CO2 laser cutting system and the quality characteristics. First, the orthogonal array in the Taguchi Method was applied to plan the experiment. The signal noise ratio (S/N) of the quality characteristics was calculated according to data obtained from the experiments. Second, data were pre-processed using the gray relation method and the processed data showed a relationship between the control parameters and various quality characteristics. Next, the fuzzy inference system was applied to solve the multiple quality characteristics to determine the optimal solution and the combinations of the optimal multiple laser control parameters. Moreover, the Back-Propagation Neural Networks (BPNN) with the Levenberg-Marquardt algorithm was applied to construct a prediction system and simulate experimental results. Finally, the optimal solution was experimentally verified. The results showed that the prediction error rate was within 5%, proving that the proposed prediction system can effectively predict the laser processing of transparent conductive film.

  5. Evaluation of DOE radionuclide solubility data and selected retardation parameters: description of calculational and confirmatory experimental activities

    SciTech Connect

    Kelmers, A.D.; Clark, R.J.; Cutshall, N.H.; Johnson, J.S.; Kessler, J.H.

    1983-12-31

    An experimentally oriented program has been initiated to support the NRC analysis and licensing activities related to high-level nuclear waste repositories. The program will allow the NRC to independently confirm key geochemical values used in the site performance assessments submitted by the DOE candidate repository site projects. Key radionuclide retardation factor values, particularly radionuclide solubility and sorption values under site specific geochemical conditions, are being confirmed. The initial efforts are being directed toward basalt rock/groundwater systems relevant to the BWIP candidate site in the Pasco Basin. Future work will consider tuff (NNWSI candidate site in Yucca Mountain) and salt (unspecified ONWI bedded or domal salt sites) rock/groundwater systems. Initial experimental results with technetium have confirmed the BWIP values for basalt/groundwater systems under oxic redox conditions: high solubility and no sorption. Under reducing redox conditions, however, the experimental work did not confirm the proposed technetium values recommended by BWIP. In the presence of hydrazine to establish reducing conditions, an apparent solubility limit for technetium of about 5E-7 mol/L was encountered; BWIP recommended calculated values of 1E-12 or greater than or equal to 1E-14 mol/L. Experimental evidence concerning sorption of reduced technetium species is incomplete at this time. Equilibrium speciation and saturation indices were calculated for well water data sets from BWIP using the computer code PHREEQUE. Oversaturation was indicated for hematite and quartz in all data sets. Near surface samples were undersaturated with respect to calcite, but most deep samples were oversaturated with respect to calcite and other carbonate minerals.

  6. Design and operational parameters of a rooftop rainwater harvesting system: definition, sensitivity and verification.

    PubMed

    Mun, J S; Han, M Y

    2012-01-01

    The appropriate design and evaluation of a rainwater harvesting (RWH) system is necessary to improve system performance and the stability of the water supply. The main design parameters (DPs) of an RWH system are rainfall, catchment area, collection efficiency, tank volume and water demand. Its operational parameters (OPs) include rainwater use efficiency (RUE), water saving efficiency (WSE) and cycle number (CN). The sensitivity analysis of a rooftop RWH system's DPs to its OPs reveals that the ratio of tank volume to catchment area (V/A) for an RWH system in Seoul, South Korea is recommended between 0.03 and 0.08 in terms of rate of change in RUE. The appropriate design value of V/A is varied with D/A. The extra tank volume up to V/A of 0.15∼0.2 is also available, if necessary to secure more water. Accordingly, we should figure out suitable value or range of DPs based on the sensitivity analysis to optimize design of an RWH system or improve operation efficiency. The operational data employed in this study, which was carried out to validate the design and evaluation method of an RWH system, were obtained from the system in use at a dormitory complex at Seoul National University (SNU) in Korea. The results of these operational data are in good agreement with those used in the initial simulation. The proposed method and the results of this research will be useful in evaluating and comparing the performance of RWH systems. It is found that RUE can be increased by expanding the variety of rainwater uses, particularly in the high rainfall season.

  7. Study of design parameters affecting the motion of DNA for nanoinjection

    NASA Astrophysics Data System (ADS)

    David, Regis A.; Jensen, Brian D.; Black, Justin L.; Burnett, Sandra H.; Howell, Larry L.

    2012-05-01

    This paper reports the effects of various parameters on the attraction and repulsion of DNA to and from a silicon lance. An understanding of DNA motion is crucial for a new approach to insert DNA, or other foreign microscopic matter, into a living cell. The approach, called nanoinjection, uses electrical forces to attract and repel the desired substance to a micromachined lance designed to pierce the cell membranes. We have developed mathematical models to predict the trajectory of DNA. The mathematical model allows investigation of the attraction/repulsion process by varying specific parameters. We find that the ground electrode placement, lance orientation and lance penetration significantly affect attraction or repulsion efficiency, while the gap, lance direction, lance tip width, lance tip half-angle and lance tip height do not.

  8. Effect of turning parameters on A16351 T6 by using Design of Experiments

    NASA Astrophysics Data System (ADS)

    Annigeri, Ulhas K.; Charan, M.; Vishnu Sai, M.; Ram Charan, T.; Rahul Sai, L.

    2016-09-01

    Aluminium is a well known lightest engineering metals. It is the most productive element on the earth crust. It can be extracted from bauxite, kaolinite or nepheline. It can be used in making aeroplane bodies, automobile parts etc. It is mostly used in multiple applications in order to reduce the weight of the component and it has fancy corrosion resistance. In the present study Al 6351 T6 is selected and a plain turning operation is performed on it with the help of design of experiments. The surface roughness of the samples are tested by varying the cutting parameters such as speed, feed, and depth of cut. A mathematical model is developed and the parameter which affects the surface roughness is determined.

  9. Validation of updated neutronic calculation models proposed for Atucha-II PHWR. Part II: Benchmark comparisons of PUMA core parameters with MCNP5 and improvements due to a simple cell heterogeneity correction

    SciTech Connect

    Grant, C.; Mollerach, R.; Leszczynski, F.; Serra, O.; Marconi, J.; Fink, J.

    2006-07-01

    In 2005 the Argentine Government took the decision to complete the construction of the Atucha-II nuclear power plant, which has been progressing slowly during the last ten years. Atucha-II is a 745 MWe nuclear station moderated and cooled with heavy water, of German (Siemens) design located in Argentina. It has a pressure vessel design with 451 vertical coolant channels and the fuel assemblies (FA) are clusters of 37 natural UO{sub 2} rods with an active length of 530 cm. For the reactor physics area, a revision and update of reactor physics calculation methods and models was recently carried out covering cell, supercell (control rod) and core calculations. This paper presents benchmark comparisons of core parameters of a slightly idealized model of the Atucha-I core obtained with the PUMA reactor code with MCNP5. The Atucha-I core was selected because it is smaller, similar from a neutronic point of view, more symmetric than Atucha-II, and has some experimental data available. To validate the new models benchmark comparisons of k-effective, channel power and axial power distributions obtained with PUMA and MCNP5 have been performed. In addition, a simple cell heterogeneity correction recently introduced in PUMA is presented, which improves significantly the agreement of calculated channel powers with MCNP5. To complete the validation, the calculation of some of the critical configurations of the Atucha-I reactor measured during the experiments performed at first criticality is also presented. (authors)

  10. Parameter Design and Optimal Control of an Open Core Flywheel Energy Storage System

    NASA Technical Reports Server (NTRS)

    Pang, D.; Anand, D. K.; Kirk, J. A.

    1996-01-01

    In low earth orbit (LEO) satellite applications spacecraft power is provided by photovoltaic cells and batteries. To overcome battery shortcomings the University of Maryland, working in cooperation with NASA/GSFC and NASA/LeRC, has developed a magnetically suspended flywheel for energy storage applications. The system is referred to as an Open Core Composite Flywheel (OCCF) energy storage system. Successful application of flywheel energy storage requires integration of several technologies, viz. bearings, rotor design, motor/generator, power conditioning, and system control. In this paper we present a parameter design method which has been developed for analyzing the linear SISO model of the magnetic bearing controller for the OCCF. The objective of this continued research is to principally analyze the magnetic bearing system for nonlinear effects in order to increase the region of stability, as determined by high speed and large air gap control. This is achieved by four tasks: (1) physical modeling, design, prototyping, and testing of an improved magnetically suspended flywheel energy storage system, (2) identification of problems that limit performance and their corresponding solutions, (3) development of a design methodology for magnetic bearings, and (4) design of an optimal controller for future high speed applications. Both nonlinear SISO and MIMO models of the magnetic system were built to study limit cycle oscillations and power amplifier saturation phenomenon observed in experiments. The nonlinear models include the inductance of EM coils, the power amplifier saturation, and the physical limitation of the flywheel movement as discussed earlier. The control program EASY5 is used to study the nonlinear SISO and MIMO models. Our results have shown that the characteristics and frequency responses of the magnetic bearing system obtained from modeling are comparable to those obtained experimentally. Although magnetic saturation is shown in the bearings, there

  11. Multi-fields direct design approach in 3D: calculating a two-surface freeform lens with an entrance pupil for line imaging systems.

    PubMed

    Nie, Yunfeng; Thienpont, Hugo; Duerr, Fabian

    2015-12-28

    Including an entrance pupil in optical systems provides clear benefits for balancing the overall performance of freeform and/or rotationally symmetric imaging systems. Current existing direct design methods that are based on perfect imaging of few discrete ray bundles are not well suited for wide field of view systems. In this paper, a three-dimensional multi-fields direct design approach is proposed to balance the full field imaging performance of a two-surface freeform lens. The optical path lengths and image points of numerous fields are calculated during the procedures, wherefore very few initial parameters are needed in advance. Design examples of a barcode scanner lens as well as a line imaging objective are introduced to demonstrate the effectiveness of this method.

  12. Calculation of the Physical and Microdosimetric Parameters of Electron and Alpha-Particle Radiation Using Monte Carlo Simulations

    NASA Astrophysics Data System (ADS)

    Geng, Jin-Peng; Cao, Tian-Guang; Li, Duo-Fang; An, Hai-Long; Han, Ying-Rong; Li, Jin; Hu, Jin-Shan; Li, Nan-Nan; Zhan, Yong

    2014-03-01

    Various ionizing radiations, such as electrons and alpha particles, transfer their energy to media by produced secondary electrons and induce double- or single-strand break of DNA, which result in variable effects. To understand how the ionizing radiations interact with DNA and break it, several models have been developed, most of them consider the water as a vapor state. Actually, the ionizing particles interact with DNA which is solved in liquid water. To compare the difference of vapor and liquid water models, we calculate the stopping power, continuous slowing down approximation (CSDA) range and S value of electrons and alpha particles at cellular scale in liquid and vapor by Monte Carlo simulations, respectively. Our data show that the stopping power and CSDA range are different in liquid and vapor water in a special energy range. For many S values, the liquid model is better than the vapor model when the energy of the electrons is higher than 100 keV and the vapor model is higher than the liquid model for the 1 MeV alpha particles.

  13. Factors affecting the accuracy of near-infrared spectroscopy concentration calculations for focal changes in oxygenation parameters

    NASA Technical Reports Server (NTRS)

    Strangman, Gary; Franceschini, Maria Angela; Boas, David A.; Sutton, J. P. (Principal Investigator)

    2003-01-01

    Near-infrared spectroscopy (NIRS) can be used to noninvasively measure changes in the concentrations of oxy- and deoxyhemoglobin in tissue. We have previously shown that while global changes can be reliably measured, focal changes can produce erroneous estimates of concentration changes (NeuroImage 13 (2001), 76). Here, we describe four separate sources for systematic error in the calculation of focal hemoglobin changes from NIRS data and use experimental methods and Monte Carlo simulations to examine the importance and mitigation methods of each. The sources of error are: (1). the absolute magnitudes and relative differences in pathlength factors as a function of wavelength, (2). the location and spatial extent of the absorption change with respect to the optical probe, (3). possible differences in the spatial distribution of hemoglobin species, and (4). the potential for simultaneous monitoring of multiple regions of activation. We found wavelength selection and optode placement to be important variables in minimizing such errors, and our findings indicate that appropriate experimental procedures could reduce each of these errors to a small fraction (<10%) of the observed concentration changes.

  14. A normalized wave number variation parameter for acoustic black hole design.

    PubMed

    Feurtado, Philip A; Conlon, Stephen C; Semperlotti, Fabio

    2014-08-01

    In recent years, the concept of the Acoustic Black Hole has been developed as an efficient passive, lightweight absorber of bending waves in plates and beams. Theory predicts greater absorption for a higher thickness taper power. However, a higher taper power also increases the violation of an underlying theory smoothness assumption. This paper explores the effects of high taper power on the reflection coefficient and spatial change in wave number and discusses the normalized wave number variation as a spatial design parameter for performance, assessment, and optimization.

  15. Effect of design and process parameters on nip width of soft calendering

    NASA Astrophysics Data System (ADS)

    Kanth, Neel; Ray, A. K.; Dang, Riti

    2016-07-01

    Calendering is a well-known operation in which a material is run between rolls to thin it into sheets or to produce smooth or glossy finish. An attempt has been made in this investigation to remove the drawbacks in the model of Meijers and applicable directly to soft calendering, also to make nip mechanics model generalized and applicable, so that it can be applicable where there is roll to roll or roll to plate contact. Also, the effect of various design and process parameters on results of soft calendering has been discussed using the data taken from paper industry.

  16. Proposition of group molar constants for sodium to calculate the partial solubility parameters of sodium salts using the van Krevelen group contribution method.

    PubMed

    Barra, J; Peña, M A; Bustamante, P

    2000-04-01

    The aim of this study is to propose, for the first time, a set of group molar constants for sodium to calculate the partial solubility parameters of sodium salts. The values were estimated using the few experimental partial solubility parameters of acid/sodium salt series available either from the literature (benzoic acid/Na, ibuprofen acid/Na, diclofenac Na) or determined in this work (salicylic acid/Na, p-aminobenzoic acid/Na, diclofenac), the group contribution method of van Krevelen to calculate the partial parameters of the acids, and three reasonable hypothesis. The experimental method used is a modification of the extended Hansen approach based on a regression analysis of the solubility mole fraction of the drug lnX(2) against models including three- or four-partial solubility parameters of a series of pure solvents ranging from non-polar (heptane) to highly polar (water). The modified method combined with the four-parameter model provided the best results for both acids and sodium derivatives. The replacement of the acidic proton by sodium increased the dipolar and basic partial solubility parameters, whereas the dispersion parameter remained unaltered, thus increasing the overall total solubility parameter of the salt. The proposed group molar constants of sodium are consistent with the experimental results as sodium has a relatively low London dispersion molar constant (identical to that of -OH), a very high Keesom dipolar molar constant (identical to that of -NO(2), two times larger than that of -OH), and a very high hydrogen bonding molar constant (identical to that of -OH). The proposed values are: F((Na)d)=270 (J cm(3))(1/2) mol(-1); F((Na)p)=1030 (J cm(3))(1/2) mol(-1); U((Na)h)=17000 J mol(-1). Like the constants for the other groups, the group molar constants proposed for sodium are certainly not the exact values. However, they are believed to be a fair approximation of the impact of sodium on the partial solubility parameters and, therefore, can

  17. Intramolecular exchange energy transfer in a bridged bimetallic transition metal complex: Calculation of rate constants using emission spectral fitting parameters

    SciTech Connect

    Liang, Y.Y.; Baba, A.I.; Kim, W.Y.; Schmehl, R.H.; Atherton, S.J.

    1996-11-21

    The photophysical behavior of the transition metal complexes [[(bpy){sub 2}Ru]{sub 2}(bphb)](PF{sub 6}){sub 4}, [[(tpy)(CN)Ru]{sub 2}(bhpb)](PF{sub 6}){sub 2} and [(bpy){sub 2}Ru(bhpb)Ru(tpy)(CN)](PF{sub 6}){sub 4} (bpy = 2,2`-bipyridine, typ = 2,2`,6`,2{double_prime}-terpyridine, bphb = 1,4-bis(2,2`-bipyrid-4-yl)benzene) was investigated in acetonitrile solution and low-temperature glasses. Luminescence spectra, excitation spectra, and transient absorption decays of the three complexes serve to show that intermolecular electronic energy transfer from the MLCT excited state of the [(bpy){sub 2}Ru(bphb)] chromophore to the MLCT state of the tpy-containing chromophore occurs in the unsymmetric bimetallic complex. Nearly complete energy transfer from the [(bpy){sub 2}Ru(bphb)] chromophore to the tpy-containing chromophore was observed even in 4:1 ethanol: methanol glasses at 20K. A semiclassical exchange energy transfer mechanism was used to treat the available data; the Franck-Condon weighted density of state (FCWD) was obtained using parameters determined from fits of luminescence spectra. Give the FCWD at room temperature and the experimental rate constant, an electronic coupling matrix element of approximately 60 cm{sup -1} was determined for this system. 34 refs., 5 figs., 3 tabs.

  18. Calculation of the Electronic Parameters of an Al/DNA/p-Si Schottky Barrier Diode Influenced by Alpha Radiation

    PubMed Central

    Al-Ta’ii, Hassan Maktuff Jaber; Amin, Yusoff Mohd; Periasamy, Vengadesh

    2015-01-01

    Many types of materials such as inorganic semiconductors have been employed as detectors for nuclear radiation, the importance of which has increased significantly due to recent nuclear catastrophes. Despite the many advantages of this type of materials, the ability to measure direct cellular or biological responses to radiation might improve detector sensitivity. In this context, semiconducting organic materials such as deoxyribonucleic acid or DNA have been studied in recent years. This was established by studying the varying electronic properties of DNA-metal or semiconductor junctions when exposed to radiation. In this work, we investigated the electronics of aluminium (Al)/DNA/silicon (Si) rectifying junctions using their current-voltage (I-V) characteristics when exposed to alpha radiation. Diode parameters such as ideality factor, barrier height and series resistance were determined for different irradiation times. The observed results show significant changes with exposure time or total dosage received. An increased deviation from ideal diode conditions (7.2 to 18.0) was observed when they were bombarded with alpha particles for up to 40 min. Using the conventional technique, barrier height values were observed to generally increase after 2, 6, 10, 20 and 30 min of radiation. The same trend was seen in the values of the series resistance (0.5889–1.423 Ω for 2–8 min). These changes in the electronic properties of the DNA/Si junctions could therefore be utilized in the construction of sensitive alpha particle detectors. PMID:25730484

  19. Optimization of design and operating parameters of a space-based optical-electronic system with a distributed aperture.

    PubMed

    Tcherniavski, Iouri; Kahrizi, Mojtaba

    2008-11-20

    Using a gradient optimization method with objective functions formulated in terms of a signal-to-noise ratio (SNR) calculated at given values of the prescribed spatial ground resolution, optimization problems of geometrical parameters of a distributed optical system and a charge-coupled device of a space-based optical-electronic system are solved for samples of the optical systems consisting of two and three annular subapertures. The modulation transfer function (MTF) of the distributed aperture is expressed in terms of an average MTF taking residual image alignment (IA) and optical path difference (OPD) errors into account. The results show optimal solutions of the optimization problems depending on diverse variable parameters. The information on the magnitudes of the SNR can be used to determine the number of the subapertures and their sizes, while the information on the SNR decrease depending on the IA and OPD errors can be useful in design of a beam combination control system to produce the necessary requirements to its accuracy on the basis of the permissible deterioration in the image quality.

  20. A sensitivity analysis of process design parameters, commodity prices and robustness on the economics of odour abatement technologies.

    PubMed

    Estrada, José M; Kraakman, N J R Bart; Lebrero, Raquel; Muñoz, Raúl

    2012-01-01

    The sensitivity of the economics of the five most commonly applied odour abatement technologies (biofiltration, biotrickling filtration, activated carbon adsorption, chemical scrubbing and a hybrid technology consisting of a biotrickling filter coupled with carbon adsorption) towards design parameters and commodity prices was evaluated. Besides, the influence of the geographical location on the Net Present Value calculated for a 20 years lifespan (NPV20) of each technology and its robustness towards typical process fluctuations and operational upsets were also assessed. This comparative analysis showed that biological techniques present lower operating costs (up to 6 times) and lower sensitivity than their physical/chemical counterparts, with the packing material being the key parameter affecting their operating costs (40-50% of the total operating costs). The use of recycled or partially treated water (e.g. secondary effluent in wastewater treatment plants) offers an opportunity to significantly reduce costs in biological techniques. Physical/chemical technologies present a high sensitivity towards H2S concentration, which is an important drawback due to the fluctuating nature of malodorous emissions. The geographical analysis evidenced high NPV20 variations around the world for all the technologies evaluated, but despite the differences in wage and price levels, biofiltration and biotrickling filtration are always the most cost-efficient alternatives (NPV20). When, in an economical evaluation, the robustness is as relevant as the overall costs (NPV20), the hybrid technology would move up next to BTF as the most preferred technologies.

  1. Response Surface Method for the Rapid Design of Process Parameters in Tube Hydroforming

    SciTech Connect

    Chebbah, M. S.; Hecini, M.; Naceur, H.; Belouettar, S.

    2007-05-17

    This paper deals with the optimization of tube hydroforming parameters in order reduce defects which may occur at the end of forming process such as necking and wrinkling. We propose a specific methodology based on the coupling between an inverse method for the rapid simulation of tube hydroforming process, and a Response Surface Method based on diffuse approximation. The response surfaces are built using Moving Least Squares approximations and constructed within a moving region of interest which moves across a predefined discrete grid of authorized experimental designs. An application of hydroforming of a bulge from aluminium alloy 6061-T6 tubing has been utilized to validate our methodology. The final design is validated with ABAQUS Explicit Dynamic commercial code.

  2. Optimizing Design Parameters for Sets of Concentric Tube Robots using Sampling-based Motion Planning.

    PubMed

    Baykal, Cenk; Torres, Luis G; Alterovitz, Ron

    2015-09-28

    Concentric tube robots are tentacle-like medical robots that can bend around anatomical obstacles to access hard-to-reach clinical targets. The component tubes of these robots can be swapped prior to performing a task in order to customize the robot's behavior and reachable workspace. Optimizing a robot's design by appropriately selecting tube parameters can improve the robot's effectiveness on a procedure-and patient-specific basis. In this paper, we present an algorithm that generates sets of concentric tube robot designs that can collectively maximize the reachable percentage of a given goal region in the human body. Our algorithm combines a search in the design space of a concentric tube robot using a global optimization method with a sampling-based motion planner in the robot's configuration space in order to find sets of designs that enable motions to goal regions while avoiding contact with anatomical obstacles. We demonstrate the effectiveness of our algorithm in a simulated scenario based on lung anatomy.

  3. Optimizing Design Parameters for Sets of Concentric Tube Robots using Sampling-based Motion Planning

    PubMed Central

    Baykal, Cenk; Torres, Luis G.; Alterovitz, Ron

    2015-01-01

    Concentric tube robots are tentacle-like medical robots that can bend around anatomical obstacles to access hard-to-reach clinical targets. The component tubes of these robots can be swapped prior to performing a task in order to customize the robot’s behavior and reachable workspace. Optimizing a robot’s design by appropriately selecting tube parameters can improve the robot’s effectiveness on a procedure-and patient-specific basis. In this paper, we present an algorithm that generates sets of concentric tube robot designs that can collectively maximize the reachable percentage of a given goal region in the human body. Our algorithm combines a search in the design space of a concentric tube robot using a global optimization method with a sampling-based motion planner in the robot’s configuration space in order to find sets of designs that enable motions to goal regions while avoiding contact with anatomical obstacles. We demonstrate the effectiveness of our algorithm in a simulated scenario based on lung anatomy. PMID:26951790

  4. Entrance window design parameters for high-pressure gas x-ray imaging detectors.

    PubMed

    Jordan, L M; Dibianca, F A

    1995-01-01

    Gas ionization x-ray detectors operating at pressures up to 100 atm offer inherently high spatial and contrast resolution. However, incorporating the detector x-ray entrance window in a conventional pressure vessel designed for such pressures can result in high primary beam loss in the window and a much reduced overall detective quantum efficiency. The design of a gas chamber cover plate for a strip beam detector which mechanically isolates the x-ray entrance window from the lateral tensile stresses in the chamber body is described. A number of test windows of this design, varying in three geometric parameters-thickness, window curvature, and fillet radius-were fabricated from wrought aluminum [6061-T651 ] and subjected to pressures of up to 400 atm for the purpose of selecting an optimum window for a prototype digital x-ray imaging detector. The experimental data indicate that windows can be designed for a detector admitting a 1.0 cm wide x-ray beam that have rupture pressures exceeding 500 atm while maintaining x-ray transmittances of as much as 93.4% for a 120 kVp tungsten anode spectrum.

  5. Conceptual Design Parameters for HFIR LEU U-Mo Fuel Conversion Experimental Irradiations

    SciTech Connect

    Renfro, David G; Cook, David Howard; Chandler, David; Ilas, Germina; Jain, Prashant K

    2013-03-01

    The High Flux Isotope Reactor (HFIR) is a versatile research reactor that is operated at the Oak Ridge National Laboratory (ORNL). The HFIR core is loaded with high-enriched uranium (HEU) and operates at a power level of 85 MW. The primary scientific missions of the HFIR include cold and thermal neutron scattering, materials irradiation, and isotope production. An engineering design study of the conversion of the HFIR from HEU to low-enriched uranium (LEU) fuel is ongoing at the Oak Ridge National Laboratory. The LEU fuel considered is based on a uranium-molybdenum alloy that is 10 percent by weight molybdenum (U-10Mo) with a 235U enrichment of 19.75 wt %. The LEU core design discussed in this report is based on the design documented in ORNL/TM-2010/318. Much of the data reported in Sections 1 and 2 of this document was derived from or taken directly out of ORNL/TM-2010/318. The purpose of this report is to document the design parameters for and the anticipated normal operating conditions of the conceptual HFIR LEU fuel to aid in developing requirements for HFIR irradiation experiments.

  6. Calculating the parameters of self-oscillations in the vertical combustion chamber of the blast-furnace air heater during unstable combustion

    NASA Astrophysics Data System (ADS)

    Basok, B. I.; Gotsulenko, V. V.

    2015-01-01

    A procedure for simplified calculation of the parameters of self-oscillations excited during unstable (vibrating) combustion in the vertical combustion chambers of blast-furnace air heaters is developed. The proposed procedure is based on an independent nonlinear dynamic system similar to the equations from the theory of a blade supercharger stalling and surging mode. The head characteristic considered in the blade supercharger stalling and surging theory determines the part of the supercharger drive rotation energy that is converted into the head developed by the supercharger. In the considered system, the supercharger head characteristic is replaced by the combustion chamber head characteristic. Being a function of flow rate, this characteristic describes the part of heat supplied to flow that is converted to the flow head. Unlike the supercharger head characteristic, which is determined by experiment, the combustion chamber head characteristic is determined by calculation, due to which it becomes much easier to calculate the parameters of self-oscillations according to the proposed procedure. In particular, an analysis of the periodic solutions of the obtained dynamic system made it possible to determine the pattern in which the amplitude of considered self-oscillations depends on the surge impedance of the vertical combustion chamber.

  7. A new LPV modeling approach using PCA-based parameter set mapping to design a PSS.

    PubMed

    Jabali, Mohammad B Abolhasani; Kazemi, Mohammad H

    2017-01-01

    This paper presents a new methodology for the modeling and control of power systems based on an uncertain polytopic linear parameter-varying (LPV) approach using parameter set mapping with principle component analysis (PCA). An LPV representation of the power system dynamics is generated by linearization of its differential-algebraic equations about the transient operating points for some given specific faults containing the system nonlinear properties. The time response of the output signal in the transient state plays the role of the scheduling signal that is used to construct the LPV model. A set of sample points of the dynamic response is formed to generate an initial LPV model. PCA-based parameter set mapping is used to reduce the number of models and generate a reduced LPV model. This model is used to design a robust pole placement controller to assign the poles of the power system in a linear matrix inequality (LMI) region, such that the response of the power system has a proper damping ratio for all of the different oscillation modes. The proposed scheme is applied to controller synthesis of a power system stabilizer, and its performance is compared with a tuned standard conventional PSS using nonlinear simulation of a multi-machine power network. The results under various conditions show the robust performance of the proposed controller.

  8. Design parameters for a biomass harvester for short-rotation, hardwood stands

    SciTech Connect

    Gibson, H.G.; Pope, P.E.

    1984-01-01

    Design parameters were developed from field tests and mathematical simulations methods. Serving methods, tyres versus tracks, and compaction were evaluated from field tests. Power, weight, tractive effort and speed requirements were determined from simulation methods. Method of harvest (sawing or shearing) had no significant influence on coppice DM production of individual stumps. However, shearing of the 1 x 1 and 0.5 x 1 m spacing produced more DM from sprouts than shearing at other spacings or sawing at any spacing. Tracked vehicles caused more stump damage than rubber-tyred vehicles for both species tested. Productivity of the stumps was inversely related to stump damage, though productivity significantly declined only for stumps assessed as being heavily damaged. Succeeding passes of the pneumatic tyred tractor over randomized subplots resulted in increased soil strength and density down to 15.2 cm. Compaction did not affect the number of sprouts produced at 0, 2, 6, or 10 passes but did significantly reduce sprout height at 6 and 10 passes. Using an optimization technique, an analysis was made to determine parameters for the design of the harvester. 12 references.

  9. Robust control design with real parameter uncertainty using absolute stability theory. Ph.D. Thesis

    NASA Technical Reports Server (NTRS)

    How, Jonathan P.; Hall, Steven R.

    1993-01-01

    The purpose of this thesis is to investigate an extension of mu theory for robust control design by considering systems with linear and nonlinear real parameter uncertainties. In the process, explicit connections are made between mixed mu and absolute stability theory. In particular, it is shown that the upper bounds for mixed mu are a generalization of results from absolute stability theory. Both state space and frequency domain criteria are developed for several nonlinearities and stability multipliers using the wealth of literature on absolute stability theory and the concepts of supply rates and storage functions. The state space conditions are expressed in terms of Riccati equations and parameter-dependent Lyapunov functions. For controller synthesis, these stability conditions are used to form an overbound of the H2 performance objective. A geometric interpretation of the equivalent frequency domain criteria in terms of off-axis circles clarifies the important role of the multiplier and shows that both the magnitude and phase of the uncertainty are considered. A numerical algorithm is developed to design robust controllers that minimize the bound on an H2 cost functional and satisfy an analysis test based on the Popov stability multiplier. The controller and multiplier coefficients are optimized simultaneously, which avoids the iteration and curve-fitting procedures required by the D-K procedure of mu synthesis. Several benchmark problems and experiments on the Middeck Active Control Experiment at M.I.T. demonstrate that these controllers achieve good robust performance and guaranteed stability bounds.

  10. Electron work function–a promising guiding parameter for material design

    PubMed Central

    Lu, Hao; Liu, Ziran; Yan, Xianguo; Li, Dongyang; Parent, Leo; Tian, Harry

    2016-01-01

    Using nickel added X70 steel as a sample material, we demonstrate that electron work function (EWF), which largely reflects the electron behavior of materials, could be used as a guide parameter for material modification or design. Adding Ni having a higher electron work function to X70 steel brings more “free” electrons to the steel, leading to increased overall work function, accompanied with enhanced e−–nuclei interactions or higher atomic bond strength. Young’s modulus and hardness increase correspondingly. However, the free electron density and work function decrease as the Ni content is continuously increased, accompanied with the formation of a second phase, FeNi3, which is softer with a lower work function. The decrease in the overall work function corresponds to deterioration of the mechanical strength of the steel. It is expected that EWF, a simple but fundamental parameter, may lead to new methodologies or supplementary approaches for metallic materials design or tailoring on a feasible electronic base. PMID:27074974

  11. A computer program for enzyme kinetics that combines model discrimination, parameter refinement and sequential experimental design.

    PubMed Central

    Franco, R; Gavaldà, M T; Canela, E I

    1986-01-01

    A method of model discrimination and parameter estimation in enzyme kinetics is proposed. The experimental design and analysis of the model are carried out simultaneously and the stopping rule for experimentation is deduced by the experimenter when the probabilities a posteriori indicate that one model is clearly superior to the rest. A FORTRAN77 program specifically developed for joint designs is given. The method is very powerful, as indicated by its usefulness in the discrimination between models. For example, it has been successfully applied to three cases of enzyme kinetics (a single-substrate Michaelian reaction with product inhibition, a single-substrate complex reaction and a two-substrate reaction). By using this method the most probable model and the estimates of the parameters can be obtained in one experimental session. The FORTRAN77 program is deposited as Supplementary Publication SUP 50134 (19 pages) at the British Library (Lending Division), Boston Spa, Wetherby, West Yorkshire LS23 7BQ, U.K., from whom copies can be obtained on the terms indicated in Biochem. J. (1986) 233, 5. PMID:3800965

  12. Optimal algorithm to improve the calculation accuracy of energy deposition for betavoltaic MEMS batteries design

    NASA Astrophysics Data System (ADS)

    Li, Sui-xian; Chen, Haiyang; Sun, Min; Cheng, Zaijun

    2009-11-01

    Aimed at improving the calculation accuracy when calculating the energy deposition of electrons traveling in solids, a method we call optimal subdivision number searching algorithm is proposed. When treating the energy deposition of electrons traveling in solids, large calculation errors are found, we are conscious of that it is the result of dividing and summing when calculating the integral. Based on the results of former research, we propose a further subdividing and summing method. For β particles with the energy in the entire spectrum span, the energy data is set only to be the integral multiple of keV, and the subdivision number is set to be from 1 to 30, then the energy deposition calculation error collections are obtained. Searching for the minimum error in the collections, we can obtain the corresponding energy and subdivision number pairs, as well as the optimal subdivision number. The method is carried out in four kinds of solid materials, Al, Si, Ni and Au to calculate energy deposition. The result shows that the calculation error is reduced by one order with the improved algorithm.

  13. A design for a relational database for the calculation and storage of greenhouse gas emissions.

    PubMed

    Newcomb, T M

    2001-10-01

    The Intergovernmental Panel on Climate Change (IPCC) has published guidelines for the development of national greenhouse gas-emissions inventories and recommendations for collecting data necessary to calculate greenhouse gas emissions. Many regional and local jurisdictions will be performing inventories of greenhouse gas emissions and estimating the benefits of mitigation strategies to reduce emissions. This article advocates the development of relational databases to calculate and store emissions estimates based on IPCC guidelines and quantities of precursors of greenhouse gases. Specific examples of tables and queries are used to illustrate calculation methods and formulae, the choice of database keys, and the choice of methods for joining tables to construct queries.

  14. The performance of a prototype device designed to evaluate general quality parameters of X-ray equipment

    NASA Astrophysics Data System (ADS)

    Murata, C. H.; Fernandes, D. C.; Lavínia, N. C.; Caldas, L. V. E.; Pires, S. R.; Medeiros, R. B.

    2014-02-01

    The performance of radiological equipment can be assessed using non-invasive methods and portable instruments that can analyze an X-ray beam with just one exposure. These instruments use either an ionization chamber or a state solid detector (SSD) to evaluate X-ray beam parameters. In Brazil, no such instruments are currently being manufactured; consequently, these instruments come at a higher cost to users due to importation taxes. Additionally, quality control tests are time consuming and impose a high workload on the X-ray tubes when evaluating their performance parameters. The assessment of some parameters, such as the half-value layer (HVL), requires several exposures; however, this can be reduced by using a SSD that requires only a single exposure. One such SSD uses photodiodes designed for high X-ray sensitivity without the use of scintillation crystals. This sensitivity allows one electron-hole pair to be created per 3.63 eV of incident energy, resulting in extremely high and stable quantum efficiencies. These silicon photodiodes operate by absorbing photons and generating a flow of current that is proportional to the incident power. The aim of this study was to show the response of the solid sensor PIN RD100A detector in a multifunctional X-ray analysis system that is designed to evaluate the average peak voltage (kVp), exposure time, and HVL of radiological equipment. For this purpose, a prototype board that uses four SSDs was developed to measure kVp, exposure time, and HVL using a single exposure. The reproducibility and accuracy of the results were compared to that of different X-ray beam analysis instruments. The kVp reproducibility and accuracy results were 2% and 3%, respectively; the exposure time reproducibility and accuracy results were 2% and 1%, respectively; and the HVL accuracy was ±2%. The prototype's methodology was able to calculate these parameters with appropriate reproducibility and accuracy. Therefore, the prototype can be considered

  15. Influence of newly designed monorail pressure sensor catheter on coronary diagnostic parameters: an in vitro study.

    PubMed

    Banerjee, Rupak K; Peelukhana, Srikara V; Goswami, Ishan

    2014-02-07

    The decision to perform intervention on a patient with coronary stenosis is often based on functional diagnostic parameters obtained from pressure and flow measurements using sensor-tipped guidewire at maximal vasodilation (hyperemia). Recently, a rapid exchange Monorail Pressure Sensor catheter of 0.022″ diameter (MPS22), with pressure sensor at distal end has been developed for improved assessment of stenosis severity. The hollow shaft of the MPS22 is designed to slide over any standard 0.014″ guidewire (G14). Hence, influence of MPS22 diameter on coronary diagnostic parameters needs investigation. An in vitro experiment was conducted to replicate physiologic flows in three representative area stenosis (AS): mild (64% AS), intermediate (80% AS), and severe (90% AS), for two arterial diameters, 3mm (N2; more common) and 2.5mm (N1). Influence of MPS22 on diagnostic parameters: fractional flow reserve (FFR) and pressure drop coefficient (CDP) was evaluated both at hyperemic and basal conditions, while comparing it with G14. The FFR values decreased for the MPS22 in comparison to G14, (Mild: 0.87 vs 0.88, Intermediate: 0.68 vs 0.73, Severe: 0.48 vs 0.56) and CDP values increased (Mild: 16 vs 14, Intermediate: 75 vs 56, Severe: 370 vs 182) for N2. Similar trend was observed in the case of N1. The FFR values were found to be well above (mild) and below (intermediate and severe) the diagnostic cut-off of 0.75. Therefore, MPS22 catheter can be used as a possible alternative to G14. Further, irrespective of the MPS22 or G14, basal FFR (FFRb) had overlapping ranges in close proximity for clinically relevant mild and intermediate stenoses that will lead to diagnostic uncertainty under both N1 and N2. However, CDPb had distinct ranges for different stenosis severities and could be a potential diagnostic parameter under basal conditions.

  16. The Calculation of Reliability from a Split-Plot Factorial Design

    ERIC Educational Resources Information Center

    Brennan, Robert L.

    1975-01-01

    Variance components from split-plot factorial design (SPF) were used to estimate reliability for schools and persons within schools. Reliability for persons within SPF and randomized block design (RB) schools were compared and reliability for SPF and RB design schools were compared. (Author/BJG)

  17. Synthesis of calculational methods for design and analysis of radiation shields for nuclear rocket systems

    NASA Technical Reports Server (NTRS)

    Capo, M. A.; Disney, R. K.; Jordan, T. A.; Soltesz, R. G.; Woodsum, H. C.

    1969-01-01

    Eight computer programs make up a nine volume synthesis containing two design methods for nuclear rocket radiation shields. The first design method is appropriate for parametric and preliminary studies, while the second accomplishes the verification of a final nuclear rocket reactor design.

  18. Effect of inflow cannula tip design on potential parameters of blood compatibility and thrombosis.

    PubMed

    Wong, Kai Chun; Büsen, Martin; Benzinger, Carrie; Gäng, René; Bezema, Mirko; Greatrex, Nicholas; Schmitz-Rode, Thomas; Steinseifer, Ulrich

    2014-09-01

    During ventricular assist device support, a cannula acts as a bridge between the native cardiovascular system and a foreign mechanical device. Cannula tip design strongly affects the function of the cannula and its potential for blood trauma. In this study, the flow fields of five different tip geometries within the ventricle were evaluated using stereo particle image velocimetry. Inflow cannulae with conventional tip geometries (blunt, blunt with four side ports, beveled with three side ports, and cage) and a custom-designed crown tip were interposed between a mixed-flow rotary blood pump and a compressible, translucent silicone left ventricle. The contractile function of the failing ventricle and hemodynamics were reproduced in a mock circulation loop. The rotary blood pump was interfaced with the ventricle and aorta and used to fully support the failing ventricle. Among these five tip geometries, high-shear volume ( γ ˙ ≥ 2778 / s , potential parameter of platelet activation) was found to be the greatest in the blunt tip. The cage tip was observed to have the highest low-shear volume and recirculation volume ( γ ˙ ≤ 100 / s and Vz  > 0, respectively; potential parameters of thrombus formation). The crown tip, together with conventional tip geometries with side ports (blunt with four side ports and beveled with three side ports) showed no significant difference in either high-shear volume or low-shear volume. However, recirculation volume was reduced significantly in the crown tip. Despite limited generalizability to clinical situations, these transient-state measurements supported the potential mitigation of complications by changing the design of conventional cannula tip geometries.

  19. Linear, position-sensitive x-ray detector used for real-time calculations of small-angle scattering parameters with submillisecond resolution

    SciTech Connect

    Borso, C.S.

    1984-01-01

    The advent of high-intensity X-ray synchrotron sources has made possible the measurement of fluctuations in small-angle scattering parameters from typical specimens on a submillisecond time scale in real-time. The fundamental design of any fast detector system optimized for such measurements will incorporate some type of solid state detector array capable of rapid encoding algorithms. A prototype with a self-scanning photodiode array has been designed and tested at beamline 1 to 4 at the Stanford Synchrotron Radiation Laboratory (SSRL), and the results indicate that the device will operate at speeds yielding submillisecond temporal resolution in real-time.

  20. Measurements and calculations of Ar-broadening and -shifting parameters of water vapor transitions of ν1+ν2+ν3 band

    NASA Astrophysics Data System (ADS)

    Petrova, T. M.; Solodov, A. M.; Solodov, A. A.; Starikov, V. I.

    2014-11-01

    The water vapor line broadening and shifting for 94 lines in the ν1+ν2+ν3 band induced by argon pressure are measured with Bruker IFS 125 HR FTIR spectrometer. The measurements were performed at room temperature, at the spectral resolution of 0.01 cm-1 and in a wide pressure range of Ar. The calculations of the broadening coefficients γ and δ were performed in the framework of the semi-classical method. The intermolecular potential was taken as the sum of pair potentials which, in turn, were modeled by the Lennard-Jones potentials. Optimal sets of potential parameters given the best discrepancy of measured broadening coefficients are found. The influence of the rotational dependence of an intermolecular potential and its repulsive part on the calculated coefficients γ and δ is discussed.

  1. Calculation of the aqueous thermodynamic properties of citric acid cycle intermediates and precursors and the estimation of high temperature and pressure equation of state parameters.

    PubMed

    Dalla-Betta, Peter; Schulte, Mitchell

    2009-06-22

    The citric acid cycle (CAC) is the central pathway of energy transfer for many organisms, and understanding the origin of this pathway may provide insight into the origins of metabolism. In order to assess the thermodynamics of this key pathway for microorganisms that inhabit a wide variety of environments, especially those found in high temperature environments, we have calculated the properties and parameters for the revised Helgeson-Kirkham-Flowers equation of state for the major components of the CAC. While a significant amount of data is not available for many of the constituents of this fundamental pathway, methods exist that allow estimation of these missing data.

  2. Conformational stability, structural parameters and vibrational assignment from variable temperature infrared spectra of krypton solutions and ab initio calculations of ethylisothiocyanate.

    PubMed

    Durig, James R; Zheng, Chao

    2007-11-01

    Variable temperature (-105 to -150 degrees C) studies of the infrared spectra (3500-400 cm(-1)) of ethylisothiocyanate, CH(3)CH(2)NCS, dissolved in liquid krypton have been recorded. Additionally the infrared spectra of the gas and solid have been re-investigated. These spectroscopic data indicate a single conformer in all physical states with a large number of molecules in the gas phase at ambient temperature in excited states of the CN torsional mode which has a very low barrier to conformational interchange. To aid in the analyses of the vibrational and rotational spectra, ab initio calculations have been carried out by the perturbation method to the second order (MP2) with valence and core electron correlation using a variety of basis sets up to 6-311+G(2df,2pd). With the smaller basis sets up to 6-311+G(d,p) and cc-PVDZ, the cis conformer is indicated as a transition state with all larger basis sets the cis conformer is the only stable form. The predicted energy difference from these calculations between the cis form and the higher energy trans conformer is about 125 cm(-1) which represents essentially the barrier to internal rotation of the NCS group (rotation around NC axis). Density functional theory calculation by the B3LYP method with the same basis sets predicts this barrier to be about 25 cm(-1). By utilizing the previously reported microwave rotational constants with the structural parameters predicted by the ab initio MP2(full)/6-311+G(d,p) calculations, adjusted r(0) structural parameters have been obtained for the cis form. The determined heavy atom parameters are: r(NC)=1.196(5), r(CS)=1.579(5), r(CN)=1.439(5), r(CC)=1.519(5)A for the distances and angles of angleCCN=112.1(5), angleCNC=146.2(5), angleNCS=174.0(5) degrees . The centrifugal distortion constants, dipole moments, conformational stability, vibrational frequencies, infrared intensities and Raman activities have been predicted from ab initio calculations and compared to experimental

  3. Planar air-bearing microgravity simulators: Review of applications, existing solutions and design parameters

    NASA Astrophysics Data System (ADS)

    Rybus, Tomasz; Seweryn, Karol

    2016-03-01

    All devices designed to be used in space must be thoroughly tested in relevant conditions. For several classes of devices the reduced gravity conditions are the key factor. In early stages of development and later due to financial reasons, the tests need to be done on Earth. However, in Earth conditions it is impossible to obtain a different gravity field independent on all linear and rotational spatial coordinates. Therefore, various test-bed systems are used, with their design driven by the device's specific needs. One of such test-beds are planar air-bearing microgravity simulators. In such an approach, the tested objects (e.g., manipulators intended for on-orbit operations or vehicles simulating satellites in a close formation flight) are mounted on planar air-bearings that allow almost frictionless motion on a flat surface, thus simulating microgravity conditions in two dimensions. In this paper we present a comprehensive review of research activities related to planar air-bearing microgravity simulators, demonstrating achievements of the most active research groups and describing newest trends and ideas, such as tests of landing gears for low-g bodies. Major design parameters of air-bearing test-beds are also reviewed and a list of notable existing test-beds is presented.

  4. Validation of updated neutronic calculation models proposed for Atucha-II PHWR. Part I: Benchmark comparisons of WIMS-D5 and DRAGON cell and control rod parameters with MCNP5

    SciTech Connect

    Mollerach, R.; Leszczynski, F.; Fink, J.

    2006-07-01

    In 2005 the Argentine Government took the decision to complete the construction of the Atucha-II nuclear power plant, which has been progressing slowly during the last ten years. Atucha-II is a 745 MWe nuclear station moderated and cooled with heavy water, of German (Siemens) design located in Argentina. It has a pressure-vessel design with 451 vertical coolant channels, and the fuel assemblies (FA) are clusters of 37 natural UO{sub 2} rods with an active length of 530 cm. For the reactor physics area, a revision and update calculation methods and models (cell, supercell and reactor) was recently carried out covering cell, supercell (control rod) and core calculations. As a validation of the new models some benchmark comparisons were done with Monte Carlo calculations with MCNP5. This paper presents comparisons of cell and supercell benchmark problems based on a slightly idealized model of the Atucha-I core obtained with the WIMS-D5 and DRAGON codes with MCNP5 results. The Atucha-I core was selected because it is smaller, similar from a neutronic point of view, and more symmetric than Atucha-II Cell parameters compared include cell k-infinity, relative power levels of the different rings of fuel rods, and some two-group macroscopic cross sections. Supercell comparisons include supercell k-infinity changes due to the control rods (tubes) of steel and hafnium. (authors)

  5. Research and Design of Thermophysical Gas-Liquid Mixture Parameters in Product Pipelines

    NASA Astrophysics Data System (ADS)

    Dudin, S. M.; Zemenkov, Yu D.; Maier, A. V.; Shabarov, A. B.

    2016-10-01

    Operational problems are hard to overcome because of the temperature and pressure conditions of the hydrocarbon flow in the pipe, as well as the composition of the hydrocarbon system and the geometry of the pipeline. It is known that energy costs to pump a unit mass of RH in the form of gas 2-3 times exceed energy costs to pump a unit mass of RH in the form of liquid. As far as energy conservation during RH transportation is concerned, an important task is development and application of a method to calculate the gas-liquid hydrocarbons flow, and heat and mass transfer in process and trunk pipelines during their design and operation. The authors have developed a calculation method which is used to analyze the hydrodynamic state and composition of the hydrocarbon mixture in each ith section of the pipeline when temperature-pressure and hydraulic conditions change. The developed technique was tested on the hydrocarbon mixture of de-ethanized condensate and oil transported from northern oil and gas condensate fields via the main gas condensate line to the refinery.

  6. Prosthesis-user-in-the-loop: user-centered design parameters and visual simulation.

    PubMed

    Christ, O; Wojtusch, J; Beckerle, P; Wolff, K; Vogt, J; von Stryk, O; Rinderknecht, S

    2012-01-01

    After an amputation, processes of change in the body image as well as a change in body scheme have direct influences on the quality of living in every patient. Within this paper, a paradigm of experimental induced body illusion (the Rubber Hand Illusion, RHI) is integrated in a prosthetic hardware simulator concept. This concept combines biodynamical and visual feedback to enhance the quality of rehabilitation and to integrate patients' needs into the development of prostheses aiming on user-centered solutions. Therefore, user-centered design parameters are deducted. Furthermore, the basic concept of the visual simulation is presented and a possibility for its implementation is given. Finally, issues and conclusions for future work are described.

  7. Dependence of charge multiplication on different design parameters of LGAD devices

    NASA Astrophysics Data System (ADS)

    Jain, G.; Dalal, R.; Bhardwaj, A.; Ranjan, K.

    2017-03-01

    The Low Gain Avalanche Detectors (LGADs) have the unique characteristic to provide amplification to the particle signal by using a controlled local avalanche mechanism. These devices are being explored by the HEP community because, while it is known that in standard silicon detectors the signal-to-noise ratio falls drastically with fluence, in LGAD devices this can be made sufficiently high to potentially overcome this problem. However, the existing irradiation studies show that at high fluences, the LGAD internal gain disappears and is no more significant. In this work, we have studied the effect of various design parameters of the LGAD device on its gain characteristic, at different irradiation levels. With the acquired understanding, we have also tried to tune the LGAD gain so to be suited for operation in a high radiation environment.

  8. Particle Shape: A New Design Parameter for Micro- and Nanoscale Drug Delivery Carriers

    PubMed Central

    Champion, Julie A.; Katare, Yogesh K.; Mitragotri, Samir

    2014-01-01

    Encapsulation of therapeutic agents in polymer particles has been successfully used in the development of new drug carriers. A number of design parameters that govern the functional behavior of carriers, including the choice of polymer, particle size and surface chemistry, have been tuned to optimize their performance in vivo. However, particle shape, which may also have a strong impact on carrier performance, has not been investigated. This is perhaps due to the limited availability of techniques to produce non-spherical polymer particles. In recent years, a number of reports have emerged to directly address this bottleneck and initial studies have indeed confirmed that particle shape can significantly impact the performance of polymer drug carriers. This article provides a review of this field with respect to methods of particle preparation and the role of particle shape in drug delivery. PMID:17544538

  9. Design and Performance Calculations of a Propeller for Very High Altitude Flight. Degree awarded by Case Western Univ.

    NASA Technical Reports Server (NTRS)

    Koch, L. Danielle

    1998-01-01

    Reported here is a design study of a propeller for a vehicle capable of subsonic flight in Earth's stratosphere. All propellers presented were required to absorb 63.4 kW (85 hp) at 25.9 km (85,000 ft) while aircraft cruise velocity was maintained at Mach 0.40. To produce the final design, classic momentum and blade-element theories were combined with two and three-dimensional results from the Advanced Ducted Propfan Analysis Code (ADPAC), a numerical Navier-Stokes analysis code. The Eppler 387 airfoil was used for each of the constant section propeller designs compared. Experimental data from the Langley Low-Turbulence Pressure Tunnel was used in the strip theory design and analysis programs written. The experimental data was also used to validate ADPAC at a Reynolds numbers of 60,000 and a Mach number of 0.20. Experimental and calculated surface pressure coefficients are compared for a range of angles of attack. Since low Reynolds number transonic experimental data was unavailable, ADPAC was used to generate two-dimensional section performance predictions for Reynolds numbers of 60,000 and 100,000 and Mach numbers ranging from 0.45 to 0.75. Surface pressure coefficients are presented for selected angles of attack. in addition to the variation of lift and drag coefficients at each flow condition. A three-dimensional model of the final design was made which ADPAC used to calculated propeller performance. ADPAC performance predictions were compared with strip-theory calculations at design point. Propeller efficiency predicted by ADPAC was within 1.5% of that calculated by strip theory methods, although ADPAC predictions of thrust, power, and torque coefficients were approximately 5% lower than the strip theory results. Simplifying assumptions made in the strip theory account for the differences seen.

  10. Quantitative microscopy of the lung: a problem-based approach. Part 2: stereological parameters and study designs in various diseases of the respiratory tract.

    PubMed

    Mühlfeld, Christian; Ochs, Matthias

    2013-08-01

    Design-based stereology provides efficient methods to obtain valuable quantitative information of the respiratory tract in various diseases. However, the choice of the most relevant parameters in a specific disease setting has to be deduced from the present pathobiological knowledge. Often it is difficult to express the pathological alterations by interpretable parameters in terms of volume, surface area, length, or number. In the second part of this companion review article, we analyze the present pathophysiological knowledge about acute lung injury, diffuse parenchymal lung diseases, emphysema, pulmonary hypertension, and asthma to come up with recommendations for the disease-specific application of stereological principles for obtaining relevant parameters. Worked examples with illustrative images are used to demonstrate the work flow, estimation procedure, and calculation and to facilitate the practical performance of equivalent analyses.

  11. Effects of rock riprap design parameters on flood protection costs for uranium tailings impoundments

    SciTech Connect

    Ecker, R.M.

    1984-07-01

    The Pacific Northwest Laboratory (PNL) is studying the problem of long-term protection of earthen covers on decommissioned uranium tailings impoundments. The major erosive forces acting on these covers will be river flooding and overland flow from rainfall-runoff. For impoundments adjacent to rivers, overbank flooding presents the greater potential for significant erosion. To protect the earthen covers against flood erosion, rock riprap armoring will be placed over the cover surface. Because of the large size rock usually required for riprap, the quarrying, transport, and placement of the rock could be a significant part of the decommissioning cost. This report examines the sensitivity of riprap protection costs to certain design parameters at tailings impoundments. The parameters include flood discharge, riprap materials, impoundment side slopes, and an added safety factor. Two decommissioned tailings impoundments are used as case studies for the evaluation. These are the Grand Junction, Colorado, impoundment located adjacent to the Colorado River and the Slickrock, Colorado, impoundment located adjacent to the Dolores River. The evaluation considers only the cost of riprap protection against flood erosion. The study results show that embankment side slope and rock specific gravity can have optimum values or ranges at a specific site. For both case study sites the optimum side slope is about 5H:1V. Of the rock sources considered at Grand Junction, the optimum specific gravity would be about 2.50; however, an optimum rock specific gravity for the Slickrock site could not be determined. Other results indicate that the arbitrary safety factor usually added in riprap design can lead to large increases in protection costs. 22 references, 19 figures, 15 tables.

  12. Calculation of the Ion Distribution Function over Transverse Velocities under ICR Heating Conditions and Separation Parameters of a Collector of Heated Ions

    SciTech Connect

    Karchevskii, A.I.; Potanin, E.P.

    2004-12-15

    The ion distribution function over transverse velocities and the ion heating efficiency (which is defined as the fraction {eta} of ions heated above a certain energy W{sub min}) are calculated in the context of a plasma method for isotope separation on the basis of ion cyclotron resonance heating. The ion distribution function over longitudinal velocities is assumed to be linear in the range of low velocities. It is shown that, when the ions are heated to high energies, the averaged ion distribution function over transverse velocities becomes highly nonequilibrium and has two peaks. Results are presented from calculations of the ion heating efficiency {eta} for W{sub min} = 40 eV and for different values of the parameter p that characterizes the ratio of the wavelength {lambda} of the antenna electric field to the length L of the heating region. The relative roles of the time-of-flight and the Doppler broadening are analyzed, and the separation parameters of a collector of heated ions are estimated.

  13. Accurate calculations on 9 Λ-S and 28 Ω states of NSe radical in the gas phase: Potential energy curves, spectroscopic parameters and spin-orbit couplings

    NASA Astrophysics Data System (ADS)

    Shi, Deheng; Li, Peiling; Sun, Jinfeng; Zhu, Zunlue

    2014-01-01

    The potential energy curves (PECs) of 28 Ω states generated from 9 Λ-S states (X2Π, 14Π, 16Π, 12Σ+, 14Σ+, 16Σ+, 14Σ-, 24Π and 14Δ) are studied for the first time using an ab initio quantum chemical method. All the 9 Λ-S states correlate to the first two dissociation limits, N(4Su) + Se(3Pg) and N(4Su) + Se(3Dg), of NSe radical. Of these Λ-S states, the 16Σ+, 14Σ+, 16Π, 24Π and 14Δ are found to be rather weakly bound states. The 12Σ+ is found to be unstable and has double wells. And the 16Σ+, 14Σ+, 14Π and 16Π are found to be the inverted ones with the SO coupling included. The PEC calculations are made by the complete active space self-consistent field method, which is followed by the internally contracted multireference configuration interaction approach with the Davidson modification. The spin-orbit coupling is accounted for by the state interaction approach with the Breit-Pauli Hamiltonian. The convergence of the present calculations is discussed with respect to the basis set and the level of theory. Core-valence correlation corrections are included with a cc-pCVTZ basis set. Scalar relativistic corrections are calculated by the third-order Douglas-Kroll Hamiltonian approximation at the level of a cc-pV5Z basis set. All the PECs are extrapolated to the complete basis set limit. The variation with internuclear separation of spin-orbit coupling constants is discussed in brief for some Λ-S states with one shallow well on each PEC. The spectroscopic parameters of 9 Λ-S and 28 Ω states are determined by fitting the first ten vibrational levels whenever available, which are calculated by solving the rovibrational Schrödinger equation with Numerov's method. The splitting energy in the X2Π Λ-S state is determined to be about 864.92 cm-1, which agrees favorably with the measurements of 891.80 cm-1. Moreover, other spectroscopic parameters of Λ-S and Ω states involved here are also in fair agreement with available measurements. It

  14. Theoretical calculations on 12 Λ-S and 23 Ω states of CBr+ cation in the gas phase: Potential energy curves, spectroscopic parameters and spin-orbit coupling

    NASA Astrophysics Data System (ADS)

    Shi, Deheng; Niu, Xianghong; Sun, Jinfeng; Zhu, Zunlue

    2014-01-01

    The potential energy curves (PECs) of X1Σ+, a3Π, 13Σ+, 13Δ, 11Δ, 11Σ-, 13Σ-, 11Π, 21Σ+, 23Π, 21Π and 23Σ+ Λ-S states of CBr+ cation and corresponding 23 Ω states are calculated for the first time using the CASSCF method, which is followed by the internally contracted MRCI approach with the aug-cc-pVQZ basis set. All the Λ-S states involved are found to be bound and dissociate into the first dissociation limit of CBr+ cation. Of these Λ-S states, only the 13Σ+ and 13Σ- are inverted ones. The spin-orbit (SO) coupling is accounted for by the state interaction approach with the Breit-Pauli Hamiltonian. Core-valence correlation is included by a cc-pCVTZ basis set. Relativistic correction is calculated with the third-order Douglas-Kroll Hamiltonian approximation at the level of cc-pVQZ basis set. To obtain more reliable results, the PECs obtained by the MRCI calculations are corrected for size-extensivity errors by means of the Davidson modification. The PEC crossings of different Λ-S states are studied. With these PECs, the spectroscopic parameters of all the Λ-S and Ω states involved are obtained by fitting the first ten vibrational levels whenever available, which are calculated by solving the rovibrational Schrödinger equation using the Numerov's method. The spectroscopic parameters are compared with those reported in the literature. Excellent agreement is found between the present results and available measurements. In particular, the energy separation of 352.26 cm-1 between the a3Π0+ and the a3Π1 Ω states agrees well with the measurements of 369±8 cm-1, and the ωe results of 907.45 and 907.08 cm-1 for the a3Π0+ and a3Π1 Ω states are in excellent agreement with the measurements of 906±2 and 903±6 cm-1, respectively. These show that the spectroscopic parameters obtained in the present paper can be expected to be reliable predicted ones.

  15. Materials by design: methodological developments in the calculation of excited-state properties

    NASA Astrophysics Data System (ADS)

    Govoni, Marco

    Density functional theory (DFT) is one of the main tools used in first principle simulations of materials; however several of the current approximations of exchange and correlation functionals do not provide the level of accuracy required for predictive calculations of excited state properties. The application to heterogeneous systems of more accurate post-DFT approaches such as Many-Body Perturbation Theory (MBPT) - for example to nanostructured, disordered, and defective materials - has been hindered by high computational costs. In this talk recent methodological developments in MBPT calculations will be discussed, as recently implemented in the open source code WEST, which efficiently exploits HPC architectures. Results using a formulation that does not require the explicit calculation of virtual states, nor the storage and inversion of large dielectric matrices will be presented; these results include quasi particle energies for systems with thousands of electrons and encompass the electronic structure of aqueous solutions, spin defects in insulators, and benchmarks for molecules and solids containing heavy elements. Simplifications of MBPT calculations based on the use of static response properties, such as dielectric-dependent hybrid functionals, will also be discussed. Work done in collaboration with Hosung Seo, Peter Scherpelz, Ikutaro Hamada, Jonathan Skone, Alex Gaiduk, T. Anh Pham, and Giulia Galli. Supported by DOE-BES.

  16. As-Built design specification for PARPLT. [program to produce scatter plots of crop greenness profile parameters

    NASA Technical Reports Server (NTRS)

    Tompkins, M. A.; Cheng, D. E. (Principal Investigator)

    1981-01-01

    The design and implementation of the PARPLT program are described. The program produces scatter plots of the greenness profile derived parameters alpha, beta, and t sub o computed by the CLASFYG program (alpha being the approximate greenness rise time; beta, the greenness decay time; and t sub o, the spectral crop emergence date). Statistical information concerning the parameters is also computed.

  17. Design Concept and Parameters of a 15 T $Nb_{3}Sn$ Dipole Demonstrator for a 100 TEV Hadron Collider

    SciTech Connect

    Zlobin, A. V.; Andreev, N.; Barzi, E.; Kashikhin, V. V.; Novitski, I.

    2015-06-01

    FNAL has started the development of a 15 T $Nb_{3}Sn$ dipole demonstrator for a 100 TeV scale hadron collider. This paper describes the design concept and parameters of the 15 T $Nb_{3}Sn$ dipole demonstrator. The dipole magnetic, mechanical and quench protection concept and parameters are presented and discussed.

  18. A relaxation-accelerated propagator method for calculations of electron energy distribution function and electron transport parameters in gas under dc electric fields

    NASA Astrophysics Data System (ADS)

    Sugawara, Hirotake

    2017-04-01

    A propagator method (PM), a numerical technique to solve the Boltzmann equation (BE) for the electron velocity or energy distribution function (EVDF/EEDF) of electron swarms in gases, was customized to obtain the equilibrium solution quickly. The PM calculates the number of electrons in cells defined in velocity space using an operator called the propagator or Green’s function. The propagator represents the intercellular transfer of electrons corresponding to the electron velocity change due to the acceleration by the electric field and the collisional events with gas molecules. The relaxation of the EVDF to its drift equilibrium solution proceeds with iterative propagator operations for the EVDF. Merits of the PM are that the series expansion of the EVDF as done in the BE analyses is not required and that time evolution of the electron swarm can be observed if necessary. On the other hand, in case only the equilibrium solution of the EVDF is wanted, the relaxation can be accelerated numerically. A demonstration achieved a shortening of the computational time by about three orders of magnitude. Furthermore, this scheme was applied to calculations of a set of electron transport parameters required in fluid-model simulations, i.e. the effective ionization frequency, the centroid drift velocity and the longitudinal diffusion coefficient, using the zeroth-, first- and second-order moment equations derived from the BE. A detailed description on the PM calculation was presented.

  19. A Comparison of Body Segment Inertial Parameter Estimation Methods and Joint Moment and Power Calculations During a Drop Vertical Jump in Collegiate Female Soccer Players.

    PubMed

    Arena, Sara L; McLaughlin, Kelsey; Nguyen, Anh-Dung; Smoliga, James M; Ford, Kevin R

    2017-02-01

    Athletic individuals may differ in body segment inertial parameter (BSIP) estimates due to differences in body composition, and this may influence calculation of joint kinetics. The purposes of this study were to (1) compare BSIPs predicted by the method introduced by de Leva(1) with DXA-derived BSIPs in collegiate female soccer players, and (2) examine the effects of these BSIP estimation methods on joint moment and power calculations during a drop vertical jump (DVJ). Twenty female NCAA Division I soccer players were recruited. BSIPs of the shank and thigh (mass, COM location, and radius of gyration) were determined using de Leva's method and analysis of whole-body DXA scans. These estimates were used to determine peak knee joint moments and power during the DVJ. Compared with DXA, de Leva's method located the COM more distally in the shank (P = .008) and more proximally in the thigh (P < .001), and the radius of gyration of the thigh to be further from the thigh COM (P < .001). All knee joint moment and power measures were similar between methods. These findings suggest that BSIP estimation may vary between methods, but the impact on joint moment calculations during a dynamic task is negligible.

  20. Derivation of force field parameters for SnO2-H2O surface systems from plane-wave density functional theory calculations.

    PubMed

    Bandura, A V; Sofo, J O; Kubicki, J D

    2006-04-27

    Plane-wave density functional theory (DFT-PW) calculations were performed on bulk SnO2 (cassiterite) and the (100), (110), (001), and (101) surfaces with and without H2O present. A classical interatomic force field has been developed to describe bulk SnO2 and SnO2-H2O surface interactions. Periodic density functional theory calculations using the program VASP (Kresse et al., 1996) and molecular cluster calculations using Gaussian 03 (Frisch et al., 2003) were used to derive the parametrization of the force field. The program GULP (Gale, 1997) was used to optimize parameters to reproduce experimental and ab initio results. The experimental crystal structure and elastic constants of SnO2 are reproduced reasonably well with the force field. Furthermore, surface atom relaxations and structures of adsorbed H2O molecules agree well between the ab initio and force field predictions. H2O addition above that required to form a monolayer results in consistent structures between the DFT-PW and classical force field results as well.