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Sample records for elastic potential energy

  1. Energy-harvesting potential of multiple elastic structures in tandem arrangement

    NASA Astrophysics Data System (ADS)

    Yin, Bo; Luo, Haoxiang

    2011-11-01

    Vortex-induced flapping vibrations of elastic structures attached with piezoelectric materials, i.e., ``piezo-leaves'', have recently been explored for its potential application in wind energy harvesting (e.g., Li, Yuan, and Lipson, J. Appl. Phys., 2011). In this work, we explore the possibility of enhancing the structural vibration and energy harvesting performance of the generator by putting the leaves in tandem arrangement and within close range of hydrodynamic interaction. A two-dimensional model is developed, where two or more elastic plates are mounted in a cross flow. In the case of two plates, the numerical simulation shows that at a particular distance, the vibration of the downstream plate is greatly increased, and so is the energy level of the entire system. For multiple plates, we observed both synchronized and apparently chaotic vibration modes. The characteristics of the vortex interaction, plate deformation, and energetics will be presented for those coupling modes.

  2. Dynamic polarization potentials for the halo nucleus {sup 6}He in medium-energy elastic scattering

    SciTech Connect

    Abu-Ibrahim, B.; Suzuki, Y.

    2004-07-01

    We study dynamic polarization potentials for a halo nucleus {sup 6}He scattered by a {sup 12}C target in the eikonal approximation. We use a realistic, six-nucleon wave function of {sup 6}He to include both the halo-neutron and the core-nucleon excitations on an equal footing. We discuss the energy dependence of the polarization potential in relation to that of the nucleon-target optical potential. The imaginary part of the polarization potential changes a sign (negative to positive with increasing energy) around the incident energy of 200 MeV/nucleon, which gives different contributions, depending on the energy, to the elastic differential cross section as well as the reaction cross section.

  3. Polarization potential for elastic scattering of {sup 6,7}Li + {sup 28}Si at near-barrier energies

    SciTech Connect

    Pakou, Athena

    2008-12-15

    The polarization potential for the elastic scattering of {sup 6,7}Li + {sup 28}Si at near barrier energies has been investigated in the context of an optical model framework. The effect on the elastic scattering was found to be strong, energy dependent, and compatible with the transfer channel.

  4. Global optical potential for the elastic scattering of {sup 6}He at low energies

    SciTech Connect

    Kucuk, Y.; Boztosun, I.; Topel, T.

    2009-11-15

    A set of global optical potentials has been derived to describe the interactions of {sup 6}He at low energies. The elastic scattering angular distribution data measured so far for many systems, ranging from {sup 12}C to {sup 209}Bi, have been considered within the framework of the optical model to find a global potential set to describe the experimental data consistently. We report that very good agreement between theoretical and experimental results has been obtained with small {chi}{sup 2}/N values by using the derived potential set. The reaction cross section and volume integrals of the potentials have been deduced from the theoretical calculations for all studied systems at relevant energies.

  5. Modeling the elastic energy of alloys: Potential pitfalls of continuum treatments

    NASA Astrophysics Data System (ADS)

    Baskaran, Arvind; Ratsch, Christian; Smereka, Peter

    2015-12-01

    Some issues that arise when modeling elastic energy for binary alloys are discussed within the context of a Keating model and density-functional calculations. The Keating model is a simplified atomistic formulation based on modeling elastic interactions of a binary alloy with harmonic springs whose equilibrium length is species dependent. It is demonstrated that the continuum limit for the strain field are the usual equations of linear elasticity for alloys and that they correctly capture the coarse-grained behavior of the displacement field. In addition, it is established that Euler-Lagrange equation of the continuum limit of the elastic energy will yield the same strain field equation. This is the same energy functional that is often used to model elastic effects in binary alloys. However, a direct calculation of the elastic energy atomistic model reveals that the continuum expression for the elastic energy is both qualitatively and quantitatively incorrect. This is because it does not take atomistic scale compositional nonuniformity into account. Importantly, this result also shows that finely mixed alloys tend to have more elastic energy than segregated systems, which is the exact opposite of predictions made by some continuum theories. It is also shown that for strained thin films the traditionally used effective misfit for alloys systematically underestimate the strain energy. In some models, this drawback is handled by including an elastic contribution to the enthalpy of mixing, which is characterized in terms of the continuum concentration. The direct calculation of the atomistic model reveals that this approach suffers serious difficulties. It is demonstrated that elastic contribution to the enthalpy of mixing is nonisotropic and scale dependent. It is also shown that such effects are present in density-functional theory calculations for the Si-Ge system. This work demonstrates that it is critical to include the microscopic arrangements in any elastic model to achieve even qualitatively correct behavior.

  6. Modeling the elastic energy of alloys: Potential pitfalls of continuum treatments.

    PubMed

    Baskaran, Arvind; Ratsch, Christian; Smereka, Peter

    2015-12-01

    Some issues that arise when modeling elastic energy for binary alloys are discussed within the context of a Keating model and density-functional calculations. The Keating model is a simplified atomistic formulation based on modeling elastic interactions of a binary alloy with harmonic springs whose equilibrium length is species dependent. It is demonstrated that the continuum limit for the strain field are the usual equations of linear elasticity for alloys and that they correctly capture the coarse-grained behavior of the displacement field. In addition, it is established that Euler-Lagrange equation of the continuum limit of the elastic energy will yield the same strain field equation. This is the same energy functional that is often used to model elastic effects in binary alloys. However, a direct calculation of the elastic energy atomistic model reveals that the continuum expression for the elastic energy is both qualitatively and quantitatively incorrect. This is because it does not take atomistic scale compositional nonuniformity into account. Importantly, this result also shows that finely mixed alloys tend to have more elastic energy than segregated systems, which is the exact opposite of predictions made by some continuum theories. It is also shown that for strained thin films the traditionally used effective misfit for alloys systematically underestimate the strain energy. In some models, this drawback is handled by including an elastic contribution to the enthalpy of mixing, which is characterized in terms of the continuum concentration. The direct calculation of the atomistic model reveals that this approach suffers serious difficulties. It is demonstrated that elastic contribution to the enthalpy of mixing is nonisotropic and scale dependent. It is also shown that such effects are present in density-functional theory calculations for the Si-Ge system. This work demonstrates that it is critical to include the microscopic arrangements in any elastic model to achieve even qualitatively correct behavior. PMID:26764702

  7. A potential deduced from low energy {sup 16}O({alpha},{alpha}) elastic scattering

    SciTech Connect

    Michel, F.; Reidemeister, G.; Kondo, Y.

    1995-06-01

    The properties of the {alpha}+{sup 16}O interaction in the vicinity of the Coulomb barrier are investigated by constructing (real, energy-independent) potentials which reproduce---when resonant nonpotential contributions are added to the potential background---all available {sup 16}O({alpha},{alpha}) elastic scattering angular distributions and excitation functions between 3.5 and 9 MeV incident energies. These low energy potentials, which are constructed for angular momenta ranging from 0 to 5, are in line with the global potential extracted from the analysis of the higher energy data (20{le}{ital E}{sub {alpha}}{le}150 MeV), but a slight angular momentum dependence, and an increase of the barrier height of about 1 MeV, are found necessary to reproduce the low energy data; this effect is qualitatively similar to that predicted by calculations taking into account antisymmetrization or dispersion relation effects. These potentials reproduce the properties of the first three members of the {sup 20}Ne {ital K}{sup {pi}}=0{sub 4}{sup +} ``higher nodal`` rotational band, which dominate the scattering in the investigated energy range, and of the {ital J}{sup {pi}}=5{sup {minus}} member of the {ital K}{sup {pi}}=0{sup {minus}} ``inversion doublet`` band. By taking into account the energy dependence of the interaction at lower energy, these potentials also give a nice account of the properties of the {ital J}{sup {pi}}=1{sup {minus}} and 3{sup {minus}} members of the same band, and are found to be compatible with the properties of the first three members of the {sup 20}Ne ground state band.

  8. Elastic alpha scattering experiments and the alpha-nucleus optical potential at low energies

    SciTech Connect

    Mohr, P.; Kiss, G.G.; Fülöp, Zs.; Galaviz, D.; Gyürky, Gy.; Somorjai, E.

    2013-11-15

    High precision angular distribution data of (α,α) elastic scattering are presented for the nuclei {sup 89}Y, {sup 92}Mo, {sup 106,110,116}Cd, {sup 112,124}Sn, and {sup 144}Sm at energies around the Coulomb barrier. Such data with small experimental uncertainties over the full angular range (20–170°) are the indispensable prerequisite for the extraction of local optical potentials and for the determination of the total reaction cross section σ{sub reac}. A systematic fitting procedure was applied to the experimental scattering data presented to obtain comprehensive local potential parameter sets that are composed of a real folding potential and an imaginary potential of Woods–Saxon surface type. The potential parameters obtained were used in turn to construct a new systematic α-nucleus potential with very few parameters. Although this new potential cannot reproduce the angular distributions with the same small deviations as the local potential, the new potential is able to predict the total reaction cross sections for all cases under study.

  9. Elastic Energy Driven Polymerization

    PubMed Central

    Wang, Andrew; Zocchi, Giovanni

    2009-01-01

    We present a molecular system where polymerization is controlled externally by tuning the elastic energy of the monomers. The elastic energy, provided by a DNA molecular spring, destabilizes the monomer state through a process analogous to domain swapping. This energy can be large (of ∼10 kT) and thus drive polymerization at relatively low monomer concentrations. The monomer-dimer equilibrium provides a measurement of the elastic energy of the monomer, which in this construction appears limited by kink formation in the DNA molecular spring, in accord with previous theoretical and experimental investigations of the elasticity of sharply bent DNA. PMID:19289060

  10. Notepad-like triboelectric generator for efficiently harvesting low-velocity motion energy by interconversion between kinetic energy and elastic potential energy.

    PubMed

    Liu, Guanlin; Leng, Qiang; Lian, Jiawei; Guo, Hengyu; Yi, Xi; Hu, Chenguo

    2015-01-21

    Great attention has been paid to nanogenerators that harvest energy from ambient environments lately. In order to give considerable output current, most nanogenerators require high-velocity motion that in most cases can hardly be provided in our daily life. Here we report a notepad-like triboelectric generator (NTEG), which uses simple notepad-like structure to generate elastic deformation so as to turn a low-velocity kinetic energy into high-velocity kinetic energy through the conversion of elastic potential energy. Therefore, the NTEG can achieve high current output under low-velocity motion, which completely distinguishes it from tribogenerators previously reported. The factors that may affect the output performance are explored, including the number of slices, active length of slice, press speed, and vertical displacement. In addition, the working mechanism is systematically studied, indicating that the efficiency of the generator can be greatly enhanced by interconversion between kinetic energy and elastic potential energy. The short-circuit current, the open-circuit voltage, and power density are 205 μA and 470 V and 9.86 W/m(2), respectively, which is powerful enough to light up hundreds of light-emitting diodes (LEDs) and charge a commercial capacitor. Besides, NTEGs have been successfully applied to a self-powered door monitor. PMID:25564956

  11. Determination of the interatomic potential from elastic differential cross sections at fixed energy: Functional sensitivity analysis approach

    SciTech Connect

    Ho, T.; Rabitz, H.

    1989-02-01

    Elastic differential cross sections in atomic crossed beam experiments contain detailed information about the underlying interatomic potentials. The functional sensitivity density of the cross sections with respect to the potential deltasigma(theta)/deltaV(R) reveals such information and has been implemented in an iterative inversion procedure, analogous to that of the Newton--Raphson technique. The stability of the inversion is achieved with the use of the regularization method of Tikhonov and Miller. It is shown that given a set of well resolved and noise-free differential cross section data within a limited angular range and given a reasonable starting reference potential, the recovered potential accurately resembles the desired one in the important region, i.e., the region to which the scattering data are sensitive. The region of importance depends upon the collision energy relative to the well depth of the potential under study; usually a higher collision energy penetrates deeper into the repulsive part of the potential and thus accordingly yields a more accurate potential in that part. The inversion procedure produces also a quality function indicating the well determined radial region. Moreover, the extracted potential is quite independent of the functional form of the reference potential in contrast to curve fitting approaches. As illustrations, the model inert gas systems He--Ne and Ne--Ar have been considered. For collision energies within an order of magnitude of the associated potential well depth, the attractive part of the potential can be determined to high precision provided that scattering data at small enough angles are available.

  12. Elastic energy release in great earthquakes and eruptions

    NASA Astrophysics Data System (ADS)

    Gudmundsson, Agust

    2014-05-01

    The sizes of earthquakes are measured using well-defined, measurable quantities such as seismic moment and released (transformed) elastic energy. No similar measures exist for the sizes of volcanic eruptions, making it difficult to compare the energies released in earthquakes and eruptions. Here I provide a new measure of the elastic energy (the potential mechanical energy) associated with magma chamber rupture and contraction (shrinkage) during an eruption. For earthquakes and eruptions, elastic energy derives from two sources: (1) the strain energy stored in the volcano/fault zone before rupture, and (2) the external applied load (force, pressure, stress, displacement) on the volcano/fault zone. From thermodynamic considerations it follows that the elastic energy released or transformed (dU) during an eruption is directly proportional to the excess pressure (pe) in the magma chamber at the time of rupture multiplied by the volume decrease (-dVc) of the chamber, so that . This formula can be used as a basis for a new eruption magnitude scale, based on elastic energy released, which can be related to the moment-magnitude scale for earthquakes. For very large eruptions (>100 km3), the volume of the feeder-dike is negligible, so that the decrease in chamber volume during an eruption corresponds roughly to the associated volume of erupted materials , so that the elastic energy is . Using a typical excess pressures of 5 MPa, it is shown that the largest known eruptions on Earth, such as the explosive La Garita Caldera eruption (27-28 million years ago) and largest single (effusive) Colombia River basalt lava flows (15-16 million years ago), both of which have estimated volumes of about 5000 km3, released elastic energy of the order of 10EJ. For comparison, the seismic moment of the largest earthquake ever recorded, the M9.5 1960 Chile earthquake, is estimated at 100 ZJ and the associated elastic energy release at 10EJ.

  13. An excitation potential imaging condition for elastic reverse time migration

    NASA Astrophysics Data System (ADS)

    Gu, Bingluo; Liu, Youshan; Li, Zhiyuan; Ma, Xiaona; Liang, Guanghe

    2014-09-01

    Elastic reverse time migration (ERTM) has been demonstrated to be more accurate than scalar RTM. However, low efficiency (large storage and heavy calculated amount) and strong artifacts caused by the crosstalk between different wave modes are the two primary barriers to the application of the ERTM during the processing of real data. The scalar (P) and vector (S) potentials of the elastic wavefield and the arrival times corresponding to the first energy extremum of the wavefield are saved at each grid point during the forward modeling of the source wavefield. The angle-dependent reflection coefficient images are subsequently obtained by dividing the scalar and vector potentials of the backward extrapolated receiver wavefield by the saved scalar and vector potentials at the grid points that satisfy the image time at each time step, respectively. The proposed imaging condition does not need to store the snapshots of the source wavefield, while it can considerably improve the computational efficiency and decrease the amount of storage and Input/Output manipulation (compared with the cross-correlation imaging condition) in addition to suppressing the crosstalk between compressive and shear wave modes. Compared with the excitation time imaging condition, the proposed imaging condition reduces the energy loss caused by the opposite polarity of the horizontal component at opposite sides of the source in stacked images. Numerical tests with synthetic data of the Sigsbee2a model have demonstrated that this imaging condition is a cost-effective and practical imaging condition for use in prestack ERTM.

  14. Elastic model for dinucleosome structure and energy

    NASA Astrophysics Data System (ADS)

    Fatemi, Hashem; Khodabandeh, Fatemeh; Mohammad-Rafiee, Farshid

    2016-04-01

    The equilibrium structure of a dinucleosome is studied using an elastic model that takes into account the force and torque balance conditions. Using the proper boundary conditions, it is found that the conformational energy of the problem does not depend on the length of the linker DNA. In addition it is shown that the two histone octamers are almost perpendicular to each other, and the linker DNA in short lengths is almost straight. These findings could shed some light on the role of DNA elasticity in the chromatin structure.

  15. Optical potential parameters from 12C + Zr elastic scattering

    NASA Astrophysics Data System (ADS)

    Gan, L.; Li, Z. H.; Sun, H. B.; Su, J.; Li, Y. J.; Yan, S. Q.; Wang, Y. B.; Zeng, S.; Bai, X. X.; Du, X. C.; Wu, Z. D.; Jin, S. J.; Zhang, W. J.; Liu, W. P.; Li, E. T.

    2016-02-01

    The angular distributions of 12C + 90,92,94,96Zr elastic scattering were measured with the Q3D magnetic spectrometer at the HI-13 tandem accelerator, Beijing. The real part of optical potential were extracted by analysing these angular distributions. The analysis enable us to avoid the influence of Coulomb effect and to observe the dependence of optical potential on the nuclear properties. With the deduced potential parameters, the experimental elastic scattering angular distributions can be reproduced very well. Formulas to infer global heavy-ion potential parameters were obtained then by analyzing the extracted optical potential parameters. The formulas can be used widely in heavy-ion nuclear reactions.

  16. Low energy elastic scattering from toluene

    NASA Astrophysics Data System (ADS)

    Sakaamini, Ahmad; Hargreaves, Leigh; Khakoo, Murtadha A.; Pastega, Diego Farago; Bettega, Marcio H. F.

    2015-09-01

    Differential scattering cross sections for elastic scattering of low-energy electrons from toluene are presented in the form of experimental and theoretical (Schwinger multichannel method with pseudopotentials) results. The experimental incident electron energy range is from 1 eV to 20 eV and scattering angles from 15 to 130 degrees. Comparisons with other available cross sections are also presented. CSUF is funded by an NSF-PHY-RUI grant; U. Federal do Parana is funded by CNPq, CAPES and Finep.

  17. Elastic energy of polyhedral bilayer vesicles

    NASA Astrophysics Data System (ADS)

    Haselwandter, Christoph A.; Phillips, Rob

    2011-06-01

    In recent experiments [M. Dubois, B. Demé, T. Gulik-Krzywicki, J.-C. Dedieu, C. Vautrin, S. Désert, E. Perez, and T. Zemb, Nature (London)NATUAS0028-083610.1038/35079541 411, 672 (2001)] the spontaneous formation of hollow bilayer vesicles with polyhedral symmetry has been observed. On the basis of the experimental phenomenology it was suggested [M. Dubois, V. Lizunov, A. Meister, T. Gulik-Krzywicki, J. M. Verbavatz, E. Perez, J. Zimmerberg, and T. Zemb, Proc. Natl. Acad. Sci. USAPNASA60027-842410.1073/pnas.0400837101 101, 15082 (2004)] that the mechanism for the formation of bilayer polyhedra is minimization of elastic bending energy. Motivated by these experiments, we study the elastic bending energy of polyhedral bilayer vesicles. In agreement with experiments, and provided that excess amphiphiles exhibiting spontaneous curvature are present in sufficient quantity, we find that polyhedral bilayer vesicles can indeed be energetically favorable compared to spherical bilayer vesicles. Consistent with experimental observations we also find that the bending energy associated with the vertices of bilayer polyhedra can be locally reduced through the formation of pores. However, the stabilization of polyhedral bilayer vesicles over spherical bilayer vesicles relies crucially on molecular segregation of excess amphiphiles along the ridges rather than the vertices of bilayer polyhedra. Furthermore, our analysis implies that, contrary to what has been suggested on the basis of experiments, the icosahedron does not minimize elastic bending energy among arbitrary polyhedral shapes and sizes. Instead, we find that, for large polyhedron sizes, the snub dodecahedron and the snub cube both have lower total bending energies than the icosahedron.

  18. Elastic energy of polyhedral bilayer vesicles.

    PubMed

    Haselwandter, Christoph A; Phillips, Rob

    2011-06-01

    In recent experiments [M. Dubois, B. Demé, T. Gulik-Krzywicki, J.-C. Dedieu, C. Vautrin, S. Désert, E. Perez, and T. Zemb, Nature (London) 411, 672 (2001)] the spontaneous formation of hollow bilayer vesicles with polyhedral symmetry has been observed. On the basis of the experimental phenomenology it was suggested [M. Dubois, V. Lizunov, A. Meister, T. Gulik-Krzywicki, J. M. Verbavatz, E. Perez, J. Zimmerberg, and T. Zemb, Proc. Natl. Acad. Sci. USA 101, 15082 (2004)] that the mechanism for the formation of bilayer polyhedra is minimization of elastic bending energy. Motivated by these experiments, we study the elastic bending energy of polyhedral bilayer vesicles. In agreement with experiments, and provided that excess amphiphiles exhibiting spontaneous curvature are present in sufficient quantity, we find that polyhedral bilayer vesicles can indeed be energetically favorable compared to spherical bilayer vesicles. Consistent with experimental observations we also find that the bending energy associated with the vertices of bilayer polyhedra can be locally reduced through the formation of pores. However, the stabilization of polyhedral bilayer vesicles over spherical bilayer vesicles relies crucially on molecular segregation of excess amphiphiles along the ridges rather than the vertices of bilayer polyhedra. Furthermore, our analysis implies that, contrary to what has been suggested on the basis of experiments, the icosahedron does not minimize elastic bending energy among arbitrary polyhedral shapes and sizes. Instead, we find that, for large polyhedron sizes, the snub dodecahedron and the snub cube both have lower total bending energies than the icosahedron. PMID:21797397

  19. Expression for the granular elastic energy.

    PubMed

    Jiang, Yimin; Zheng, Hepeng; Peng, Zheng; Fu, Liping; Song, Shixiong; Sun, Qicheng; Mayer, Michael; Liu, Mario

    2012-05-01

    Granular solid hydrodynamics (GSH) is a broad-ranged continual mechanical description of granular media capable of accounting for static stress distributions, yield phenomena, propagation and damping of elastic waves, the critical state, shear band, and fast dense flow. An important input of GSH is an expression for the elastic energy needed to deform the grains. The original expression, though useful and simple, has some drawbacks. Therefore a slightly more complicated expression is proposed here that eliminates three of them: (1) The maximal angle at which an inclined layer of grains remains stable is increased from 26^{∘} to the more realistic value of 30^{∘}. (2) Depending on direction and polarization, transverse elastic waves are known to propagate at slightly different velocities. The old expression neglects these differences, the new one successfully reproduces them. (3) Most importantly, the old expression contains only the Drucker-Prager yield surface. The new one contains in addition those named after Coulomb, Lade-Duncan, and Matsuoka-Nakai-realizing each, and interpolating between them, by shifting a single scalar parameter. PMID:23004747

  20. Elastic epsilon/sup + -/-He scattering with the use of the model-potential method

    SciTech Connect

    Khan, P.; Datta, S.K.; Bhattacharyya, D.; Ghosh, A.S.

    1984-06-01

    A model-potential method has been used to evaluate the elastic e/sup + -/-He scattering at the low-incident energies. The potential contains one parameter to include the effect of short-range correlation. The results for the elastic e/sup + -/-He scattering have been obtained using the same parameter. Two model exchange potentials, one for s wave and the other for higher partial waves, have been employed. The present results are in good agreement with the measured values and refined theoretical predictions.

  1. Velocity-dependent optical potential for neutron elastic scattering from 1 p -shell nuclei

    NASA Astrophysics Data System (ADS)

    Ghabar, I. N.; Jaghoub, M. I.

    2015-06-01

    Background: The conventional optical model is quite successful in describing the nucleon elastic scattering data from medium and heavy nuclei. However, its success in describing the light 1 p -shell nuclei is somewhat limited. The velocity-dependent optical potential resulted in a significant improvement in describing the elastic angular distributions for light nuclei in the low energy region. Purpose: To extend the formalism of the velocity-dependent potential to higher energies, and to assess its importance in describing neutron elastic scattering data from light 1 p -shell nuclei at high energies. Method: We fit the angular distribution data for neutron elastic scattering from 12C and 16O using (i) the velocity-dependent optical potential and (ii) the conventional optical potential. The results of the two models are then compared. At low energies, we compare our angular distribution fits with the fits of other works that exist in the literature. Furthermore, the total integrated cross sections in addition to the analyzing power are calculated using the velocity-dependent optical potential and compared to the experimental data. Results: The velocity-dependent potential resulted in significant improvements in describing the angular distributions particularly in the large-angle scattering region and for certain energy ranges. This model is important where the experimental data show structural effects from nuclear surface deformations, which are important in light nuclei. Furthermore, the calculated total elastic cross sections and analyzing power are in good agreement with the experimental data. Conclusions: The velocity-dependent potential gives rise to surface-peaked real terms in the optical model. Such terms account, at least partly, for the structural effects seen in the angular distribution data. The energy range over which the surface terms are needed is found to depend on the target nucleus. Other works that have introduced real surface terms in the optical potential are discussed.

  2. Hybrid Simulation Modeling to Estimate U.S. Energy Elasticities

    NASA Astrophysics Data System (ADS)

    Baylin-Stern, Adam C.

    This paper demonstrates how an U.S. application of CIMS, a technologically explicit and behaviourally realistic energy-economy simulation model which includes macro-economic feedbacks, can be used to derive estimates of elasticity of substitution (ESUB) and autonomous energy efficiency index (AEEI) parameters. The ability of economies to reduce greenhouse gas emissions depends on the potential for households and industry to decrease overall energy usage, and move from higher to lower emissions fuels. Energy economists commonly refer to ESUB estimates to understand the degree of responsiveness of various sectors of an economy, and use estimates to inform computable general equilibrium models used to study climate policies. Using CIMS, I have generated a set of future, 'pseudo-data' based on a series of simulations in which I vary energy and capital input prices over a wide range. I then used this data set to estimate the parameters for transcendental logarithmic production functions using regression techniques. From the production function parameter estimates, I calculated an array of elasticity of substitution values between input pairs. Additionally, this paper demonstrates how CIMS can be used to calculate price-independent changes in energy-efficiency in the form of the AEEI, by comparing energy consumption between technologically frozen and 'business as usual' simulations. The paper concludes with some ideas for model and methodological improvement, and how these might figure into future work in the estimation of ESUBs from CIMS. Keywords: Elasticity of substitution; hybrid energy-economy model; translog; autonomous energy efficiency index; rebound effect; fuel switching.

  3. Low-energy elastic differential scattering of He/++/ by He.

    NASA Technical Reports Server (NTRS)

    Lam, S. K.; Doverspike, L. D.; Champion, R. L.

    1973-01-01

    Experimental results are developed for the relative elastic differential scattering of He(++) by He for collision energies in the range 4 equal to or less than E equal to or less than 75 eV. In the analysis of the data, semiclassical considerations are utilized, assuming that the dynamics of the scattering is governed solely by the B and E states of He2(++). It is shown that existing ab initio calculations for the intermolecular potentials predict differential cross sections which are not in particularly good agreement with the experimental data.

  4. Transport of elastically coupled particles in an asymmetric periodic potential

    NASA Astrophysics Data System (ADS)

    Csahók, Z.; Family, F.; Vicsek, T.

    1997-05-01

    We study the motion of a chain of elastically coupled particles in an asymmetric potential. The particles are also subject to thermal fluctuations and a stochastic driving force of zero temporal average. The main motivation for investigating such systems originates from their partial analogy with a number of important models, including stochastic ratchets, the Frenkel-Kontorova model, and the various approaches to the microscopic description of friction and stick-slip motion having attracted great interest recently. We find that the collective behavior of the elastically coupled particles under certain conditions leads to an average velocity v which is larger than that of a single particle. The dependence of v on the coupling constant shows interesting anomalies discussed in the paper.

  5. np elastic scattering analyzing power characteristics at intermediate energies

    SciTech Connect

    Abegg, R.; Ahmad, M.; Bandyopadhyay, D.; Birchall, J.; Cairns, E.B.; Chantziantoniou, K.; Coombes, G.H.; Davis, C.A.; Davison, N.E.; Delheij, P.P.J.; Green, P.W.; Greeniaus, L.G.; Gubler, H.P.; Healey, D.C.; Lapointe, C.; Lee, W.P.; McDonald, W.J.; Miller, C.A.; Moss, G.A.; Page, S.A.; Plattner, G.R.; Poffenberger, P.R.; Ramsay, W.D.; Rodning, N.L.; Roy, G.; Soukup, J.; Svenne, J.P.; Tkachuk, R.R.; van Oers, W.T.H.; Wait, G.D.; Watson, J.W.; Ye, Y.; Zhang, Y.P. University of Manitoba, Department of Physics, Winnipeg, Manitoba, Canada R3T 2N2 University of Alberta, Department of Physics, Edmonton, Alberta, Canada T6G 2N5 University of Basel, Institute of Physics, CH-4000 Basel, Switzerland Kent State University, Department of Physics, Kent, Ohio 44242)

    1989-11-01

    Recent measurements of charge symmetry breaking in the {ital np} system at 477 MeV, and of {ital A}{sub 00{ital nn}} for {ital np} elastic scattering at 220, 325, and 425 MeV also yield accurate analyzing power data. These data allow the energy dependence of the analyzing power zero-crossing angle and the slope of the analyzing power at the zero-crossing angle to be determined. The incident neutron energies span a region where the zero-crossing angle is strongly energy dependent ({ital E}{sub {ital n}}{lt}250 MeV) to where it is almost independent of energy ({ital E}{sub {ital n}}{gt}350 MeV). The results are compared to current phase-shift analysis predictions, recently published data, and the predictions of the Bonn and Paris potentials.

  6. Energy in elastic fiber embedded in elastic matrix containing incident SH wave

    NASA Technical Reports Server (NTRS)

    Williams, James H., Jr.; Nagem, Raymond J.

    1989-01-01

    A single elastic fiber embedded in an infinite elastic matrix is considered. An incident plane SH wave is assumed in the infinite matrix, and an expression is derived for the total energy in the fiber due to the incident SH wave. A nondimensional form of the fiber energy is plotted as a function of the nondimensional wavenumber of the SH wave. It is shown that the fiber energy attains maximum values at specific values of the wavenumber of the incident wave. The results obtained here are interpreted in the context of phenomena observed in acousto-ultrasonic experiments on fiber reinforced composite materials.

  7. Double folding cluster potential for {sup 12}C+{sup 12}C elastic scattering

    SciTech Connect

    Hassanain, M. A.; Ibraheem, Awad A.; Farid, M. El-Azab

    2008-03-15

    Using the alpha ({alpha})-cluster structure of {sup 12}C nucleus, two versions of the {sup 12}C+{sup 12}C real double folded optical potentials have been generated based upon effective {alpha}-{alpha},{alpha}-nucleon (N) and N-N interactions. The obtained potentials, in conjunction with shallow phenomenological Woods-Saxon imaginary parts, successfully reproduce the elastic scattering differential cross section for 12 sets of data over the broad energy range 70-360 MeV. No renormalization of the real folded potentials is required to fit the data. The energy dependence of the extracted real and imaginary volume integrals and total reaction cross section is investigated.

  8. Elastic energy storage in the mantis shrimp's fast predatory strike.

    PubMed

    Zack, T I; Claverie, T; Patek, S N

    2009-12-01

    Storage of elastic energy is key to increasing the power output of many biological systems. Mantis shrimp (Stomatopoda) must store considerable elastic energy prior to their rapid raptorial strikes; however, little is known about the dynamics and location of elastic energy storage structures in this system. We used computed tomography (CT) to visualize the mineralization patterns in Gonodactylaceus falcatus and high speed videography of Odontodactylus scyllarus to observe the dynamics of spring loading. Using a materials testing apparatus, we measured the force and work required to contract the elastic structures in G. falcatus. There was a positive linear correlation between contraction force and contraction distance; alternative model tests further supported the use of a linear model. Therefore, we modeled the system as a Hookean spring. The force required to fully compress the spring was positively correlated with body mass and appendage size, but the spring constant did not scale with body size, suggesting a possible role of muscle constraints in the scaling of this system. One hypothesized elastic storage structure, the saddle, only contributed approximately 11% of the total measured force, thus suggesting that primary site of elastic energy storage is in the mineralized ventral bars found in the merus segment of the raptorial appendages. Furthermore, the intact system exhibited 81% resilience and severing the saddle resulted in a non-significant reduction to 77% resilience. The remarkable shapes and mineralization patterns that characterize the mantis shrimp's raptorial appendage further reveal a highly integrated mechanical power amplification system based on exoskeletal elastic energy storage. PMID:19946078

  9. Low energy electron elastic reflection from solid surfaces

    NASA Astrophysics Data System (ADS)

    Starý, Vladimír.; Zemek, Josef

    2004-09-01

    Using our Monte-Carlo (MC) code, we calculated the ratio of the coefficients of elastic reflection of electrons from Si, SiO 2 and Au to those of Cu and Al in the electron energy range 0.2-1.0 and 1.5 keV (Au-Cu), respectively. The electron scattering was simulated by a single scattering model. For the MC calculations, we compared the elastic differential cross-sections calculated using a static field approximation with relativistic partial wave analysis on either the Thomas-Fermi-Dirac potential of free atoms (TFD model) or the Hartree-Fock-Wigner-Seitz (muffin-tin) potential of atoms in the solid state (HFWS model). The MC data were compared with the experimental values. For both models, reasonably good agreement for Si-Cu and SiO 2-Cu systems was found. In the Au-Cu system, better agreement was achieved using the TFD model. The addition of C in a surface interaction layer of 2-5 nm improves the agreement between simulated and experimental values for the Si-Al and Si-SiO 2 systems.

  10. Low-energy elastic electron interactions with pyrimidine

    SciTech Connect

    Palihawadana, Prasanga; Sullivan, James; Buckman, Stephen; Brunger, Michael; Winstead, Carl; McKoy, Vincent; Garcia, Gustavo; Blanco, F.

    2011-12-15

    We present results of measurements and calculations of elastic electron scattering from pyrimidine in the energy range 3-50 eV. Absolute differential and integral elastic cross sections have been measured using a crossed electron-molecule beam spectrometer and the relative flow technique. The measured cross sections are compared with results of calculations using the well-known Schwinger variational technique and an independent-atom model. Agreement between the measured differential cross sections and the results of the Schwinger calculations is good at lower energies but less satisfactory at higher energies where inelastic channels that should be open are kept closed in the calculations.

  11. Calculations of {sup 8}He+p elastic cross sections using a microscopic optical potential

    SciTech Connect

    Lukyanov, V. K.; Zemlyanaya, E. V.; Lukyanov, K. V.; Kadrev, D. N.; Antonov, A. N.; Gaidarov, M. K.; Massen, S. E.

    2009-08-15

    An approach to calculate microscopic optical potential with the real part obtained by a folding procedure and with the imaginary part inherent in the high-energy approximation is applied to study the {sup 8}He+p elastic-scattering data at energies of tens of MeV/nucleon. The neutron and proton density distributions obtained in different models for {sup 8}He are used in the calculations of the differential cross sections. The role of the spin-orbit potential is studied. Comparison of the calculations with the available experimental data on the elastic-scattering differential cross sections at beam energies of 15.7, 26.25, 32, 66, and 73 MeV/nucleon is performed. The problem of the ambiguities of the depths of each component of the optical potential is considered by means of the imposed physical criterion related to the known behavior of the volume integrals as functions of the incident energy. It is shown also that the role of the surface absorption is rather important, in particular for the lowest incident energies (e.g., 15.7 and 26.25 MeV/nucleon)

  12. Quasi-elastic nuclear scattering at high energies

    NASA Technical Reports Server (NTRS)

    Cucinotta, Francis A.; Townsend, Lawrence W.; Wilson, John W.

    1992-01-01

    The quasi-elastic scattering of two nuclei is considered in the high-energy optical model. Energy loss and momentum transfer spectra for projectile ions are evaluated in terms of an inelastic multiple-scattering series corresponding to multiple knockout of target nucleons. The leading-order correction to the coherent projectile approximation is evaluated. Calculations are compared with experiments.

  13. A Microscopic Optical Potential Approach to {sup 6,8}He+p Elastic Scattering

    SciTech Connect

    Lukyanov, V. K.; Zemlyanaya, E. V.; Lukyanov, K. V.; Kadrev, D. N.; Antonov, A. N.; Gaidarov, M. K.; Massen, S. E.

    2009-08-26

    A microscopic approach to calculate the optical potential (OP) with the real part obtained by a folding procedure and with the imaginary part inherent in the high-energy approximation (HEA) is applied to study the {sup 6,8}He+p elastic scattering data at energies of tens of MeV/N. The OP's and the cross sections are calculated using different models for the neutron and proton densities of {sup 6,8}He. The role of the spin-orbit (SO) potential and effects of the energy and density dependence of the effective NN forces are studied. Comparison of the calculations with the available experimental data on the elastic scattering differential cross sections at beam energies <100 MeV/N is performed and conclusions on the role of the aforesaid effects are made. It is shown that the present approach, which uses only parameters that renormalize the depths of the OP, can be applied along with other methods like that from the microscopic g-matrix description of the complex proton optical potential.

  14. Comparison of Electron Elastic-Scattering Cross Sections Calculated from Two Commonly Used Atomic Potentials

    NASA Astrophysics Data System (ADS)

    Jablonski, A.; Salvat, F.; Powell, C. J.

    2004-06-01

    We have analyzed differential cross sections (DCSs) for the elastic scattering of electrons by neutral atoms that have been derived from two commonly used atomic potentials: the Thomas-Fermi-Dirac (TFD) potential and the Dirac-Hartree-Fock (DHF) potential. DCSs from the latter potential are believed to be more accurate. We compared DCSs for six atoms (H, Al, Ni, Ag, Au, and Cm) at four energies (100, 500, 1000, and 10 000 eV) from two databases issued by the National Institute of Standards and Technology in which DCSs had been obtained from the TFD and DHF potentials. While the DCSs from the two potentials had similar shapes and magnitudes, there can be pronounced deviations (up to 70%) for small scattering angles for Al, Ag, Au, and Cm. In addition, there were differences of up to 400% at scattering angles for which there were deep minima in the DCSs; at other angles, the differences were typically less than 20%. The DCS differences decreased with increasing electron energy. DCSs calculated from the two potentials were compared with measured DCSs for six atoms (He, Ne, Ar, Kr, Xe, and Hg) at energies between 50 eV and 3 keV. For Ar, the atom for which experimental data are available over the largest energy range there is good agreement between the measured DCSs and those calculated from the TFD and DHF potentials at 2 and 3 keV, but the experimental DCSs agree better with the DCSs from the DHF potential at lower energies. A similar trend is found for the other atoms. At energies less than about 1 keV, there are increasing differences between the measured DCSs and the DCSs calculated from the DHF potential. These differences were attributed to the neglect of absorption and polarizability effects in the calculations. We compare transport cross sections for H, Al, Ni, Ag, Au, and Cm obtained from the DCSs for each potential. For energies between 200 eV and 1 keV, the largest differences are about 20% (for H, Au, and Cm); at higher energies, the differences are smaller. We also examine the extent to which three quantities derived from DCSs vary depending on whether the DCSs were obtained from the TFD or DHF potential. First, we compare calculated and measured elastic-backscattered intensities for thin films of Au on a Ni substrate with different measurement conditions, but it is not clear whether DCSs from the TFD or DHF potential should be preferred. Second, we compare electron inelastic mean free paths (IMFPs) derived from relative and absolute measurements by elastic-peak electron spectroscopy and from analyses with DCSs obtained from the TFD and DHF potentials. In four examples, for a variety of materials and measurement conditions, we find differences between the IMFPs from the TFD and DHF potentials ranging from 1.3% to 17.1%. Third, we compare mean escape depths for two photoelectron lines and two Auger-electron lines in solid Au obtained using DCSs from the TFD and DHF potentials. The relative differences between these mean escape depths vary from 4.3% at 70 eV to0.5% at 2016 eV at normal electron emission, and become smaller with increasing emission angle. Although measured DCSs for atoms can differ from DCSs calculated from the DHF potential by up to a factor of 2, we find that the atomic DCSs are empirically useful for simulations of electron transport in solids for electron energies above about 300 eV. The atomic DCSs can also be useful for energies down to at least 200 eV if relative measurements are made.

  15. Energy distribution in disordered elastic networks

    NASA Astrophysics Data System (ADS)

    Plaza, Gustavo R.

    2010-09-01

    Disordered networks are found in many natural and artificial materials, from gels or cytoskeletal structures to metallic foams or bones. Here, the energy distribution in this type of networks is modeled, taking into account the orientation of the struts. A correlation between the orientation and the energy per unit volume is found and described as a function of the connectivity in the network and the relative bending stiffness of the struts. If one or both parameters have relatively large values, the struts aligned in the loading direction present the highest values of energy. On the contrary, if these have relatively small values, the highest values of energy can be reached in the struts oriented transversally. This result allows explaining in a simple way remodeling processes in biological materials, for example, the remodeling of trabecular bone and the reorganization in the cytoskeleton. Additionally, the correlation between the orientation, the affinity, and the bending-stretching ratio in the network is discussed.

  16. Measurements of radiated elastic wave energy from dynamic tensile cracks

    NASA Technical Reports Server (NTRS)

    Boler, Frances M.

    1990-01-01

    The role of fracture-velocity, microstructure, and fracture-energy barriers in elastic wave radiation during a dynamic fracture was investigated in experiments in which dynamic tensile cracks of two fracture cofigurations of double cantilever beam geometry were propagating in glass samples. The first, referred to as primary fracture, consisted of fractures of intact glass specimens; the second configuration, referred to as secondary fracture, consisted of a refracture of primary fracture specimens which were rebonded with an intermittent pattern of adhesive to produce variations in fracture surface energy along the crack path. For primary fracture cases, measurable elastic waves were generated in 31 percent of the 16 fracture events observed; the condition for radiation of measurable waves appears to be a local abrupt change in the fracture path direction, such as occurs when the fracture intersects a surface flaw. For secondary fractures, 100 percent of events showed measurable elastic waves; in these fractures, the ratio of radiated elastic wave energy in the measured component to fracture surface energy was 10 times greater than for primary fracture.

  17. Elastic and total cross sections for simple biomolecules in the intermediate energy range

    NASA Astrophysics Data System (ADS)

    Gupta, Dhanoj; Naghma, Rahla; Antony, Bobby

    2015-09-01

    The elastic and total cross sections for formaldehyde, acetaldehyde, acetone, 2-butanone and formamide are calculated using the spherical complex optical potential formalism in the intermediate energy range from 50 eV to 10 keV. These cross sections find application to various fields like radiation damage and biological sciences. The present results are compared with the available experimental and theoretical data and are found to give excellent agreement. The elastic cross sections reported for most of the targets in the present energy range are done for the first time. The energy dependence of the contribution of ionization and elastic cross section with respect to the total cross section and the correlation of total cross section with polarizability of the molecules are also studied.

  18. Gravitational potential as a source of earthquake energy

    USGS Publications Warehouse

    Barrows, L.; Langer, C.J.

    1981-01-01

    Some degree of tectonic stress within the earth originates from gravity acting upon density structures. The work performed by this "gravitational tectonics stress" must have formerly existed as gravitational potential energy contained in the stress-causing density structure. According to the elastic rebound theory (Reid, 1910), the energy of earthquakes comes from an elastic strain field built up by fairly continuous elastic deformation in the period between events. For earthquakes resulting from gravitational tectonic stress, the elastic rebound theory requires the transfer of energy from the gravitational potential of the density structures into an elastic strain field prior to the event. An alternate theory involves partial gravitational collapse of the stress-causing density structures. The earthquake energy comes directly from a net decrease in gravitational potential energy. The gravitational potential energy released at the time of the earthquake is split between the energy released by the earthquake, including work done in the fault zone and an increase in stored elastic strain energy. The stress associated with this elastic strain field should oppose further fault slip. ?? 1981.

  19. Elastic positron-cadmium scattering at low energies

    SciTech Connect

    Bromley, M. W. J.; Mitroy, J.

    2010-05-15

    The elastic and annihilation cross sections for positron-cadmium scattering are reported up to the positronium-formation threshold (at 2.2 eV). The low-energy phase shifts for the elastic scattering of positrons from cadmium were derived from the bound and pseudostate energies of a very large basis configuration-interaction calculation of the e{sup +}-Cd system. The s-wave binding energy is estimated to be 126{+-}42 meV, with a scattering length of A{sub scat}=(14.2{+-}2.1)a{sub 0}, while the threshold annihilation parameter, Z{sub eff}, was 93.9{+-}26.5. The p-wave phase shift exhibits a weak shape resonance that results in a peak Z{sub eff} of 91{+-}17 at a collision energy of about 490{+-}50 meV.

  20. Investigation of 17F+p elastic scattering at near-barrier energies

    NASA Astrophysics Data System (ADS)

    El-Azab Farid, M.; Ibraheem, Awad A.; Al-Hajjaji, Arwa S.

    2015-10-01

    The 17F +p elastic scattering at two near-barrier energies of 3.5 and 4.3 MeV/nucleon, have been analyzed in the framework of the single folding approach. The folded potentials are constructed by folding the density-dependent (DDM3Y) effective nucleon-nucleon interaction over the nuclear density of the one-proton halo nucleus 17F. Two versions of the density are considered. In addition, two versions of the one-nucleon knock-on exchange potentials are introduced to construct the real microscopic potentials. The derived potentials supplemented by phenomenological Woods-Saxon imaginary and spin-orbit potentials produced excellent description of the differential elastic scattering cross sections at the higher energy without need to introduce any renormalization. At the lower energy, however, in order to successfully reproduce the data, it is necessary to reduce the strength of the constructed real DDM3Y potential by about 25% of its original value. Furthermore, good agreement with data is obtained using the extracted microscopic DDM3Y potentials for both real and imaginary parts. Moreover, the interesting notch test is applied to investigate the sensitivity of the elastic scattering cross section to the radial distribution of the constructed microscopic potentials. The extracted reaction (absorption) cross sections are, also, investigated.

  1. Low-energy elastic electron scattering from ethylene: Elastic scattering and vibrational excitation

    NASA Astrophysics Data System (ADS)

    Khakoo, M. A.; Khakoo, S. M.; Sakaamini, A.; Hlousek, B. A.; Hargreaves, L. R.; Lee, J.; Murase, R.

    2016-01-01

    Normalized experimental differential and integral cross sections for elastic and vibrationally inelastic scattering of low-energy electrons from ethylene (C2H4 ) have been measured over a large number of incident electron energies and angles. The differential cross sections are measured at incident energies from 0.5 to 100 eV and scattering angles from 5° to 130°. These measurements are made to monitor the role of the 2g2B(≈1.8 eV ) and the higher 2u2B+1u2B+A2g (≈7.5 eV ) resonances in the scattering dynamics. Our differential cross section measurements are in very good to excellent agreement with past measurements, and in reasonable agreement with theory as regards forward scattering. A feature in the elastic cross section at 90° scattering angle at ≈3.5 eV is tentatively associated with the onset of excitation of the ˜a 1u3B triplet electronic state. Differential cross sections for vibrational excitation of four composite energy features in ethylene are also presented from incident energies of 1.25-15 eV. These results are compared to previous measurements with satisfactory results regarding resonant behavior of these features also concerning the role of the 2g2B (≈1.8 eV ) and the higher 2u2B+1u2B+A2g (≈7.5 eV ) resonances in the scattering dynamics.

  2. Low-Energy Elastic Electron Scattering by Atomic Oxygen

    NASA Technical Reports Server (NTRS)

    Zatsarinny O.; Bartschat, K.; Tayal, S. S.

    2006-01-01

    The B-spline R-matrix method is employed to investigate the low-energy elastic electron scattering by atomic oxygen. Flexible non-orthogonal sets of radial functions are used to construct the target description and to represent the scattering functions. A detailed investigation regarding the dependence of the predicted partial and total cross sections on the scattering model and the accuracy of the target description is presented. The predicted angle-integrated elastic cross sections are in good agreement with experiment, whereas significant discrepancies are found in the angle-differential elastic cross sections near the forward direction. .The near-threshold results are found to strongly depend on the treatment of inner-core short-range correlation effects in the target description, as well as on a proper account of the target polarizability. A sharp increase in the elastic cross sections below 1 eV found in some earlier calculations is judged to be an artifact of an unbalanced description of correlation in the N-electron target structure and the (N+l)-electron-collision problems.

  3. An energy formulation of continuum magneto-electro-elasticity with applications

    NASA Astrophysics Data System (ADS)

    Liu, Liping

    2014-02-01

    We present an energy formulation of continuum electro-elasticity and magneto-electro-elasticity. Based on the principle of minimum free energy, we propose a form of total free energy of the system in three dimensions, and then systematically derive the theories for a hierarchy of materials including dielectric elastomers, piezoelectric ceramics, ferroelectrics, flexoelectric materials, magnetic elastomers, magnetoelectric materials, piezo-electric-magnetic materials among others. The effects of mechanical, electrical and magnetic boundary devices, external charges, polarizations and magnetization are taken into account in formulating the free energy. The linear and nonlinear boundary value problems governing these materials are explicitly derived as the Euler-Lagrange equations of the principle of minimum free energy. Finally, we illustrate the applications of the formulations by presenting solutions to a few simple problems and give an outlook of potential applications.

  4. Absolute elastic differential electron scattering cross sections in the intermediate energy region. IV - CO

    NASA Technical Reports Server (NTRS)

    Tanaka, H.; Srivastava, S. K.; Chutjian, A.

    1978-01-01

    Using a crossed electron beam-molecular beam scattering geometry and a relative-flow technique, ratios of elastic differential cross sections of CO to those of He have been measured at electron impact energies of 3, 5, 7.5, 9.9, 15, 20, 30, 50, 75, and 100 eV. At each energy, an angular range of 15 to 130 deg has been covered. These ratios have been multiplied by previously known He elastic differential cross sections to obtain elastic differential cross sections for CO. Since pure rotational excitations were not resolved, the elastic differential cross sections are a sum of elastic and pure rotational excitations at room temperature. From a knowledge of differential cross sections (DCS), integral and momentum transfer cross sections have been calculated. Both the DCS and integral cross sections are compared at 50, 75, and 100 eV to a recent two-potential theory of e-molecule scattering. Present results show that the isoelectronic molecules CO and N2 have very similar magnitudes and shapes of their differential cross sections.

  5. Investigation of 16O+12C refractive elastic scattering using the ?-cluster model potential

    NASA Astrophysics Data System (ADS)

    Hassanain, Mahmoud A.

    2016-01-01

    Differential cross-section of the 16O+12C elastic scattering at E_{lab}=132, 181, 200, 260, 300, 608 and 1503MeV has been reanalyzed in the framework of double-folding cluster (DFC1) potential over a wide angular range which cover both diffractive and refractive regions. Based upon the ?-cluster structure of both colliding nuclei, the real DFC1 optical potential has been generated by using ?- ? effective interaction and new cluster modified Gaussian (CMGD) of target and projectile has also been extracted. Successful descriptions of the data were obtained over the full measured angular range at all considered energies. The results have been compared with the findings obtained by using the phenomenological approach as well as experimental data. Furthermore, the consistency between the real and imaginary volume integrals is checked by the dispersion relation and the total reaction cross-section has also been investigated.

  6. Low-energy elastic electron scattering by acetaldehyde

    NASA Astrophysics Data System (ADS)

    Gauf, A.; Navarro, C.; Balch, G.; Hargreaves, L. R.; Khakoo, M. A.; Winstead, C.; McKoy, V.

    2014-02-01

    We report results from a combined experimental and computational study of low-energy electron interactions with acetaldehyde in the gas phase. Differential cross sections for elastic electron scattering were measured at selected incident energies from 1 to 50 eV, while corresponding first-principles calculations were carried out up to 30 eV. Integral and momentum-transfer cross sections were derived from the angle-differential data. The role of resonances in the scattering is examined and comparison is made to previous results for acetaldehyde and for its analogs, formamide and formic acid.

  7. Energy distribution of elastically scattered electrons from double layer samples

    NASA Astrophysics Data System (ADS)

    Tőkési, K.; Varga, D.

    2016-02-01

    We present a theoretical description of the spectra of electrons elastically scattered from thin double layered Au-C samples. The analysis is based on the Monte Carlo simulation of the recoil and Doppler effects in reflection and transmission geometries of the scattering at a fixed angle of 44.3 ° and a primary energy of 40 keV. The relativistic correction is taken into account. Besides the experimentally measurable energy distributions the simulations give many partial distributions separately, depending on the number of elastic scatterings (single, and multiple scatterings of different types). Furthermore, we present detailed analytical calculations for the main parameters of the single scattering, taking into account both the ideal scattering geometry, i.e. infinitesimally small angular range, and the effect of the real, finite angular range used in the measurements. We show our results for intensity ratios, peak shifts and broadenings for four cases of measurement geometries and layer thicknesses. While in the peak intensity ratios of gold and carbon for transmission geometries were found to be in good agreement with the results of the single scattering model, especially large deviations were obtained in reflection geometries. The separation of the peaks, depending on the geometry and the thickness, generally smaller, and the peak width generally larger than it can be expected from the nominal values of the primary energy, scattering angle, and mean kinetic energy of the atoms. We also show that the peaks are asymmetric even for the case of the single scattering due to the finite solid angle. Finally, we present a qualitative comparison with the experimental data. We find our resulting energy distribution of elastically scattered electrons to be in good agreement with recent measurements.

  8. Inertia of Potential Energy

    ERIC Educational Resources Information Center

    Higbie, J.

    1975-01-01

    Demonstrates that when a system of attracting or repelling bodies is bound, its rest mass will generally be different than the sum of the rest masses of the individual bodies. The mass excess or defect is simply related to the stored potential energy of the system. (Author/MLH)

  9. High energy elastic and inelastic electron scattering by the Ne and Ar atoms: Electron correlation effects

    SciTech Connect

    Duguet, A.; Bennani, A.L.; Rouault, M.

    1983-09-15

    Elastic and inelastic differential cross sections (DCS) of high energy electrons (25 keV) scattered by neon and argon have been separately measured by totally independent methods. The effects of electronic correlations on the DCS and on the radial distribution functions D(R) and P(R) are deduced from experiment by comparison with theoretical Hartree--Fock values. An estimate of the correlation energy is also given. In the case of neon, the differences, with respect to Hartree--Fock, of the various contributions to atomic potential energy ..delta.. Vne, ..delta.. Vee/sup Coul/, and ..delta..Vee/sup exch/ are calculated from experiment and compared to theoretical results.

  10. Reinterpreting the energy dependence of the optical potential

    NASA Astrophysics Data System (ADS)

    Chamon, L. C.; Gasques, L. R.

    2016-01-01

    In earlier works, we proposed a model for the nuclear potential of α-nucleus systems which is energy independent and has no adjustable parameters. This interaction has been successfully applied in the description of fusion, elastic and inelastic scattering data for many of those systems in regions of low energy. In the present work, we assume the same interaction as the bare potential to study the elastic scattering for α + 208Pb in a wide energy range. We demonstrate that the corresponding data set can be described if couplings to inelastic states with high excitation energy are explicitly considered through coupled-channel calculations.

  11. Breakup and Elastic Scattering in the {sup 9}Be + {sup 144}Sm system at near barrier energies

    SciTech Connect

    Paes, B.; Garcia, V. N.; Lubian, J.; Gomes, P. R. S.; Padron, I.

    2010-05-21

    Breakup and elastic scattering in the Be + {sup 144}Sm system, at near barrier energies, are investigated. We calculate theoretically the non-capture breakup cross section by performing coupled reaction channel calculations. The energy dependence of the optical potential does not show the usual threshold anomaly found in tightly bound systems.

  12. Equivalent local potentials for energy dependent nonlocal interactions

    SciTech Connect

    Fiedeldey, H. ); Lipperheide, R. ); Rawitscher, G.H. ); Sofianos, S.A. )

    1992-06-01

    Various equivalent local potentials and their Perey factors are discussed. The Wronskian and inversion-type equivalent local potentials for the energy dependent nonlocal interaction induced by the coupling of the elastic to the nonelastic channels are investigated numerically. Their Perey factors are found to be closer to unity than those associated with exchange-type nonlocal potentials.

  13. Elastic scattering of low-energy electrons from toluene

    NASA Astrophysics Data System (ADS)

    Sakaamini, Ahmad; Hargreaves, L. R.; Khakoo, M. A.; Pastega, D. F.; Bettega, M. H. F.

    2016-04-01

    Theoretical and normalized experimental differential, momentum transfer, and integral cross sections for vibrationally elastic scattering of low-energy electrons from toluene (C6H5C H3 ) are presented. The differential cross sections are measured at incident energies from 1 to 20 eV and scattering angles from 15° to 130°. The calculated cross sections are obtained using the Schwinger multichannel method with pseudopotentials in the static-exchange plus polarization approximation. Comparisons are made between the present theory and measurements with earlier available measurements. In general, the agreement between the theory and the experiment is very good. We also discuss the resonance spectra of toluene, where we find three π* shape resonances whose locations agree well with the experiment. In addition, we compare the cross sections of toluene and benzene, since the former can be considered as a benzene derivative by the substitution of a hydrogen in benzene by a C H3 group in toluene.

  14. Low-energy elastic electron scattering from furan

    SciTech Connect

    Khakoo, M. A.; Muse, J.; Ralphs, K.; Costa, R. F.; Bettega, M. H. F.; Lima, M. A. P.

    2010-06-15

    We report normalized experimental and theoretical differential cross sections for elastic electron scattering by C{sub 4}H{sub 4}O (furan) molecules from a collaborative project between several Brazilian theoretical groups and an experimental group at California State Fullerton, USA. The measurements are obtained by using the relative flow method with helium as the standard gas and a thin aperture target gas collimating source. The relative flow method is applied without the restriction imposed by the relative flow pressure condition on helium and the unknown gas. The experimental data were taken at incident electron energies of 1, 1.5, 1.73, 2, 2.7, 3, 5, 7, 10, 20, 30, and 50 eV and covered the angular range between 10 deg. and 130 deg. The measurements verify observed {pi}* shape resonances at 1.65{+-}0.05eV and 3.10{+-}0.05 eV scattering energies, in good agreement with the transmission electron data of Modelli and Burrow [J. Phys. Chem. A 108, 5721 (2004)]. Furthermore, the present results also indicated both resonances dominantly in the d-wave channel. The differential cross sections are integrated in the standard way to obtain integral elastic cross sections and momentum transfer cross sections. The calculations employed the Schwinger multichannel method with pseudopotentials and were performed in the static-exchange and in the static-exchange plus polarization approximations. The calculated integral and momentum transfer cross sections clearly revealed the presence of two shape resonances located at 1.95 and 3.56 eV and ascribed to the B{sub 1} and A{sub 2} symmetries of the C{sub 2v} point group, respectively, in very good agreement with the experimental findings. Overall agreement between theory and experiment regarding the differential, momentum transfer, and integral cross sections is very good, especially for energies below 10 eV.

  15. Elastic scattering of {sup 9}Li on {sup 208}Pb at energies around the Coulomb barrier

    SciTech Connect

    Cubero, M.; Fernandez-Garcia, J. P.; Alvarez, M. A. G.; Lay, J. A.; Moro, A. M.; Acosta, L.; Martel, I.; Sanchez-Benitez, A. M.; Alcorta, M.; Borge, M. J. G.; Tengblad, O.; Buchmann, L.; Shotter, A.; Walden, P.; Diget, D. G.; Fulton, B.; Fynbo, H. O. U.; Galaviz, D.; Gomez-Camacho, J.; Mukha, I.

    2011-10-28

    We have studied the dynamical effects of the halo structure of {sup 11}Li on the scattering on heavy targets at energies around the Coulomb barrier. This experiment was performed at ISAC-II at TRIUMF with a world record in production of the post-accelerated {sup 11}Li beam. As part of this study we report here on the first measurement of the elastic cross section of the core nucleus, i.e. {sup 9}Li on {sup 208}Pb, at energies around the Coulomb barrier. A preliminary optical model analysis has been performed in order to extract a global optical potential to describe the measured angular distributions.

  16. Anchoring energy and orientational elasticity of a ferroelectric liquid crystal

    SciTech Connect

    Kaznacheev, A. V.; Pozhidaev, E. P.

    2012-06-15

    The dielectric susceptibility of a helix-free ferroelectric liquid crystal layer has been experimentally and theoretically studied as a function of the layer thickness. The investigation has been performed on the inner branch of the polarization hysteresis loop, in the region of a linear dependence of the polarization on the electric field. The experimental results are explained using the notion of effective layer thickness, which involves the characteristic distance {xi} over which the orienting effect of interfaces is operative. Comparison of the experimental data and theoretical results made it possible to estimate this distance as {xi} = 41 {mu}m and evaluate the anchoring energy (W = 2.8 Multiplication-Sign 10{sup -3}-1.1 Multiplication-Sign 10{sup -2} J/m{sup 2}) and the intralayer elastic constant (K Double-Prime Almost-Equal-To 1 Multiplication-Sign 10{sup -8}-3 Multiplication-Sign 10{sup -7} N).

  17. Failure of the Woods-Saxon nuclear potential to simultaneously reproduce precise fusion and elastic scattering measurements

    SciTech Connect

    Mukherjee, A.; Hinde, D. J.; Dasgupta, M.; Newton, J. O.; Butt, R. D.; Hagino, K.

    2007-04-15

    A precise fusion excitation function has been measured for the {sup 12}C+{sup 208}Pb reaction at energies around the barrier, allowing the fusion barrier distribution to be extracted. The fusion cross sections at high energies differ significantly from existing fusion data. Coupled reaction channels calculations have been carried out with the code FRESCO. A bare potential previously claimed to uniquely describe a wide range of {sup 12}C+{sup 208}Pb near-barrier reaction channels failed to reproduce the new fusion data. The nuclear potential diffuseness of 0.95 fm which fits the fusion excitation function over a broad energy range fails to reproduce the elastic scattering. A diffuseness of 0.55 fm reproduces the fusion barrier distribution and elastic scattering data, but significantly overpredicts the fusion cross sections at high energies. This may be due to physical processes not included in the calculations. To constrain calculations, it is desirable to have precisely measured fusion cross sections, especially at energies around the barrier.

  18. Rotationally elastic total cross sections for NH3 on electron impact over a wide energy range

    NASA Astrophysics Data System (ADS)

    Vinodkumar, Minaxi; Limbachiya, Chetan; Antony, Bobby

    2011-10-01

    Electron molecule collisions are important over incident energy from very low (0.01 eV) to intermediate and high energies (10 keV). We present rotationally elastic total cross sections for electron scattering for NH3 from 0.01 eV to 2 keV using two different theoretical formalisms. We use Quantemol-N formalism for calculating total cross sections up to threshold of the target and the Spherical Optical Complex Potential (SCOP) method for calculating total cross sections beyond threshold up to 2 keV. Electron molecule collisions are important over incident energy from very low (0.01 eV) to intermediate and high energies (10 keV). We present rotationally elastic total cross sections for electron scattering for NH3 from 0.01 eV to 2 keV using two different theoretical formalisms. We use Quantemol-N formalism for calculating total cross sections up to threshold of the target and the Spherical Optical Complex Potential (SCOP) method for calculating total cross sections beyond threshold up to 2 keV. MVK and BA thank DST, CGL thanks UGC new Delhi.

  19. Alaska's renewable energy potential.

    SciTech Connect

    Not Available

    2009-02-01

    This paper delivers a brief survey of renewable energy technologies applicable to Alaska's climate, latitude, geography, and geology. We first identify Alaska's natural renewable energy resources and which renewable energy technologies would be most productive. e survey the current state of renewable energy technologies and research efforts within the U.S. and, where appropriate, internationally. We also present information on the current state of Alaska's renewable energy assets, incentives, and commercial enterprises. Finally, we escribe places where research efforts at Sandia National Laboratories could assist the state of Alaska with its renewable energy technology investment efforts.

  20. Solution for boson-diboson elastic scattering at zero energy in the shape-independent model

    NASA Astrophysics Data System (ADS)

    Macek, J. H.; Ovchinnikov, Serge; Gasaneo, Gustavo

    2005-09-01

    We derive an exact analytic expression for the boson-diboson elastic scattering phase shift in the shape-independent model for positive two-body scattering lengths when the total energy vanishes. A three-body hard-core potential depending upon a hyperradial cutoff parameter R0 is introduced to obtain a finite result. The exact result is compared with adiabatic hyperspherical calculations of the phase shift, and a similar functional dependence on the cutoff parameter is found. The cutoff parameter plays the role of a renormalization constant in that it renormalizes the wave function at vanishing hyperradius.

  1. Experimental validation of theoretical methods to estimate the energy radiated by elastic waves during an impact

    NASA Astrophysics Data System (ADS)

    Farin, Maxime; Mangeney, Anne; Rosny, Julien de; Toussaint, Renaud; Sainte-Marie, Jacques; Shapiro, Nikolaï M.

    2016-02-01

    Estimating the energy lost in elastic waves during an impact is an important problem in seismology and in industry. We propose three complementary methods to estimate the elastic energy radiated by bead impacts on thin plates and thick blocks from the generated vibration. The first two methods are based on the direct wave front and are shown to be equivalent. The third method makes use of the diffuse regime. These methods are tested for laboratory experiments of impacts and are shown to give the same results, with error bars of 40 percent and 300 percent for impacts on a smooth plate and on a rough block, respectively. We show that these methods are relevant to establish the energy budget of an impact. On plates of glass and PMMA, the radiated elastic energy increases from 2 percent to almost 100 percent of the total energy lost as the bead diameter approaches the plate thickness. The rest of the lost energy is dissipated by viscoelasticity. For beads larger than the plate thickness, plastic deformation occurs and reduces the amount of energy radiated in the form of elastic waves. On a concrete block, the energy dissipation during the impact is principally inelastic because only 0.2-2 percent of the energy lost by the bead is transported by elastic waves. The radiated elastic energy estimated with the presented methods is quantitatively validated by Hertz's model of elastic impact.

  2. Low-energy electron elastic scattering cross sections for excited Au and Pt atoms

    NASA Astrophysics Data System (ADS)

    Felfli, Zineb; Eure, Amanda R.; Msezane, Alfred Z.; Sokolovski, Dmitri

    2010-05-01

    Electron elastic total cross sections (TCSs) and differential cross sections (DCSs) in both impact energy and scattering angle for the excited Au and Pt atoms are calculated in the electron impact energy range 0 ⩽ E ⩽ 4.0 eV. The cross sections are found to be characterized by very sharp long-lived resonances whose positions are identified with the binding energies of the excited anions formed during the collisions. The recent novel Regge-pole methodology wherein is embedded through the Mulholland formula the electron-electron correlations is used together with a Thomas-Fermi type potential incorporating the crucial core-polarization interaction for the calculations of the TCSs. The DCSs are evaluated using a partial wave expansion. The Ramsauer-Townsend minima, the shape resonances and the binding energies of the excited Au - and Pt - anions are extracted from the cross sections, while the critical minima are determined from the DCSs.

  3. The elastic modulus correction term in creep activation energies Applied to oxide dispersion strengthened superalloy

    NASA Technical Reports Server (NTRS)

    Malu, M.; Tien, J. K.

    1975-01-01

    The effect of elastic modulus and the temperature dependence of elastic modulus on creep activation energies for an oxide dispersion strengthened nickel-base superalloy are investigated. This superalloy is commercially known as Inconel Alloy MA 753, strengthened both by gamma-prime precipitates and by yttria particles. It is shown that at intermediate temperatures, say below 1500 F, where elastic modulus is weakly dependent on temperature, the modulus correction term to creep activation energy is small. Accordingly, modulus corrections are insignificant for the superalloy considered, which shows high apparent creep activation energies at this temperature. On the contrary, at very high temperatures, the elastic modulus correction term can be significant, thus reducing the creep activation energy to that of vacancy self-diffusion. In order to obtain high-temperature creep resistance, a high-value elastic modulus with a weak dependence on temperature is required.

  4. Phenomenological optical potential analysis of proton-carbon elastic scattering at 200 MeV

    NASA Technical Reports Server (NTRS)

    Bidasaria, H. B.; Townsend, L. W.

    1982-01-01

    Differential cross sections for 200 MeV protons elastically scattered from C-12 were analyzed utilizing a local, complex, spin-dependent optical potential with a harmonic well radial dependence. Analyses were performed using the WKB and eikonal approximations. For the latter, first-order corrections to he phase shifts were incorporated to account for the spin-orbit contribution. Large disagreement between theory and experiment was observed when the usual Thomas form for the spin-orbit potential was utilized. Substantial improvement was obtained by allowing the parameters in the central and spin-orbit potential terms to vary independently.

  5. Kangaroo rat locomotion: design for elastic energy storage or acceleration?

    PubMed

    Biewener, A A; Blickhan, R

    1988-11-01

    Mechanical stresses (force/cross-sectional area) acting in muscles, tendons and bones of the hindlimbs of kangaroo rats (Dipodomys spectabilis) were calculated during steady-speed hops and vertical jumps. Stresses were determined from both high-speed ciné films (light and X-ray) and force plate recordings, as well as from in vivo tendon force recordings. Stresses in each hindlimb support element during hopping (1.6-3.1 m s-1) were generally only 33% of those acting during jumping (greater than or equal to 40 cm height): ankle extensor muscles, 80 +/- 12 (S.D.) versus 297 +/- 42 kPa; ankle extensor tendons, 7.9 +/- 1.5 versus 32.7 +/- 4.8 MPa; tibia, -29 +/- 5 versus -110 +/- 25 MPa (all values are for hopping versus jumping). The magnitude of stress in each structure during these locomotor activities was similarly matched to the strength of each element, so that a consistent safety factor to failure is achieved for the hindlimb as a whole (1.5-2.0). The large stresses during jumping were correlated with a three-fold increase in ground reaction forces exerted on the ground compared with the fastest steady hopping speeds. We conclude that, for its size, the kangaroo rat has disproportionately large hindlimb muscles, tendons and bones to withstand the large forces associated with rapid acceleration to avoid predation, which limits their ability to store and recover elastic strain energy. Middle ear morphology and behavioural observations of kangaroo rats jumping vertically to avoid predation by owls and rattlesnakes support this view. PMID:3204333

  6. The effect of breakup of 6Li on elastic scattering and fusion with 28Si at near barrier energies

    NASA Astrophysics Data System (ADS)

    Sinha, Mandira; Roy, Subinit; Basu, P.; Majumdar, H.

    2016-01-01

    Elastic scattering angular distributions for 6Li+28Si system were measured at Elab = 16, 21MeV and analyzed along with the existing data from the previous measurements in the energy range of Elab = 7.5 - 27MeV. The measured cross-sections and the existing data, forming a set of angular distributions over a range of E/Vb = 0.9 - 3.23, were analyzed using the phenomenological optical model potential (OMP). Three different sets of potential parameters were used. The energy dependence of the real and the imaginary potential strengths were, subsequently, extracted at the radius of sensitivity (Rav) for the system. Continuum Discretized Coupled Channel (CDCC) calculation was performed to explore the contribution of projectile break-up (BU) on the observed energy dependence of the effective potential for elastic scattering of 6Li from 28Si. The energy variation of the strength of the real potential with continuum coupling was found to agree with the energy dependence of the same extracted from the (OMP) analysis at energies around the barrier. But the behavior of the imaginary strength appeared to be different. The calculated fusion cross-sections, including the effect of BU, clearly overestimated the measured fusion excitation function data in the below and near barrier energies but compared well with the data at higher energies.

  7. The elastic energy and character of quakes in solid stars and planets

    NASA Technical Reports Server (NTRS)

    Pines, D.; Shaham, J.

    1972-01-01

    The quadrupolar mechanical energy of a rotating axially symmetric solid planet (with or without a liquid interior) is calculated using methods previously developed for neutron stars in which an elastic reference tensor is introduced to describe the build-up of elastic energy in the star. The basic parameters of the theory (the gravitational energy A and elastic energy B) depend upon the internal structure of the planet and may be calculated from specific planetary models. Explicit expressions are obtained for the Love numbers, and for the planetary wobble frequency. The theory provides a simple relationship between changes in shape or axis of figure of the planet and elastic energy release. The theory is extended to describe the Earth by taking into account isostasy, triaxiality and the observed lithospheric configuration.

  8. Analysis of structures in the cross sections for elastic scattering and spin exchange in low-energy H+ +H collisions

    NASA Astrophysics Data System (ADS)

    Krstić, P. S.; Macek, J. H.; Ovchinnikov, S. Yu.; Schultz, D. R.

    2004-10-01

    Elastic scattering and spin exchange cross sections in H++H collisions are computed using accurate adiabatic potential curves for the center-of-mass energy range 10-4energy grid to resolve them. We analyze the structures using a comparison equation method to find the poles of the scattering matrix in the complex energy plane. We show that many features of the cross sections can be correlated with these poles and tabulate the positions of the most important poles. Finding stationary phases in the partial wave cross sections, we also explain in all details the glory oscillations of the elastic cross section that extends below 100eV down to the lowest energies.

  9. Analytical representation of elastic scattering cross sections of low energy electrons by atmospheric gases

    NASA Technical Reports Server (NTRS)

    Ivanov, V. Y.; Sipov, N. K.; Shneyder, V. A.

    1977-01-01

    Analytical representations of the elastic scattering cross sections of electrons with energies of 0.01-1 keV in atmospheric gases of N2, O2, O are given. These representations are suitable for the Monte Carlo method.

  10. Analysis of Dermal Elastic Fibers in the Absence of Fibulin-5 Reveals Potential Roles for Fibulin-5 in Elastic Fiber Assembly

    PubMed Central

    Choi, Jiwon; Bergdahl, Andreas; Zheng, Qian; Starcher, Barry; Yanagisawa, Hiromi; Davis, Elaine C.

    2009-01-01

    Fibulin-5 is a 66 kDa modular, extracellular matrix protein that localizes to elastic fibers. Although in vitro protein-protein binding studies have shown that fibulin-5 binds many proteins involved in elastic fiber formation, the specific role of fibulin-5 in elastogenesis remains unclear. To provide a more detailed analysis of elastic fiber assembly in the absence of fibulin-5, the dermis of wild-type and fibulin-5 gene knockout (Fbln5?/?) mice was examined with electron microscopy (EM). Although light microscopy showed apparently normal elastic fibers near the hair follicles and the absence of elastic fibers in the intervening dermis of the Fbln5?/? mouse, EM revealed the presence of aberrantly assembled elastic fibers in both locales. Instead of the elastin being incorporated into the microfibrillar scaffold, the elastin appeared as globules juxtaposed to the microfibrils. Desmosine analysis showed significantly lower levels of mature cross-linked elastin in the the Fbln5?/? dermis, however, gene expression levels for tropoelastin and fibrillin-1, the major elastic fiber components, were unaffected. Based on these results, the nature of tropoelastin cross-linking was investigated using domain specific antibodies to lysyl oxidase like-1 (LOXL-1). Immunolocalization with an antibody to the N-terminal pro-peptide, which is cleaved to generate the active enzyme, revealed abundant staining in the Fbln5?/? dermis and no staining in the wild-type dermis. Overall, these results suggest two previously unrecognized functions for fibulin-5 in elastogenesis; first, to limit the extent of aggregation of tropoelastin monomers and/or coacervates and aid in the incorporation of elastin into the microfibril bundles, and second, to potentially assist in the activation of LOXL-1. PMID:19321153

  11. Low-Energy Elastic Scattering of Electrons from Highly Polarizable Atoms

    NASA Astrophysics Data System (ADS)

    Ji, Weixing; McEachran, R. P.; Stauffer, A. D.

    2000-06-01

    In elastic scattering of electrons from atomic systems it is necessary to include the effect of the polarization of the atomic target by the incident electron in order to obtain reliable results for cross sections and spin polarization parameters. For highly polarizable systems such as the alkalis or excited states of atoms, the perturbative polarized-orbital method [1] does not yield accurate polarization potentials. Thus we have developed a non-perturbative method for generating polarization potentials for such systems [2] and applied it to one-electron systems, primarily the alkalis. We will present results for elastic scattering of electrons from ground state cesium atoms and excited states of sodium. Results for spin polarization parameters as well as differential cross sections in the low-energy regime will be presented and compared with experimental results where available. [1] R P McEachran, D L Morgan, A G Ryman and A D Stauffer, J. Phys. B 10, 663 (1977) [2] R P McEachran, L A Parcell and A D Stauffer, J. Phys. B 28, 2487 (1995)

  12. Low energy elastic electron scattering from CF{sub 3}Br molecules

    SciTech Connect

    Hargreaves, L. R.; Brunton, J. R.; Maddern, T. M.; Brunger, M. J.

    2015-03-28

    CF{sub 3}Br is a potentially valuable precursor molecule for generating beams of gas phase Br radicals suitable for electron collisions studies. However, the utility of CF{sub 3}Br for this purpose depends critically on the availability of sound scattering cross sections to allow the contribution of the precursor to be isolated within the total scattering signal. To this end, here we present elastic differential cross section (DCS) measurements for CF{sub 3}Br at incident energies between 15 and 50 eV. Comparison of these DCSs to those from the only other available experimental study [Sunohara et al., J. Phys. B: At., Mol. Opt. Phys. 36, 1843 (2003)] and a Schwinger multichannel with pseudo potentials (SMCPPs) calculation [Bettega et al., J. Phys. B: At., Mol. Opt. Phys. 36, 1263 (2003)] shows generally a very good accord. Integral elastic and momentum transfer cross sections, derived from our DCSs, are also found to be in quite good agreement with the SMCPP results.

  13. Close-coupling calculations with an INDOX/1s static potential, semiclassical exchange, and a semi-empirical polarisation potential for electron-CO2 elastic scattering and rotational excitation

    NASA Technical Reports Server (NTRS)

    Onda, K.; Truhlar, D. G.

    1979-01-01

    A semiempirical molecular-orbital method for modelling the effective potential for electron-molecule scattering is applied to elastic scattering and rotational excitation of CO2 at 20 eV impact energy. Agreement with experiment is reasonably good. The calculated rotationally summed integral cross section is 67.8 a sub 0 squared.

  14. Contribution to the theory of tidal oscillations of an elastic earth. External tidal potential

    NASA Technical Reports Server (NTRS)

    Musen, P.

    1974-01-01

    The differential equations of the tidal oscillations of the earth were established under the assumption that the interior of the earth is laterally inhomogeneous. The theory was developed using vectorial and dyadic symbolism to shorten the exposition and to reduce the differential equations to a symmetric form convenient for programming and for numerical integration. The formation of tidal buldges on the surfaces of discontinuity and the changes in the internal density produce small periodic variations in the exterior geopotential which are reflected in the motion of artificial satellites. The analoques of Love elastic parameters in the expansion of exterior tidal potential reflect the asymmetric and inhomogeneous structure of the interior of the earth.

  15. The human iliotibial band is specialized for elastic energy storage compared with the chimp fascia lata.

    PubMed

    Eng, Carolyn M; Arnold, Allison S; Biewener, Andrew A; Lieberman, Daniel E

    2015-08-01

    This study examines whether the human iliotibial band (ITB) is specialized for elastic energy storage relative to the chimpanzee fascia lata (FL). To quantify the energy storage potential of these structures, we created computer models of human and chimpanzee lower limbs based on detailed anatomical dissections. We characterized the geometry and force-length properties of the FL, tensor fascia lata (TFL) and gluteus maximus (GMax) in four chimpanzee cadavers based on measurements of muscle architecture and moment arms about the hip and knee. We used the chimp model to estimate the forces and corresponding strains in the chimp FL during bipedal walking, and compared these data with analogous estimates from a model of the human ITB, accounting for differences in body mass and lower extremity posture. We estimate that the human ITB stores 15- to 20-times more elastic energy per unit body mass and stride than the chimp FL during bipedal walking. Because chimps walk with persistent hip flexion, the TFL and portions of GMax that insert on the FL undergo smaller excursions (origin to insertion) than muscles that insert on the human ITB. Also, because a smaller fraction of GMax inserts on the chimp FL than on the human ITB, and thus its mass-normalized physiological cross-sectional area is about three times less in chimps, the chimp FL probably transmits smaller muscle forces. These data provide new evidence that the human ITB is anatomically derived compared with the chimp FL and potentially contributes to locomotor economy during bipedal locomotion. PMID:26026035

  16. Elastic and vibrational properties of group IV semiconductors in empirical potential modelling.

    PubMed

    Monteverde, U; Migliorato, M A; Pal, J; Powell, D

    2013-10-23

    We have developed an interatomic potential that with a single set of parameters is able to accurately describe at the same time the elastic, vibrational and thermodynamics properties of semiconductors. The simultaneous inclusion of radial and angular forces of the interacting atom pairs (short range) together with the influence of the broken crystal symmetry when the atomic arrangement is out of equilibrium (long range) results in correct predictions of all of the phonon dispersion spectrum and mode-Grüneisen parameters of silicon and germanium. The long range interactions are taken into account up to the second nearest neighbours, to correctly influence the elastic and vibrational properties, and therefore represent only a marginal computational cost compared to the full treatment of other proposed potentials.Results of molecular dynamics simulations are compared with those of ab initio calculations, showing that when our proposed potential is used to perform the initial stages of the structural relaxation, a significant reduction of the computational time needed during the geometry optimization of density functional theory simulations is observed. PMID:24065386

  17. Detailed study and mean field interpretation of {sup 16}O+{sup 12}C elastic scattering at seven medium energies

    SciTech Connect

    Nicoli, M. P.; Haas, F.; Freeman, R. M.; Szilner, S.; Basrak, Z.; Morsad, A.; Satchler, G. R.; Brandan, M. E.

    2000-03-01

    Detailed measurements of the elastic scattering of {sup 16}O ions from {sup 12}C have been carried out at seven energies from 62 to 124 MeV, at center-of-mass angles from about 10 degree sign to about 145 degree sign . A coherent optical model analysis of these data has been performed using both the Woods-Saxon and the folding-model potentials. The extracted results are consistent with analyses of data at higher energies for this and similar light heavy-ion systems. Some model-independent spline forms for the real potentials were also investigated. (c) 2000 The American Physical Society.

  18. LHC Physics Potential versus Energy

    SciTech Connect

    Quigg, Chris; /Fermilab

    2009-08-01

    Parton luminosities are convenient for estimating how the physics potential of Large Hadron Collider experiments depends on the energy of the proton beams. I present parton luminosities, ratios of parton luminosities, and contours of fixed parton luminosity for gg, u{bar d}, and qq interactions over the energy range relevant to the Large Hadron Collider, along with example analyses for specific processes.

  19. Variation of the energy release rate as a crack approaches and passes through an elastic inclusion

    NASA Technical Reports Server (NTRS)

    Li, Rongshun; Chudnovsky, A.

    1993-01-01

    The variation of the energy release rate (ERP) at the tip of a crack penetrating an elastic inclusion is analyzed using an approach involving modeling the random array of microcracks or other defects by an elastic inclusion with effective elastic properties. Computations are carried out using a finite element procedure. The eight-noded isoparametric serendipity element with the shift of the midpoint to the quarter-point is used to simulate the singularity at the crack tip, and the crack growth is accommodated by implementing a mesh regeneration technique. The ERP values were calculated for various crack tip positions which simulate the process of the crack approaching and penetrating the inclusion.

  20. On granular elasticity

    PubMed Central

    Sun, Qicheng; Jin, Feng; Wang, Guangqian; Song, Shixiong; Zhang, Guohua

    2015-01-01

    Mesoscopic structures form in dense granular materials due to the self-organisation of the constituent particles. These structures have internal structural degrees of freedom in addition to the translational degree of freedom. The resultant granular elasticity, which exhibits intrinsic variations and inevitable relaxation, is a key quantity that accounts for macroscopic solid- or fluid-like properties and the transitions between them. In this work, we propose a potential energy landscape (PEL) with local stable basins and low elastic energy barriers to analyse the nature of granular elasticity. A function for the elastic energy density is proposed for stable states and is further calibrated with ultrasonic measurements. Fluctuations in the elastic energy due to the evolution of internal structures are proposed to describe a so-called configuration temperature Tc as a counterpart of the classical kinetic granular temperature Tk that is attributed to the translational degrees of freedom. The two granular temperatures are chosen as the state variables, and a fundamental equation is established to develop non-equilibrium thermodynamics for granular materials. Due to the relatively low elastic energy barrier in the PEL, granular elasticity relaxes more under common mechanical loadings, and a simple model based on mean-field theory is developed to account for this behaviour. PMID:25951049

  1. The series elastic shock absorber: tendon elasticity modulates energy dissipation by muscle during burst deceleration.

    PubMed

    Konow, Nicolai; Roberts, Thomas J

    2015-04-01

    During downhill running, manoeuvring, negotiation of obstacles and landings from a jump, mechanical energy is dissipated via active lengthening of limb muscles. Tendon compliance provides a 'shock-absorber' mechanism that rapidly absorbs mechanical energy and releases it more slowly as the recoil of the tendon does work to stretch muscle fascicles. By lowering the rate of muscular energy dissipation, tendon compliance likely reduces the risk of muscle injury that can result from rapid and forceful muscle lengthening. Here, we examine how muscle-tendon mechanics are modulated in response to changes in demand for energy dissipation. We measured lateral gastrocnemius (LG) muscle activity, force and fascicle length, as well as leg joint kinematics and ground-reaction force, as turkeys performed drop-landings from three heights (0.5-1.5 m centre-of-mass elevation). Negative work by the LG muscle-tendon unit during landing increased with drop height, mainly owing to greater muscle recruitment and force as drop height increased. Although muscle strain did not increase with landing height, ankle flexion increased owing to increased tendon strain at higher muscle forces. Measurements of the length-tension relationship of the muscle indicated that the muscle reached peak force at shorter and likely safer operating lengths as drop height increased. Our results indicate that tendon compliance is important to the modulation of energy dissipation by active muscle with changes in demand and may provide a mechanism for rapid adjustment of function during deceleration tasks of unpredictable intensity. PMID:25716796

  2. Price Elasticities for Energy Use in Buildings of the United States

    EIA Publications

    2014-01-01

    Energy demand tends to be responsive to changes in energy prices, a concept in economics known as price elasticity. Generally, an increase in a fuel price causes users to use less of that fuel or switch to a different fuel. The extent to which each of these changes takes place is of high importance to stakeholders in the energy sector and especially in energy planning. The purpose of this analysis is to determine fuel-price elasticities in stationary structures, particularly in the residential and commercial sectors.

  3. Microscopic description of {sup 4}He + {sup 4}He elastic scattering over the energy range E=100-280 MeV

    SciTech Connect

    El-Azab Farid, M.

    2006-12-15

    Analysis of the differential cross sections for {sup 4}He +{sup 4}He elastic scattering is performed within the framework of the double-folding optical model. Two appropriate effective nucleon-nucleon interactions are employed to generate the {alpha}-{alpha} folded real potentials. The obtained potentials in conjunction with phenomenological Woods-Saxon (WS) derivative imaginary potentials are used to investigate six sets of the elastic scattering data through the energy range 100-280 MeV. Successful reproduction of the data is obtained by both considered interactions. In addition, real phenomenological potentials expressed in a squared WS form are successfully used to reproduce these data.

  4. Target Flexibility in RNA−Ligand Docking Modeled by Elastic Potential Grids

    PubMed Central

    2011-01-01

    The highly flexible nature of RNA provides a formidable challenge for structure-based drug design approaches that target RNA. We introduce an approach for modeling target conformational changes in RNA−ligand docking based on potential grids that are represented as elastic bodies using Navier's equation. This representation provides an accurate and efficient description of RNA−ligand interactions even in the case of a moving RNA structure. When applied to a data set of 17 RNA−ligand complexes, filtered out of the largest validation data set used for RNA−ligand docking so far, the approach is twice as successful as docking into an apo structure and still half as successful as redocking to the holo structure. The approach allows considering RNA movements of up to 6 Å rmsd and is based on a uniform and robust parametrization of the properties of the elastic potential grids, so that the approach is applicable to different RNA−ligand complex classes. PMID:24900336

  5. Potential biomedical and commercial applications of cold hibernated elastic memory (CHEM) self-deployable foam structures

    NASA Astrophysics Data System (ADS)

    Sokolowski, Witold

    2004-02-01

    A cold hibernated elastic memory (CHEM) foam structure is one of the most recent results of the quest for simple, reliable and low-cost expandable space structures. The CHEM technology utilizes shape memory polymers in open cellular (foam) structure or sandwich structures made of shape memory polymer foam cores and polymeric composite skins. It takes advantage of the polymer"s heat activated shape memory in addition to the foam"s elastic recovery to deploy a compacted structure. The glass transition temperature Tg is tailored to rigidize the structure in the fully deployed configuration. Previous experimental and analytical results were very encouraging and indicated that the CHEM foam technology can perform robustly in space as well as in the Earth environment. CHEM structures are described here and their major advantages are identified over other expandable/deployable structures. Although the space community is the original major beneficiary, a number of potential applications are also anticipated for the "earth environment". CHEM developers strongly believe that this technology has great promise for a host of commercial and bio-medical applications. Some of these potential and already investigated CHEM applications are described in this paper.

  6. The series elastic shock absorber: tendon elasticity modulates energy dissipation by muscle during burst deceleration

    PubMed Central

    Konow, Nicolai; Roberts, Thomas J.

    2015-01-01

    During downhill running, manoeuvring, negotiation of obstacles and landings from a jump, mechanical energy is dissipated via active lengthening of limb muscles. Tendon compliance provides a ‘shock-absorber’ mechanism that rapidly absorbs mechanical energy and releases it more slowly as the recoil of the tendon does work to stretch muscle fascicles. By lowering the rate of muscular energy dissipation, tendon compliance likely reduces the risk of muscle injury that can result from rapid and forceful muscle lengthening. Here, we examine how muscle–tendon mechanics are modulated in response to changes in demand for energy dissipation. We measured lateral gastrocnemius (LG) muscle activity, force and fascicle length, as well as leg joint kinematics and ground-reaction force, as turkeys performed drop-landings from three heights (0.5–1.5 m centre-of-mass elevation). Negative work by the LG muscle–tendon unit during landing increased with drop height, mainly owing to greater muscle recruitment and force as drop height increased. Although muscle strain did not increase with landing height, ankle flexion increased owing to increased tendon strain at higher muscle forces. Measurements of the length–tension relationship of the muscle indicated that the muscle reached peak force at shorter and likely safer operating lengths as drop height increased. Our results indicate that tendon compliance is important to the modulation of energy dissipation by active muscle with changes in demand and may provide a mechanism for rapid adjustment of function during deceleration tasks of unpredictable intensity. PMID:25716796

  7. Elastic and inelastic angular distributions of the 7Li+120Sn system for energies near the Coulomb barrier

    NASA Astrophysics Data System (ADS)

    Zagatto, V. A. B.; Oliveira, J. R. B.; Gasques, L. R.; Alcántara-Núñez, J. A.; Duarte, J. G.; Aguiar, V. P.; Medina, N. H.; Seale, W. A.; Pires, K. C. C.; Freitas, A.; Lubian, J.; Shorto, J. M. B.; Genezini, F. A.; Rossi, E. S., Jr.

    2016-06-01

    The reaction of 7Li+120Sn has been measured at bombarding energies of 21, 24 and 27 MeV. The {2}+\\to {0}+ γ -ray transition in 120Sn was observed and the angular distribution for the 2+ excited state was obtained. Coupled channels and coupled-reaction channels calculations, including the dynamical polarization potential due to the projectile break-up, obtained from continuum discretized coupled channel calculations, were performed. The comparison between the existing experimental elastic angular distribution with the coupled-reaction channels calculations indicates that the 1n stripping transfer is the most intense channel to be coupled and the 2n stripping reaction occurs sequentially rather than directly, however, further data must be analyzed to confirm this indication. The experimental elastic and inelastic scattering data were well described by the calculations, but some discrepancies in these channels may indicate the need for corrections to the nuclear potential and/or the necessity to incorporate further channels.

  8. Regulation of residual stress in elastic solid component with high-energy acoustic field

    NASA Astrophysics Data System (ADS)

    Song, W. T.; Xu, C. G.; Pan, Q. X.; Yang, X. C.; Xu, L.; Guo, J.

    2013-01-01

    The ultrasonic regulation of internal residual stress in metal and nonmetal elastic solid component has been investigated. High-energy ultrasonic wave is applied to carbon steel and ordinary flat glass for residual stress control. An ultrasonic residual stress measurement device developed with the acoustoelastic theory is used to measure macro residual stress in time, to evaluate the residual stress regulation effectiveness. Based on the essence of residual stress, the interaction between acoustic wave and residual stress is analyzed, and dislocations theory is considered. When the ultrasonic energy supplied to the elastic solid is greater than the energy of dislocation, the internal residual stress will be released. Experiments result shows that as high energy acoustic field is applied, the local residual tensile stress in elastic solid specimen will shift gradually to beneficial compressive stress, thus the component's fatigue strength, corrosion resistance and service life will be greatly improved.

  9. Elastic scattering of 17O ions from 58Ni at near-barrier energies

    NASA Astrophysics Data System (ADS)

    Torresi, D.; Strano, E.; Mazzocco, M.; Boiano, A.; Boiano, C.; Di Meo, P.; Guglielmetti, A.; La Commara, M.; Manea, C.; Nicoletto, M.; Parascandolo, C.; Parascandolo, L.; Pierroutsakou, D.; Sandoli, M.; Signorini, C.; Soramel, F.; Toniolo, N.; Grebosz, J.; Filipescu, D.; Gheorghe, A.; Glodariu, T.; Stroe, L.; Miyatake, H.; Watanabe, Y.; Jeong, S.; Kim, Y. H.; Pakou, A.; Sgouros, O.; Soukeras, V.; Zerva, K.

    2014-03-01

    Elastic scattering has been studied for the collisions induced by 17O on 58Ni target at energies around and above the Coulomb barrier. The elastic scattering angular distributions were measured for several energies and were analyzed within the framework of the optical model to obtain total reaction cross sections. The reaction cross-sections of the tightly bound 17O were compared with those of weakly bound 17F on the same targets in order to investigate the effects of the low binding energy in the reaction dynamics.

  10. Addressing preservation of elastic contrast in energy-filtered transmission electron microscopy.

    PubMed

    Brown, H G; D'Alfonso, A J; Forbes, B D; Allen, L J

    2016-01-01

    Energy-filtered transmission electron microscopy (EFTEM) images with resolutions of the order of an ngstrm can be obtained using modern microscopes corrected for chromatic aberration. However, the delocalized nature of the transition potentials for atomic ionization often confounds direct interpretation of EFTEM images, leading to what is known as "preservation of elastic contrast". In this paper we demonstrate how more interpretable images might be obtained by scanning with a focused coherent probe and incoherently averaging the energy-filtered images over probe position. We dub this new imaging technique energy-filtered imaging scanning transmission electron microscopy (EFISTEM). We develop a theoretical framework for EFISTEM and show that it is in fact equivalent to precession EFTEM, where the plane wave illumination is precessed through a range of tilts spanning the same range of angles as the probe forming aperture in EFISTEM. It is demonstrated that EFISTEM delivers similar results to scanning transmission electron microscopy with an electron energy-loss spectrometer but has the advantage that it is immune to coherent aberrations and spatial incoherence of the probe and is also more resilient to scan distortions. PMID:26476801

  11. Impact picture for near-forward elastic scattering up to LHC energies

    NASA Astrophysics Data System (ADS)

    Soffer, Jacques; Bourrely, Claude; Wu, Tai Tsun

    2015-04-01

    We will recall the main features of an accurate phenomenological model to describe successfully near-forward elastic scattering in a wide energy range, including ISR, SPS and Tevatron colliders. A large step in energy domain is accomplished with the LHC collider, presently running, giving the opportunity to confront the new data with the predictions of our theoretical approach.

  12. The role of elastic energy in activities with high force and power requirements: a brief review.

    PubMed

    Wilson, Jacob M; Flanagan, Eamonn P

    2008-09-01

    The purpose of this article is to provide strength and conditioning practitioners with an understanding of the role of elastic energy in activities with high force and power requirements. Specifically, the article covers 1) the nature of elasticity and its application to human participants, 2) the role of elastic energy in activities requiring a stretch-shorten cycle such as the vertical jump, 3) the role of muscular stiffness in athletic performance, 4) the control of muscular stiffness through feedforward and feedback mechanisms, and 5) factors affecting muscular stiffness. Finally, practical applications are provided. In this section, it is suggested that the storage and reuse of elastic energy is optimized at relatively higher levels of stiffness. Because stiffness decreases as fatigue ensues as well as with stretching before an event, the article emphasizes the need for proper preparation phases in a periodized cycle and the avoidance of long static stretches before high-force activities. The importance of teaching athletes to transition from eccentric to concentric movements with minimal time delays is also proposed due to the finding that time delays appear to decrease the reuse of elastic energy. In addition to teaching within the criterion tasks, evidence is provided that minimizing transitions in plyometric training, a technique demonstrated to increase musculotendinous stiffness, can optimize power output in explosive movements. Finally, evidence is provided that training and teaching programs designed to optimize muscular stiffness may protect athletes against sports-related injuries. PMID:18714212

  13. Energy current imaging method for time reversal in elastic media

    SciTech Connect

    Anderson, Brian E; Ulrich, Timothy J; Le Bas, Pierre - Yves A; Larmat, Carene; Johnson, Paul A; Guyer, Robert A; Griffa, Michele

    2009-01-01

    An energy current imaging method is presented for use in locating sources of wave energy during the back propagation stage of the time reversal process. During the back propagation phase of an ideal time reversal experiment, wave energy coalesces from all angles of incidence to recreate the source event; after the recreation, wave energy diverges in every direction. An energy current imaging method based on this convergence/divergence behavior has been developed. The energy current imaging method yields a smaller spatial distribution for source reconstruction than is possible with traditional energy imaging methods.

  14. Spectral Modeling of Residual Stress and Stored Elastic Strain Energy in Thermal Barrier Coatings

    SciTech Connect

    Donegan, Sean; Rolett, Anthony

    2013-12-31

    Solutions to the thermoelastic problem are important for characterizing the response under temperature change of refractory systems. This work extends a spectral fast Fourier transform (FFT) technique to analyze the thermoelastic behavior of thermal barrier coatings (TBCs), with the intent of probing the local origins of failure in TBCs. The thermoelastic FFT (teFFT) approach allows for the characterization of local thermal residual stress and strain fields, which constitute the origins of failure in TBC systems. A technique based on statistical extreme value theory known as peaks-over-threshold (POT) is developed to quantify the extreme values ("hot spots") of stored elastic strain energy (i.e., elastic energy density, or EED). The resolution dependence of the teFFT method is assessed through a sensitivity study of the extreme values in EED. The sensitivity study is performed both for the local (point-by-point) #12;eld distributions as well as the grain scale #12;eld distributions. A convergence behavior to a particular distribution shape is demonstrated for the local #12;elds. The grain scale fields are shown to exhibit a possible convergence to a maximum level of EED. To apply the teFFT method to TBC systems, 3D synthetic microstructures are created to approximate actual TBC microstructures. The morphology of the grains in each constituent layer as well as the texture is controlled. A variety of TBC materials, including industry standard materials and potential future materials, are analyzed using the teFFT. The resulting hot spots are quantified using the POT approach. A correlation between hot spots in EED and interface rumpling between constituent layers is demonstrated, particularly for the interface between the bond coat (BC) and the thermally grown oxide (TGO) layer.

  15. Assessment of Triton Potential Energy

    NASA Astrophysics Data System (ADS)

    Friar, J. L.; Payne, G. L.

    1995-12-01

    An assessment is made of the dominant features contributing to the triton potential energy, with the objective of understanding qualitatively their origins and sensitivities. Relativistic effects, short-range repulsion, and OPEP dominance are discussed. A determination of the importance of various regions of nucleon-nucleon separation is made numerically.

  16. Analysis of Potential Energy Surfaces.

    ERIC Educational Resources Information Center

    Fernandez, G. M.; And Others

    1988-01-01

    Introduces different methodological strategies in analyzing potential energy surfaces (PES) used in chemical reactivity studies. Discusses the theory of PES and gives examples to be used for student work. Provides procedures for calculating normal coordinates and vibrational properties of an activated complex. (ML)

  17. Energies of Screened Coulomb Potentials.

    ERIC Educational Resources Information Center

    Lai, C. S.

    1979-01-01

    This article shows that, by applying the Hellman-Feynman theorem alone to screened Coulomb potentials, the first four coefficients in the energy series in powers of the perturbation parameter can be obtained from the unperturbed Coulomb system. (Author/HM)

  18. Characterization of Elastic Properties in Basalts of the Western Snake River Plain, Idaho: a Mechanostratigraphic Analysis of a Potential Geothermal Reservoir

    NASA Astrophysics Data System (ADS)

    Kessler, J. A.; Evans, J. P.; Schmitt, D. R.; Shervais, J. W.

    2013-12-01

    The western Snake River Plain is a region of high crustal heat flow and has the potential for commercial geothermal energy development. High-temperature crystalline reservoirs commonly have connected fracture networks and other discontinuities that provide the primary fluid storage and permeability (Type I fractures). A borehole was drilled during the DOE/ICDP Snake River Scientific Drilling Program near Mountain Home, Idaho to a depth of ~1,800 m (6,000 ft) with 85 - 90% slimhole core recovery to assess the potential for geothermal energy development. A high-temperature artesian flow zone was encountered in basalt at a depth of 1,745 m (5,726 ft) in the MH-2 borehole with fluid temperatures above 140°C (240°F). Analysis of geomechanical behavior of rocks requires an understanding of basic physical and elastic properties under dynamic in-situ stress conditions. Here we conduct unconfined uniaxial compressive stress experiments on core samples to measure static elastic properties and compressive strength over a ~305 m (1,000 ft) interval of the borehole above and including the geothermal reservoir. Acoustic velocities are measured under pressure and temperature scenarios to calculate dynamic elastic properties and describe the anisotropy of elastic moduli and compressive strength. Dynamic elastic properties are calculated from dipole sonic borehole log data and compare the results to the previous dynamic and static interpretations. The comparison demonstrates that the calculation of dynamic elastic properties from borehole data is an effective method to interpret and describe mechanical stratigraphy and elastic properties in the case that core is not available for analysis in this area. Natural fractures, induced fractures, and breakouts are mapped in acoustic televiewer data. Fracture density is calculated and compared to lithological and mechanical stratigraphy, defined by the physical properties, elastic properties, and strength measurements. The stratigraphic relationships indicate that a ~15 m (50 ft) section of weak, non-brittle, low-permeability, highly altered basalt may act as a caprock to the geothermal reservoir at depth. Lithological descriptions of core show that the basalt in MH-2 has been altered and reworked in many cases. The alternating zones of ductile rocks and brittle basalts affect fracture density and can control fracture permeability. The induced fracture and breakout data are used to identify the direction of each of the two horizontal principal stresses. Interpretation of breakout data and induced fracture data indicate that the maximum horizontal principal stress (Shmax) is oriented 50° + 15°. This direction is antithetical to the expected Shmax direction based on the orientation of the normal fault-bounded basin that is oriented approximately 320°.

  19. Cross-linking cellulose nanofibrils for potential elastic cryo-structured gels

    NASA Astrophysics Data System (ADS)

    Syverud, Kristin; Kirsebom, Harald; Hajizadeh, Solmaz; Chinga-Carrasco, Gary

    2011-12-01

    Cellulose nanofibrils were produced from P. radiata kraft pulp fibers. The nanofibrillation was facilitated by applying 2,2,6,6-tetramethylpiperidinyl-1-oxyl-mediated oxidation as pretreatment. The oxidized nanofibrils were cross-linked with polyethyleneimine and poly N-isopropylacrylamide- co-allylamine- co-methylenebisacrylamide particles and were frozen to form cryo-structured gels. Samples of the gels were critical-point dried, and the corresponding structures were assessed with scanning electron microscopy. It appears that the aldehyde groups in the oxidized nanofibrils are suitable reaction sites for cross-linking. The cryo-structured materials were spongy, elastic, and thus capable of regaining their shape after a given pressure was released, indicating a successful cross-linking. These novel types of gels are considered potential candidates in biomedical and biotechnological applications.

  20. Cross-linking cellulose nanofibrils for potential elastic cryo-structured gels

    PubMed Central

    2011-01-01

    Cellulose nanofibrils were produced from P. radiata kraft pulp fibers. The nanofibrillation was facilitated by applying 2,2,6,6-tetramethylpiperidinyl-1-oxyl-mediated oxidation as pretreatment. The oxidized nanofibrils were cross-linked with polyethyleneimine and poly N-isopropylacrylamide-co-allylamine-co-methylenebisacrylamide particles and were frozen to form cryo-structured gels. Samples of the gels were critical-point dried, and the corresponding structures were assessed with scanning electron microscopy. It appears that the aldehyde groups in the oxidized nanofibrils are suitable reaction sites for cross-linking. The cryo-structured materials were spongy, elastic, and thus capable of regaining their shape after a given pressure was released, indicating a successful cross-linking. These novel types of gels are considered potential candidates in biomedical and biotechnological applications. PMID:22152032

  1. Nucleation rate of critical droplets on an elastic string in a {phi}{sup 6} potential

    SciTech Connect

    Kerr, W.C.; Graham, A.J.

    2004-12-01

    We obtain the nucleation rate of critical droplets for an elastic string moving in a {phi}{sup 6} local potential and subject to noise and damping forces. The critical droplet is a bound soliton-antisoliton pair that carries a section of the string out of the metastable central minimum into one of the stable side minima. The frequencies of small oscillations about the critical droplet are obtained from a Heun equation. We solve the Fokker-Planck equation for the phase-space probability density by projecting it onto the eigenfunction basis obtained from the Heun equation. We employ Farkas' 'flux-overpopulation' method to obtain boundary conditions for solving the Fokker-Planck equation; these restrict the validity of our solution to the moderate to heavy damping regime. We present results for the rate as a function of temperature, well depth, and damping.

  2. Nonlinear Elastic Effects on the Energy Flux Deviation of Ultrasonic Waves in GR/EP Composites

    NASA Technical Reports Server (NTRS)

    Prosser, William H.; Kriz, R. D.; Fitting, Dale W.

    1992-01-01

    In isotropic materials, the direction of the energy flux (energy per unit time per unit area) of an ultrasonic plane wave is always along the same direction as the normal to the wave front. In anisotropic materials, however, this is true only along symmetry directions. Along other directions, the energy flux of the wave deviates from the intended direction of propagation. This phenomenon is known as energy flux deviation and is illustrated. The direction of the energy flux is dependent on the elastic coefficients of the material. This effect has been demonstrated in many anisotropic crystalline materials. In transparent quartz crystals, Schlieren photographs have been obtained which allow visualization of the ultrasonic waves and the energy flux deviation. The energy flux deviation in graphite/epoxy (gr/ep) composite materials can be quite large because of their high anisotropy. The flux deviation angle has been calculated for unidirectional gr/ep composites as a function of both fiber orientation and fiber volume content. Experimental measurements have also been made in unidirectional composites. It has been further demonstrated that changes in composite materials which alter the elastic properties such as moisture absorption by the matrix or fiber degradation, can be detected nondestructively by measurements of the energy flux shift. In this research, the effects of nonlinear elasticity on energy flux deviation in unidirectional gr/ep composites were studied. Because of elastic nonlinearity, the angle of the energy flux deviation was shown to be a function of applied stress. This shift in flux deviation was modeled using acoustoelastic theory and the previously measured second and third order elastic stiffness coefficients for T300/5208 gr/ep. Two conditions of applied uniaxial stress were considered. In the first case, the direction of applied uniaxial stress was along the fiber axis (x3) while in the second case it was perpendicular to the fiber axis along the laminate stacking direction (x1).

  3. Ab initio Potential Energy Surface for H-H2

    NASA Technical Reports Server (NTRS)

    Partridge, Harry; Bauschlicher, Charles W., Jr.; Stallcop, James R.; Levin, Eugene

    1993-01-01

    Ab initio calculations employing large basis sets are performed to determine an accurate potential energy surface for H-H2 interactions for a broad range of separation distances. At large distances, the spherically averaged potential determined from the calculated energies agrees well with the corresponding results determined from dispersion coefficients; the van der Waals well depth is predicted to be 75 +/- (mu)E(sub h). Large basis sets have also been applied to reexamine the accuracy of theoretical repulsive potential energy surfaces. Multipolar expansions of the computed H-H2 potential energy surface are reported for four internuclear separation distances (1.2, 1.401, 1.449, and 1.7a(sub 0) of the hydrogen molecule. The differential elastic scattering cross section calculated from the present results is compared with the measurements from a crossed beam experiment.

  4. Scaling of energy amplification in the weak and strong elastic limits of viscoelastic shear flows

    NASA Astrophysics Data System (ADS)

    Hameduddin, Ismail; Zaki, Tamer; Gayme, Dennice

    2015-11-01

    We investigate energy amplification in viscoelastic parallel shear flows in terms of the steady-state variance maintained in the velocity and polymer stresses when either quantity is excited with white noise. We derive analytical expressions that show how this amplification scales with both Reynolds (Re) and Weissenberg (Wi) numbers. The analysis focuses on the streamwise-constant fields in the limits of high and low elasticity. By introducing stochastic forcing in both the velocity and the polymer stress dynamics, we show that at low elasticity the scaling retains a form similar to the well-known O(Re3) relationship but with an added elastic correction. At high elasticity, however, the scaling is O(Wi3) with a viscous correction. Our results demonstrate that energy amplification in a viscoelastic flow can be considerable even at low Re, correlating well with recent observations of elastic turbulence in creeping flows. We also note that forcing in the polymer stress dynamics can contribute significantly to the energy amplification.

  5. California Industrial Energy Efficiency Potential

    SciTech Connect

    Coito, Fred; Worrell, Ernst; Price, Lynn; Masanet, Eric; RafaelFriedmann; Rufo, Mike

    2005-06-01

    This paper presents an overview of the modeling approach andhighlights key findings of a California industrial energy efficiencypotential study. In addition to providing estimates of technical andeconomic potential, the study examines achievable program potential undervarious program-funding scenarios. The focus is on electricity andnatural gas savings for manufacturing in the service territories ofCalifornia's investor-owned utilities (IOUs). The assessment is conductedby industry type and by end use. Both crosscutting technologies andindustry-specific process measures are examined. Measure penetration intothe marketplace is modeled as a function of customer awareness, measurecost effectiveness, and perceived market barriers. Data for the studycomes from a variety of sources, including: utility billing records, theEnergy Information Association (EIA) Manufacturing Energy ConsumptionSurvey (MECS), state-sponsored avoided cost studies, energy efficiencyprogram filings, and technology savings and cost data developed throughLawrence Berkeley National Laboratory (LBNL). The study identifies 1,706GWh and 47 Mth (million therms) per year of achievable potential over thenext twelve years under recent levels of program expenditures, accountingfor 5.2 percent of industrial electricity consumption and 1.3 percent ofindustrial natural gas consumption. These estimates grow to 2,748 GWh and192 Mth per year if all cost-effective and achievable opportunities arepursued. Key industrial electricity end uses, in terms of energy savingspotential, include compressed air and pumping systems that combine toaccount for about half of the total achievable potential estimates. Fornatural gas, savings are concentrated in the boiler and process heatingend uses, accounting for over 99 percent to total achievablepotential.

  6. Salinity Effects on Water Potential Components and Bulk Elastic Modulus of Alternanthera philoxeroides (Mart.) Griseb. 1

    PubMed Central

    Bolaños, Jorge A.; Longstreth, David J.

    1984-01-01

    Pressure volume curves for Alternanthera philoxeroides (Mart.) Griseb. (alligator weed) grown in 0 to 400 millimolar NaCl were used to determine water potential (Ψ), osmotic potential (ψs), turgor potential (ψp) and the bulk elastic modulus (ε) of shoots at different tissue water contents. Values of ψs decreased with increasing salinity and tissue Ψ was always lower than rhizosphere Ψ. The relationship between ψp and tissue water content changed because ε increased with salinity. As a result, salt-stressed plants had larger ranges of positive turgor but smaller ranges of tissue water content over which ψp was positive. To our knowledge, this is the first report of such a salinity effect on ε in higher plants. These increases in ε with salinity provided a mechanism by which a large difference between plant Ψ and rhizosphere Ψ, the driving force for water uptake, could be produced with relatively little water loss by the plant. A time-course study of response after salinization to 400 millimolar NaCl showed Ψ was constant within 1 day, ψs and ψp continued to change for 2 to 4 days, and ε continued to change for 4 to 12 days. Changes in ε modified the capacity of alligator weed to maintain a positive water balance and consideration of such changes in other species of higher plants should improve our understanding of salt stress. PMID:16663611

  7. High energy proton-proton elastic scattering at the Large Hadron Collider and nucleon structure

    NASA Astrophysics Data System (ADS)

    Luddy, Richard Joseph

    To gain insight into the structure of the nucleon, we pursue the development of the phenomenological model of Islam et al. (IIFS model) for high energy elastic pp and p¯p scattering. We determine the energy dependence of the parameters of the IIFS model using the available elastic differential cross section data from SPS Collider and Tevatron and the known asymptotic behavior of sigmatot (s) and rho(s) from dispersion relation calculations and more recent analyses of Cudell et al. (COMPETE Collaboration). Next, we incorporate a high energy elastic valence quark-quark scattering amplitude into the model based on BFKL pomeron to describe small impact parameter (large | t|) pp collisions. Finally, we predict the pp elastic differential cross section at the unprecedented c.m. energy of s = 14.0 TeV at the Large Hadron Collider (LHC). This prediction assumes crucial significance---because of an approved experiment at LHC: TOTal and Elastic Measurement (TOTEM). The TOTEM group plans to measure pp elastic dsigma/dt at 14.0 TeV all the way from momentum transfer |t| = 0 to |t| ≃ 10 GeV 2. Their measurement will stringently test not only the diffraction and o-exchange descriptions of the original IIFS model, but also the additional valence quark-quark scattering contribution that we find to be dominant for large |t|. Successful quantitative verification of the predicted dsigma/dt will mean that our picture of the nucleon with an outer cloud of qq¯ condensed ground state, an inner core of topological baryonic charge, and a still smaller core of massless valence quarks provides a realistic description of nucleon structure.

  8. The potential of renewable energy

    SciTech Connect

    Not Available

    1990-03-01

    On June 27 and 28, 1989, the US Department of Energy (DOE) national laboratories were convened to discuss plans for the development of a National Energy Strategy (NES) and, in particular, the analytic needs in support of NES that could be addressed by the laboratories. As a result of that meeting, interlaboratory teams were formed to produce analytic white papers on key topics, and a lead laboratory was designated for each core laboratory team. The broad-ranging renewables assignment is summarized by the following issue statement from the Office of Policy, Planning and Analysis: to what extent can renewable energy technologies contribute to diversifying sources of energy supply What are the major barriers to greater renewable energy use and what is the potential timing of widespread commercialization for various categories of applications This report presents the results of the intensive activity initiated by the June 1989 meeting to produce a white paper on renewable energy. Scores of scientists, analysts, and engineers in the five core laboratories gave generously of their time over the past eight months to produce this document. Their generous, constructive efforts are hereby gratefully acknowledged. 126 refs., 44 figs., 32 tabs.

  9. Spin correlation parameter and analyzing power in n - p elastic scattering at intermediate energies

    SciTech Connect

    Bandyopadhyay, D. ); Abegg, R.; Ahmad, M.; Birchall, J.; Chantziantoniou, K.; Davis, C.A.; Davison, N.E.; Delheij, P.P.J.; Green, P.W.; Greeniaus, L.G.; Healey, D.C.; Lapointe, C.; McDonald, W.J.; Miller, C.A.; Moss, G.A.; Page, S.A.; Ramsay, W.D.; Rodning, N.L.; Roy, G.; van Oers, W.T.H.; Wait, G.D.; Watson, J.W.; Ye, Y.

    1989-12-01

    In order to improve existing {ital I}=0 phase shift solutions, the spin correlation parameter {ital A}{sub {ital NN}} and the analyzing powers {ital A}{sub 0{ital N}} and {ital A}{sub {ital N}0} have been measured in {ital n}-{ital p} elastic scattering over an angular range of 50{degree}--150{degree} (c.m.) at three neutron energies (220, 325, and 425 MeV) to an absolute accuracy of {plus minus}0.03. The data have a profound effect on various phase parameters, particularly the {sup 1}P{sub 1}, {sup 3}D{sub 2}, and {epsilon}{sub 1} phase parameters which in some cases change by almost a degree. With the exception of the highest energy, the data support the predictions of the latest version of the Bonn potential. Also, the analyzing power data ({ital A}{sub 0{ital N}} and {ital A}{sub {ital N}0}) measured at 477 MeV in a different experiment over a limited angular range (60{degree}--80{degree} (c.m.)) are reported here.

  10. Study of dp-elastic scattering at energies 650, 750 and 1000 MeV/nucleon

    NASA Astrophysics Data System (ADS)

    Terekhin, A. A.; Ladygin, V. P.; Piyadin, S. M.; Gurchin, Yu. V.; Resnikov, S. G.; Isupov, A. Yu.; Kurilkin, P. K.; Kurilkin, A. K.; Khrenov, A. N.; Vnukov, I. E.

    2013-12-01

    The results of measurements of dp-elastic scattering at 650, 750 and 1000 MeV/nucleon at Nuclotron JINR are reported. The data have been obtained for angels range of 75-120 deg. in the c.m.s. The results are compared with existing data for corresponding values of energies.

  11. Transmitting electric energy through a closed elastic wall by acoustic waves and piezoelectric transducers.

    PubMed

    Yang, Zengtao; Guo, Shaohua; Yang, Jiashi

    2008-01-01

    Transmission of electric energy through a closed elastic wall by piezoelectric transducers and acoustic waves is studied based on the linear theory of piezoelectricity and elasticity. A theoretical analysis is performed. For the structure and motion considered, the 3-D equations of linear piezoelectricity reduce to a 1-D mathematical problem. An exact solution is obtained. Transmitted voltage, current, power, efficiency and stress distribution are obtained. Their dependence on various parameters is examined. The model and results of this paper are closer to real situations compared with those in a previous analysis. PMID:18599426

  12. Energy dissipation in heavy systems: the transition from quasi-elastic to deep-inelastic scattering

    SciTech Connect

    Rehm, K.E.; van den Berg, A.; Kolata, J.J.; Kovar, D.G.; Kutschera, W.; Rosner, G.; Stephans, G.S.F.; Yntema, J.L.; Lee, L.L.

    1984-01-01

    The interaction of medium mass projectiles (A = 28 - 64) with /sup 208/Pb has been studied using a split-pole spectrograph which allows single mass and charge identification. The reaction process in all systems studied so far is dominated by quasi-elastic neutron transfer reactions, especially at incident energies in the vicinity of the Coulomb barrier. In addition to the quasi-elastic component deep inelastic contributions are present in all reaction channels. The good mass and charge separation allows to generate Wilczynski plots for individual channels; for the system /sup 48/Ti + /sup 208/Pb we observe that the transition between the quasi-elastic and deep-inelastic reactions occurs around Q = -(30 to 35) MeV.

  13. Energy trapping of thickness-shear vibration modes of elastic plates with functionally graded materials.

    PubMed

    Wang, Ji; Yang, Jiashi; Li, Jiangyu

    2007-03-01

    Energy trapping has important applications in the design of thickness-shear resonators. Considerable efforts have been made for the effective utilization and improvement of energy trapping with variations of plate configurations, such as adding electrodes and contouring. As a new approach in seeking improved energy trapping feature, we analyze thickness-shear vibrations in an elastic plate with functionally graded material (FGM) of in-plane variation of mechanical properties, such as elastic constants and density. A simple and general equation governing the thickness-shear modes is derived from a variational analysis. A plate with piecewise constant material properties is analyzed as an example. It is shown that such a plate can support thickness-shear vibration modes with obvious energy trapping. Bechmann's number for the existence of only one trapped mode also can be determined accordingly. PMID:17375839

  14. Proton-proton and proton-antiproton elastic scattering at high energies: Theory, phenomenology, and experiment

    SciTech Connect

    Wu, Tai Tsun

    1990-12-31

    This is a brief review of the progress in the understanding, during the past twenty years, of hadronic elastic scattering near the forward direction at high energies. On the basis of quantum gauge field theories, the Pomeron is found to be a branch cut above 1. Using the physical picture that this result implies, phenomenology for proton-proton and antiproton-proton elastic scattering is constructed. Two noteworthy features are that, at high energies, both the total cross section and the ratio of the integrated elastic cross section to the total cross section to the total cross section are increasing functions of the center-of-mass energy. Detailed predictions are given for the elastic differential cross sections, Coulomb interference and the ratios of the real to imaginary parts of the forward amplitudes. These predictions have been extensively and accurately confirmed by experiments, and have also been given both for future experiments on existing accelerators and for experiments on future accelerators. 14 refs., 2 figs.

  15. Proton-proton and proton-antiproton elastic scattering at high energies: Theory, phenomenology, and experiment

    SciTech Connect

    Wu, Tai Tsun.

    1990-01-01

    This is a brief review of the progress in the understanding, during the past twenty years, of hadronic elastic scattering near the forward direction at high energies. On the basis of quantum gauge field theories, the Pomeron is found to be a branch cut above 1. Using the physical picture that this result implies, phenomenology for proton-proton and antiproton-proton elastic scattering is constructed. Two noteworthy features are that, at high energies, both the total cross section and the ratio of the integrated elastic cross section to the total cross section to the total cross section are increasing functions of the center-of-mass energy. Detailed predictions are given for the elastic differential cross sections, Coulomb interference and the ratios of the real to imaginary parts of the forward amplitudes. These predictions have been extensively and accurately confirmed by experiments, and have also been given both for future experiments on existing accelerators and for experiments on future accelerators. 14 refs., 2 figs.

  16. Elastic Scattering Of {sup 6,7}Li+{sup 80}Se At Near And Above Barrier Energies

    SciTech Connect

    Fimiani, L.; Marti, G. V.; Capurro, O. A.; Barbara, E. de; Testoni, J. E.; Zalazar, L.; Arazi, A.; Cardona, M. A.; Carnelli, P.; Figueira, J. M.; Hojman, D.; Martinez Heimann, D.; Negri, A. E.; Pacheco, A. J.; Fernandez Niello, J. O.

    2010-08-04

    In this work we propose to study the elastic scattering of the weakly bound projectiles {sup 6,7}Li on an intermediate mass target {sup 80}Se. From the experimental results presented here, precise angular distributions at energies below, around and above the nominal Coulomb barriers of the systems were obtained. The final goal of our work is to determine the characteristic parameters of the optical potential and use them to address the question of whether the usual threshold anomaly or the breakup threshold anomaly are present or not in these systems.

  17. Distribution of the energy of a piezoelectric actuator between traveling waves excited in an elastic layer

    NASA Astrophysics Data System (ADS)

    Glushkov, E. V.; Glushkova, N. V.; Evdokimov, A. A.

    2015-11-01

    The distribution of the energy of a piezoelectric actuator between normal modes (Lamb waves) as a function of the source parameters and frequency is studied by solving the dynamic contact problem of the interaction between a flexible piezoelectric patch and a flexible elastic substrate with explicit representations for the excited traveling waves. Zones of the maximum and minimum energy of the fundamental modes are determined in the "oscillation frequency-piezoelectric patch width" plane.

  18. Non-resonant elastic scattering of low-energy photons by atomic sodium confined in quantum plasmas

    NASA Astrophysics Data System (ADS)

    Ghosh, Avijit; Ray, Debasis

    2015-03-01

    The non-resonant elastic scattering of low-energy photons by the bound valence electron in the ground state 3s of atomic sodium confined in quantum plasmas is investigated theoretically. The incident photon energy is assumed to be much smaller than the 3s-3p excitation energy. The alkali atom sodium is first formulated as an effective one-electron problem in which the attractive interaction between the valence electron and the atomic ion core is simulated by a spherically symmetric model potential. The Shukla-Eliasson oscillatory exponential cosine screened-Coulomb potential model is then used to mimic the effective two-body (valence-core) interaction within quantum plasmas. Non-relativistic calculations performed within the electric dipole approximation indicate that the non-resonant elastic photon scattering cross-section undergoes a dramatic growth by several orders of magnitude as the quantum wave number increases. A qualitative explanation of this phenomenon is presented. In the absence of the oscillatory cosine screening term, a similar growth is observed at larger values of the quantum wave number. Our computed relevant atomic data are in very good agreement with the experimental as well as the previous theoretical data for the zero-screening (free atom) case, and with the very limited, accurate theoretical results available for the case of exponential screened-Coulomb two-body interaction, without the cosine screening term.

  19. Validity of the relativistic impulse approximation for elastic proton-nucleus scattering at energies lower than 200 MeV

    SciTech Connect

    Li, Z. P.; Hillhouse, G. C.; Meng, J.

    2008-07-15

    We present the first study to examine the validity of the relativistic impulse approximation (RIA) for describing elastic proton-nucleus scattering at incident laboratory kinetic energies lower than 200 MeV. For simplicity we choose a {sup 208}Pb target, which is a spin-saturated spherical nucleus for which reliable nuclear structure models exist. Microscopic scalar and vector optical potentials are generated by folding invariant scalar and vector scattering nucleon-nucleon (NN) amplitudes, based on our recently developed relativistic meson-exchange model, with Lorentz scalar and vector densities resulting from the accurately calibrated PK1 relativistic mean field model of nuclear structure. It is seen that phenomenological Pauli blocking (PB) effects and density-dependent corrections to {sigma}N and {omega}N meson-nucleon coupling constants modify the RIA microscopic scalar and vector optical potentials so as to provide a consistent and quantitative description of all elastic scattering observables, namely, total reaction cross sections, differential cross sections, analyzing powers and spin rotation functions. In particular, the effect of PB becomes more significant at energies lower than 200 MeV, whereas phenomenological density-dependent corrections to the NN interaction also play an increasingly important role at energies lower than 100 MeV.

  20. Non-resonant elastic scattering of low-energy photons by atomic sodium confined in quantum plasmas

    SciTech Connect

    Ghosh, Avijit Ray, Debasis

    2015-03-15

    The non-resonant elastic scattering of low-energy photons by the bound valence electron in the ground state 3s of atomic sodium confined in quantum plasmas is investigated theoretically. The incident photon energy is assumed to be much smaller than the 3s-3p excitation energy. The alkali atom sodium is first formulated as an effective one-electron problem in which the attractive interaction between the valence electron and the atomic ion core is simulated by a spherically symmetric model potential. The Shukla-Eliasson oscillatory exponential cosine screened-Coulomb potential model is then used to mimic the effective two-body (valence-core) interaction within quantum plasmas. Non-relativistic calculations performed within the electric dipole approximation indicate that the non-resonant elastic photon scattering cross-section undergoes a dramatic growth by several orders of magnitude as the quantum wave number increases. A qualitative explanation of this phenomenon is presented. In the absence of the oscillatory cosine screening term, a similar growth is observed at larger values of the quantum wave number. Our computed relevant atomic data are in very good agreement with the experimental as well as the previous theoretical data for the zero-screening (free atom) case, and with the very limited, accurate theoretical results available for the case of exponential screened-Coulomb two-body interaction, without the cosine screening term.

  1. Elastic Scattering of Low-Energy Electrons byTetrahydrofuran

    SciTech Connect

    Trevisan, Cynthia S.; Orel, Ann E.; Rescigno, Thomas N.

    2006-05-09

    We present the results of ab initio calculations for elasticelectron scattering by tetrahydrofuran (THF) using the complex Kohnvariational method. We carried out fixed-nuclei calculations at theequilibrium geometry of the target molecule for incident electronenergies up to 20 eV. The calculated momentum transfer cross sectionsclearly reveal the presence of broad shape resonance behavior in the 8-10eV energy range, in agreement with recent experiments. The calculateddifferential cross sections at 20 eV, which include the effects of thelong-range electron-dipole interaction, are alsofound to be in agreementwith the most recent experimental findings.

  2. Structural, vibrational, and elastic properties of a calcium aluminosilicate glass from molecular dynamics simulations: The role of the potential

    SciTech Connect

    Bauchy, M.

    2014-07-14

    We study a calcium aluminosilicate glass of composition (SiO{sub 2}){sub 0.60}(Al{sub 2}O{sub 3}){sub 0.10}(CaO){sub 0.30} by means of molecular dynamics. To this end, we conduct parallel simulations, following a consistent methodology, but using three different potentials. Structural and elastic properties are analyzed and compared to available experimental data. This allows assessing the respective abilities of the potentials to produce a realistic glass. We report that, although all these potentials offer a reasonable glass structure, featuring tricluster oxygen atoms, their respective vibrational and elastic predictions differ. This allows us to draw some general conclusions about the crucial role, or otherwise, of the interaction potential in silicate systems.

  3. Application of the pair torque interaction potential to simulate the elastic behavior of SLMoS2

    NASA Astrophysics Data System (ADS)

    Berinskii, I. E.; Panchenko, A. Yu; Podolskaya, E. A.

    2016-05-01

    This paper is devoted to the application of the pair torque interaction potential for the simulation of the elastic behavior of a promising two-dimensional material: single layer molybdenium disulphide (SLMoS2). It is demonstrated that both Mo-Mo and S-S interactions can be regarded as pair force interactions with sufficient accuracy. Using both experimental and calculated numerically elastic moduli, and also the phonon spectrum available in the literature, the parameters of the Morse potential are determined for Mo-Mo and S-S bonds, and the parameters of the pair torque potential are obtained for the Mo-S bond. As a result, a combination of force and torque pair potentials is proposed, which allows for the correct modelling of SLMoS2 mechanical behavior.

  4. Magneto-elastic artificial neurons with extremely low energy dissipation

    NASA Astrophysics Data System (ADS)

    Biswas, Ayan K.; Al-Rashid, Md Mamun; Atulasimha, Jayasimha; Bandyopadhyay, Supriyo

    2015-03-01

    We present a detailed analysis of artificial step transfer function neurons and binary weight synapses implemented with magneto-tunneling junctions whose soft layers are magnetostrictive nanomagnets switched with voltage generated mechanical strain. These devices are more energy-efficient than CMOS-based neurons or so-called spin neurons that are based on magnets switched with spin-polarized current. We studied their switching dynamics using stochastic Landau-Lifshitz-Gilbert simulations for two different geometries (elliptical and cylindrical) of the magnetostrictive nanomagnet. Our study revealed that while the step transition (firing) of the magnetic neuron is always very sharp at 0 K, the threshold is significantly broadened at room temperature, regardless of geometry and regardless of whether the magnet is switched with strain or spin-polarized current. While this could preclude some applications, the extreme energy-efficiency of these neurons makes them nearly ideal for use in certain types of neuromorphic computation. This work is supported by the NSF under grant ECCS-1124714 and CCF-1216614.

  5. Elastic electron scattering in krypton in the energy range from 5 to 10 eV

    SciTech Connect

    Linert, Ireneusz; Mielewska, Brygida; Zubek, Mariusz; King, George C.

    2010-01-15

    Differential cross sections for elastic electron scattering in krypton have been measured at the energies of 5,7.5, and 10 eV over the scattering angle range from 30 deg. to 180 deg. The measurements for backward scattering employed the magnetic angle-changing technique. These differential cross sections have been integrated to yield the elastic integral and momentum transfer cross sections at the above energies. These new results are compared with the most recent measurements and calculations of the respective cross sections in krypton. The dependence of the differential cross sections on atomic polarizability of the heavier rare gas atoms argon, krypton, and xenon has also been investigated over the electron energy range 5-30 eV and for forward, backward, and intermediate scattering angles.

  6. Energy and momentum transfer to a 'fully-clamped' elastic plate in an air-blast

    NASA Astrophysics Data System (ADS)

    Yuan, Y.; Tan, P. J.

    2013-07-01

    The momentum transfer by a planar wave impinging upon a rigid, free-standing plate in water, a largely incompressible medium, is well understood [1]. Kambouchev et al. [2] extended the results of Taylor [1] to include the nonlinear effects of compressibility whilst Hutchinson [3] has recently addressed the issues of energy and momentum transfer to a rigid, free-standing plate. In this paper, key conclusions from the aforementioned studies are critically re-examined in the context of a 'fully-clamped' elastic plate. The dynamic response of an elastic plate is represented by an equivalent single-degree-of-freedom (SDOF) system. A numerical method based on a Lagrangian formulation of the Euler equations of compressible flow and conventional shock-capturing techn iques, similar to that employed in [2, 3], were employed to solve numerically the interaction between the air blast wave and elastic plate. Particular emphasis is placed on elucidating the energy and momentum transfer to a 'fully-clamped' elastic plate compared to its rigid, free-standing counterpart, and on whether enhancement in the beneficial effects of FSI as a result of fluid compressibility remains and to what extent.

  7. Models with energy penalty on interresidue rotation address insufficiencies of conventional elastic network models.

    PubMed

    Yang, Lee-Wei

    2011-04-01

    In this study, I present a new elastic network model, to our knowledge, that addresses insufficiencies of two conventional models-the Gaussian network model (GNM) and the anisotropic network model (ANM). It has been shown previously that the GNM is not rotation-invariant due to its energy, which penalizes rigid-body rotation (external rotation). As a result, GNM models are found contaminated with rigid-body rotation, especially in the most collective ones. A new model (EPIRM) is proposed to remove such external component in modes. The extracted internal motions result from a potential that penalizes interresidue stretching and rotation in a protein. The new model is shown to pertinently describe crystallographic temperature factors (B-factors) and protein open↔closed transitions. Also, the capability of separating internal and external motions in GNM slow modes permits reexamining important mechanochemical properties in enzyme active sites. The results suggest that catalytic residues stay closer to rigid-body rotation axes than their immediate backbone neighbors. I show that the cumulative density of states for EPIRM and ANM follow different power laws as functions of low-mode frequencies. When using a cutoff distance of 7.5 Å, The cumulative density of states of EPIRM scales faster than that of all-atom normal mode analysis and slower than that of simple lattices. PMID:21463592

  8. Potential energy surface of cyclooctatetraene

    NASA Astrophysics Data System (ADS)

    Andrés, José L.; Castaño, Obis; Morreale, Antonio; Palmeiro, Raul; Gomperts, Roberto

    1998-01-01

    We present a theoretical study of the cyclooctatetraene (COT) molecule. Seven COT structures are located on the singlet ground state potential energy surface. Four of them, which present D2d (tub), Cs (bicyclo[4.2.0]octa-2,4,7-triene or BOT), C2h (chair) and D4 (crown) symmetries are stable species, and the other three are transition state structures showing Cs, D4h, and D8h symmetry. We discuss the symmetry of wave functions for these stationary points. Geometries, energies, and harmonic vibrational frequencies of these structures, and energy gaps between singlet-triplet states and low-lying singlets are presented. For the planar D4h and D8h structures, Jahn-Teller and tunneling effects have also been discussed. Ring inversion, bond shifting and valence isomerization reactive channels from the tub COT conformer are discussed from the point of view of the corresponding transition state structures. Where possible, in order to lend support to this theoretical information comparisons with recent transition state spectroscopy data are made.

  9. Theoretical and experimental investigations of elastic scattering spectroscopy as a potential diagnostic for tissue pathologies

    SciTech Connect

    Boyer, J.; Mourant, J.R.; Bigio, I.J.

    1994-04-01

    The spectral distribution of the diffuse reflectance of five sizes of polystyrene microspheres has been measured with an elastic scatter spectrometer designed for optical biopsy of living tissue. The microsphere sizes are representative of the suspected scattering centers in living tissue. The experiment data are discussed and interpreted in the framework of Mie scattering theory and Monte-Carlo transport analysis. Present results support the assertion that Mie theory is necessary to describe the spectral features of elastic scatter spectroscopy in tissue.

  10. Electron Attachment in Low-Energy Electron Elastic Collisions with Au and Pt Atoms: Identification of Excited Anions

    NASA Astrophysics Data System (ADS)

    Msezane, A. Z.; Eure, A.; Felfli, Z.; Sokolovski, D.

    2009-11-01

    The recent Regge-pole methodology has been benchmarked [1] on the accurately measured binding energies of the excited Ge= and Sn= anions [2] through the binding energies (BEs) extracted from the Regge-pole calculated elastic total cross sections (TCSs). Here the methodology is applied together with a Thomas-Fermi type potential that incorporates the vital core polarization interaction to investigate the possibility of forming excited Au= and Pt= anions in low-energy electron elastic collisions with Au and Pt atoms. From the positions of the characteristic extremely narrow resonances in the total cross sections, we extract the binding energies of the excited Au= and Pt= anions formed as Regge resonances during the collisions. The angular life of the complexes thus formed is used to differentiate the stable excited bound states of the anions from the shape resonances [3]. The BEs for the excited Au= and Pt= anions are found to be 0.475eVand 0.543eV, respectively, challenging both theory and experiment to verify. [1] A. Msezane et al, Phys. Rev. A, Submitted (2009) [2] M. Scheer et al, Phys. Rev. A 58, 2844 (1998) [3] Z. Felfli et al, Phys. Rev. A 79, 012714 (2009)

  11. Incorporating elastic and plastic work rates into energy balance for long-term tectonic modeling

    NASA Astrophysics Data System (ADS)

    Ahamed, M. S.; Choi, E.

    2014-12-01

    Deformation-related energy budget is usually considered in the simplest form or even completely omitted from the energy balance equation. We derive an energy balance equation that accounts not only for heat energy but also for elastic and plastic work. Such a general description of the energy balance principle will be useful for modeling complicated interactions between geodynamic processes such as thermoelastisity, thermoplasticity and mechanical consequences of metamorphism. Following the theory of large deformation plasticity, we start from the assumption that Gibbs free energy (g) is a function of temperature (T), the second Piola-Kirchhoff stress (S), density (ρ) and internal variables (qj, j=1…n). In this formulation, new terms are derived, which are related to the energy dissipated through plastic work and the elastically stored energy that are not seen in the usual form of the energy balance equation used in geodynamics. We then simplify the generic equation to one involving more familiar quantities such as Cauchy stress and material density assuming that the small deformation formulation holds for our applications. The simplified evolution equation for temperature is implemented in DyanEarthSol3D, an unstructured finite element solver for long-term tectonic deformation. We calculate each of the newly derived terms separately in simple settings and compare the numerical results with a corresponding analytic solution. We also present the effects of the new energy balance on the evolution of a large offset normal fault.

  12. Radius exponent in elastic and rigid arterial models optimized by the least energy principle.

    PubMed

    Nakamura, Yoshihiro; Awa, Shoichi

    2014-02-01

    It was analyzed in normal physiological arteries whether the least energy principle would suffice to account for the radius exponent x. The mammalian arterial system was modeled as two types, the elastic or the rigid, to which Bernoulli's and Hagen-Poiseuille's equations were applied, respectively. We minimized the total energy function E, which was defined as the sum of kinetic, pressure, metabolic and thermal energies, and loss of each per unit time in a single artery transporting viscous incompressible blood. Assuming a scaling exponent ? between the vessel radius (r) and length (l) to be 1.0, x resulted in 2.33 in the elastic model. The rigid model provided a continuously changing x from 2.33 to 3.0, which corresponded to Uylings' and Murray's theories, respectively, through a function combining Reynolds number with a proportional coefficient of the l - r relationship. These results were expanded to an asymmetric arterial fractal tree with the blood flow preservation rule. While x in the optimal elastic model accounted for around 2.3 in proximal systemic (r >1 mm) and whole pulmonary arteries (r ?0.004 mm), optimal x in the rigid model explained 2.7 in elastic-muscular (0.1 < r ?1 mm) and 3.0 in peripheral resistive systemic arteries (0.004 ? r ?0.1 mm), in agreement with data obtained from angiographic, cast-morphometric, and in vivo experimental studies in the literature. The least energy principle on the total energy basis provides an alternate concept of optimality relating to mammalian arterial fractal dimensions under ? = 1.0. PMID:24744905

  13. Clutchable series-elastic actuator: design of a robotic knee prosthesis for minimum energy consumption.

    PubMed

    Rouse, Elliott J; Mooney, Luke M; Martinez-Villalpando, Ernesto C; Herr, Hugh M

    2013-06-01

    The cyclic and often linear torque-angle relationship of locomotion presents the opportunity to innovate on the design of traditional series-elastic actuators (SEAs). In this paper, a novel modification to the SEA architecture was proposed by adding a clutch in parallel with the motor within the SEA--denoted as a CSEA. This addition permits bimodal dynamics where the system is characterized by an SEA when the clutch is disengaged and a passive spring when the clutch is engaged. The purpose of the parallel clutch was to provide the ability to store energy in a tuned series spring, while requiring only reactionary torque from the clutch. Thus, when the clutch is engaged, a tuned elastic relationship can be achieved with minimal electrical energy consumption. The state-based model of the CSEA is introduced and the implementation of the CSEA mechanism in a powered knee prosthesis is detailed. The series elasticity was optimized to fit the spring-like torque-angle relationship of early stance phase knee flexion and extension during level ground walking. In simulation, the CSEA knee required 70% less electrical energy than a traditional SEA. Future work will focus on the mechanical implementation of the CSEA knee and an empirical demonstration of reduced electrical energy consumption during walking. PMID:24187202

  14. Global Optical Potential for {sup 6}He Interactions at Low Energies

    SciTech Connect

    Kucuk, Y.; Boztosun, I.; Topel, T.

    2009-08-26

    Within the framework of optical model, we present a set of global optical potential for the elastic scattering of {sup 6}He halo nucleus from different target nuclei ranging from {sup 12}C to {sup 209}Bi at low energies. Consistent agreement with the experimental data has been obtained by using this global potential.

  15. An energy absorbing far-field boundary condition for the elastic wave equation

    SciTech Connect

    Petersson, N A; Sjogreen, B

    2008-07-15

    The authors present an energy absorbing non-reflecting boundary condition of Clayton-Engquist type for the elastic wave equation together with a discretization which is stable for any ratio of compressional to shear wave speed. They prove stability for a second order accurate finite-difference discretization of the elastic wave equation in three space dimensions together with a discretization of the proposed non-reflecting boundary condition. The stability proof is based on a discrete energy estimate and is valid for heterogeneous materials. The proof includes all six boundaries of the computational domain where special discretizations are needed at the edges and corners. The stability proof holds also when a free surface boundary condition is imposed on some sides of the computational domain.

  16. Absolute Beam Energy Measurement using Elastic ep Scattering at Thomas Jefferson National Accelerator Facility

    NASA Astrophysics Data System (ADS)

    Deur, Alexandre

    1999-10-01

    The Jefferson Lab beam energy measurement in Hall A using the elastic ep scattering will be described. This new, non-magnetic, energy measurement method allows a ( triangle E/E=10-4 ) precision. First-order corrections are canceled by the measurements of the electron and proton scattering angles for two symmetric kinematics. The measurement principle will be presented as well as the device and measurement results. Comparison with independent magnetic energy measurements of the same accuracy will be shown. This project is the result of a collaboration between the LPC: université Blaise Pascal/in2p3), Saclay and Jefferson Lab.

  17. Synergy of inelastic and elastic energy loss. Temperature effects and electronic stopping power dependence

    SciTech Connect

    Zarkadoula, Eva; Xue, Haizhou; Zhang, Yanwen; Weber, William J.

    2015-06-16

    A combination of an inelastic thermal spike model suitable for insulators and molecular dynamics simulations is used to study the effects of temperature and electronic energy loss on ion track formation, size and morphology in SrTiO3 systems with pre-existing disorder. We find temperature dependence of the ion track size. In addition, we find a threshold in the electronic energy loss for a given pre-existing defect concentration, which indicates a threshold in the synergy between the inelastic and elastic energy loss.

  18. Synergy of inelastic and elastic energy loss. Temperature effects and electronic stopping power dependence

    DOE PAGESBeta

    Zarkadoula, Eva; Xue, Haizhou; Zhang, Yanwen; Weber, William J.

    2015-06-16

    A combination of an inelastic thermal spike model suitable for insulators and molecular dynamics simulations is used to study the effects of temperature and electronic energy loss on ion track formation, size and morphology in SrTiO3 systems with pre-existing disorder. We find temperature dependence of the ion track size. In addition, we find a threshold in the electronic energy loss for a given pre-existing defect concentration, which indicates a threshold in the synergy between the inelastic and elastic energy loss.

  19. Folded Elastic Strip-Based Triboelectric Nanogenerator for Harvesting Human Motion Energy for Multiple Applications.

    PubMed

    Kang, Yue; Wang, Bo; Dai, Shuge; Liu, Guanlin; Pu, Yanping; Hu, Chenguo

    2015-09-16

    A folded elastic strip-based triboelectric nanogenerator (FS-TENG) made from two folded double-layer elastic strips of Al/PET and PTFE/PET can achieve multiple functions by low frequency mechanical motion. A single FS-TENG with strip width of 3 cm and length of 27 cm can generate a maximum output current, open-circuit voltage, and peak power of 55 μA, 840 V, and 7.33 mW at deformation frequency of 4 Hz with amplitude of 2.5 cm, respectively. This FS-TENG can work as a weight sensor due to its good elasticity. An integrated generator assembled by four FS-TENGs (IFS-TENG) can harvest the energy of human motion like flapping hands and walking steps. In addition, the IFS-TENG combined with electromagnetically induced electricity can achieve a completely self-driven doorbell with flashing lights. Moreover, a box-like generator integrated by four IFS-TENGs inside can work in horizontal or random motion modes and can be improved to harvest energy in all directions. This work promotes the research of completely self-driven systems and energy harvesting of human motion for applications in our daily life. PMID:26305461

  20. Outstanding mechanical properties of monolayer MoS2 and its application in elastic energy storage.

    PubMed

    Peng, Qing; De, Suvranu

    2013-11-28

    The structural and mechanical properties of graphene-like honeycomb monolayer structures of MoS2 (g-MoS2) under various large strains are investigated using density functional theory (DFT). g-MoS2 is mechanically stable and can sustain extra large strains: the ultimate strains are 0.24, 0.37, and 0.26 for armchair, zigzag, and biaxial deformation, respectively. The in-plane stiffness is as high as 120 N m(-1) (184 GPa equivalently). The third, fourth, and fifth order elastic constants are indispensable for accurate modeling of the mechanical properties under strains larger than 0.04, 0.07, and 0.13 respectively. The second order elastic constants, including in-plane stiffness, are predicted to monotonically increase with pressure while the Poisson ratio monotonically decreases with increasing pressure. With the prominent mechanical properties including large ultimate strains and in-plane stiffness, g-MoS2 is a promising candidate of elastic energy storage for clean energy. It possesses a theoretical energy storage capacity as high as 8.8 MJ L(-1) and 1.7 MJ kg(-1), or 476 W h kg(-1), larger than a Li-ion battery and is environmentally friendly. PMID:24126736

  1. Elastic Strain Energy Storage and Neighboring Organ Assistance for Fluid Propulsion

    NASA Astrophysics Data System (ADS)

    Arun, C. P.

    2003-11-01

    Storage of elastic strain energy by non-muscular structures such as tendons and ligaments, is a common scheme employed by jumping animals. Also, since skeletal muscle is attached to bone, mechanical advantage is obtained, allowing a burst of power that is unobtainable by muscle contraction alone. This is important at launch since force may be applied for only the brief period when the legs are in contact with the ground. Liquid propelling structures such as the urinary bladder and the heart face the similar problem of being able to impart force to the content only as long as the wall is in a stretched state. Using data from videocystometry and cardiac catheterisation we show that the means employed to achieve liquid propulsion appears to involve a combination of isometric contraction (contraction against a closed sphincter or valve) with hyperelastic stretch of the wall, elastic strain energy storage by the wall, overshoot past the undistended state and neighboring organ assistance (NOA). Thus, the heart, a partially collapsible thick muscular shell without the benefit of NOA manages an ejection fraction of about 70%. Using all of the above means, the collapsible urinary bladder is able to nearly always empty. Elastic strain energy storage and NOA appear to be important strategies for liquid propulsion employed by hollow viscera.

  2. Full potential study of the elastic, electronic, and optical properties of spinels MgIn 2S 4 and CdIn 2S 4 under pressure effect

    NASA Astrophysics Data System (ADS)

    Semari, F.; Khenata, R.; Rabah, M.; Bouhemadou, A.; Bin Omran, S.; Reshak, Ali H.; Rached, D.

    2010-12-01

    The structural, elastic, electronic, and optical properties of cubic spinel MgIn 2S 4 and CdIn 2S 4 compounds have been calculated using a full relativistic version of the full-potential linearized-augmented plane wave with the mixed basis FP/APW+lo method. The exchange and correlation potential is treated by the generalized-gradient approximation (GGA). Moreover, the Engel-Vosko GGA formalism is also applied to optimize the corresponding potential for band structure calculations. The ground state properties, including the lattice constants, the internal parameter, the bulk modulus, and the pressure derivative of the bulk modulus are in reasonable agreement with the available data. Using the total energy-strain technique, we have determined the full set of first-order elastic constants Cij and their pressure dependence, which have not been calculated or measured yet. The shear modulus, Young's modulus, and Poisson's ratio are calculated for polycrystalline XIn 2S 4 aggregates. The Debye temperature is estimated from the average sound velocity. Electronic band structures show a direct band gap (Г-Г) for MgIn 2S 4 and an indirect band gap (K-Г) for CdIn 2S 4. The calculated band gaps with EVGGA show a significant improvement over the GGA. The optical constants, including the dielectric function ɛ( ω), the refractive index n( ω), the reflectivity R( ω), and the energy loss function L( ω) were calculated for radiation up to 30 eV.

  3. Synergy of elastic and inelastic energy loss on ion track formation in SrTiO₃.

    PubMed

    Weber, William J; Zarkadoula, Eva; Pakarinen, Olli H; Sachan, Ritesh; Chisholm, Matthew F; Liu, Peng; Xue, Haizhou; Jin, Ke; Zhang, Yanwen

    2015-01-01

    While the interaction of energetic ions with solids is well known to result in inelastic energy loss to electrons and elastic energy loss to atomic nuclei in the solid, the coupled effects of these energy losses on defect production, nanostructure evolution and phase transformations in ionic and covalently bonded materials are complex and not well understood due to dependencies on electron-electron scattering processes, electron-phonon coupling, localized electronic excitations, diffusivity of charged defects, and solid-state radiolysis. Here we show that a colossal synergy occurs between inelastic energy loss and pre-existing atomic defects created by elastic energy loss in single crystal strontium titanate (SrTiO₃), resulting in the formation of nanometer-sized amorphous tracks, but only in the narrow region with pre-existing defects. These defects locally decrease the electronic and atomic thermal conductivities and increase electron-phonon coupling, which locally increase the intensity of the thermal spike for each ion. This work identifies a major gap in understanding on the role of defects in electronic energy dissipation and electron-phonon coupling; it also provides insights for creating novel interfaces and nanostructures to functionalize thin film structures, including tunable electronic, ionic, magnetic and optical properties. PMID:25578009

  4. Evidence for a vertebrate catapult: elastic energy storage in the plantaris tendon during frog jumping

    PubMed Central

    Astley, Henry C.; Roberts, Thomas J.

    2012-01-01

    Anuran jumping is one of the most powerful accelerations in vertebrate locomotion. Several species are hypothesized to use a catapult-like mechanism to store and rapidly release elastic energy, producing power outputs far beyond the capability of muscle. Most evidence for this mechanism comes from measurements of whole-body power output; the decoupling of joint motion and muscle shortening expected in a catapult-like mechanism has not been demonstrated. We used high-speed marker-based biplanar X-ray cinefluoroscopy to quantify plantaris muscle fascicle strain and ankle joint motion in frogs in order to test for two hallmarks of a catapult mechanism: (i) shortening of fascicles prior to joint movement (during tendon stretch), and (ii) rapid joint movement during the jump without rapid muscle-shortening (during tendon recoil). During all jumps, muscle fascicles shortened by an average of 7.8 per cent (54% of total strain) prior to joint movement, stretching the tendon. The subsequent period of initial joint movement and high joint angular acceleration occurred with minimal muscle fascicle length change, consistent with the recoil of the elastic tendon. These data support the plantaris longus tendon as a site of elastic energy storage during frog jumping, and demonstrate that catapult mechanisms may be employed even in sub-maximal jumps. PMID:22090204

  5. Ab Initio Potential Energy Surface for H-H2

    NASA Technical Reports Server (NTRS)

    Patridge, Harry; Bauschlicher, Charles W., Jr.; Stallcop, James R.; Levin, Eugene

    1993-01-01

    Ab initio calculations employing large basis sets are performed to determine an accurate potential energy surface for H-H2 interactions for a broad range of separation distances. At large distances, the spherically averaged potential determined from the calculated energies agrees well with the corresponding results determined from dispersion coefficients; the van der Waals well depth is predicted to be 75 +/- 3 micro E(h). Large basis sets have also been applied to reexamine the accuracy of theoretical repulsive potential energy surfaces (25-70 kcal/mol above the H-H2 asymptote) at small interatomic separations; the Boothroyd, Keogh, Martin, and Peterson (BKMP) potential energy surface is found to agree with results of the present calculations within the expected uncertainty (+/- 1 kcal/mol) of the fit. Multipolar expansions of the computed H-H2 potential energy surface are reported for four internuclear separation distances (1.2, 1.401, 1.449, and 1.7a(0)) of the hydrogen molecule. The differential elastic scattering cross section calculated from the present results is compared with the measurements from a crossed beam experiment.

  6. Low-energy elastic electron scattering from chloromethane, CH3Cl

    NASA Astrophysics Data System (ADS)

    Navarro, C.; Sakaamini, A.; Cross, J.; Hargreaves, L. R.; Khakoo, M. A.; Fedus, Kamil; Winstead, C.; McKoy, V.

    2015-10-01

    We report theoretical as well as (normalized) experimental differential and integral cross sections for vibrationally elastic scattering of low-energy electrons from chloromethane, CH3Cl, also known as methyl chloride. The theoretical cross sections were computed using the Schwinger multichannel variational method in the single-channel approximation, with polarization effects included via virtual excitations. Cross section measurements were made at incident energies ranging from 0.5 to 100 eV and at scattering angles from {5}\\circ to {125}\\circ . We compare our data to earlier previous results for this molecule.

  7. Low-energy elastic electron scattering form chloroethane, C2H5Cl

    NASA Astrophysics Data System (ADS)

    Sakaamini, A.; Navarro, C.; Cross, J.; Hargreaves, L. R.; Khakoo, M. A.; Fedus, Kamil; Winstead, C.; McKoy, V.

    2015-10-01

    We report theoretical as well as (normalized) experimental differential and integral cross sections for vibrationally elastic scattering of low-energy electrons from chloroethane, C2H5Cl, also known as ethyl chloride. The theoretical cross sections were computed using the Schwinger multichannel variational method in the single-channel approximation, with polarization effects included via virtual excitations. Cross section measurements were made at incident energies ranging from 1 to 30 eV and at scattering angles from {10}\\circ to {125}\\circ . We compare our data to previous results for C2H5Cl and for the related molecule chloromethane.

  8. A method to estimate the elastic energy stored in braided DNA molecules using hydrodynamic equations

    PubMed Central

    Fernández-Sierra, Mónica; Delgado-Martí, Violeta; Colón-García, Jorge E.; Quiñones, Edwin

    2011-01-01

    We present a single-molecule method for measuring the torque exerted by braided DNA molecules undergoing spontaneous unbraiding while attached to a paramagnetic dumbbell in the absence of external manipulation. A magnetic tweezers setup is employed to braid pairs of lambda DNA molecules covalently bound to a surface. Upon removing the magnetic field, the braided DNA molecules undergo spontaneous unbraiding, efficiently transforming the stored elastic energy into enough mechanical energy to rotate the tethered dumbbells for periods as long as 30 minutes. Using hydrodynamic equations we estimate the torque exerted on the dumbbells by the DNA braids, yielding values ranging from 47 to 166 pN nm. PMID:21765578

  9. Elastic scattering for the system {sup 6}Li+p at near barrier energies with MAGNEX

    SciTech Connect

    Soukeras, V.; Pakou, A.; Sgouros, O.; Cappuzzello, F.; Bondi, M.; Nicolosi, D.; Acosta, L.; Marquinez-Duran, G.; Martel, I.; Agodi, C.; Carbone, D.; Cavallaro, M.; Cunsolo, A.; Di Pietro, A.; Fernández-García, J. P.; Figuera, P.; Fisichella, M.; Alamanos, N.; De Napoli, M.; Foti, A.; and others

    2015-02-24

    Elastic scattering measurements have been performed for the {sup 6}Li+p system in inverse kinematics at the energies of 16, 20, 25 and 29 MeV. The heavy ejectile was detected by the large acceptance MAGNEX spectrometer at the Laboratori Nazionali del Sud (LNS) in Catania, in the angular range between ∼2{sup 0} and 12{sup 0} in the laboratory system, giving us the possibility to span almost a full angular range in the center of mass system. Results will be presented and discussed for one of the energies.

  10. Bundle structures of stretching-energy and nonlinear interactions among modes in elastic wave turbulence

    NASA Astrophysics Data System (ADS)

    Takaoka, Masanori; Yokoyama, Naoto

    2015-01-01

    The real-space dynamics and the nonlinear interactions among Fourier modes in elastic wave turbulence are investigated by simulating the Foppl-von Karman equation. We find that the bundle structures of ridges appear intermittently in the time evolution of the stretching energy field. The time-evolution of the nonlinearity indicates the existence of active and moderate phases in turbulent state. Conditional sampling analysis reveals that the bundle structure, which is the embodiment of the strong nonlinear interactions among modes, induces the energy supply from an external force to the system.

  11. Radius exponent in elastic and rigid arterial models optimized by the least energy principle

    PubMed Central

    Nakamura, Yoshihiro; Awa, Shoichi

    2014-01-01

    Abstract It was analyzed in normal physiological arteries whether the least energy principle would suffice to account for the radius exponent x. The mammalian arterial system was modeled as two types, the elastic or the rigid, to which Bernoulli's and Hagen‐Poiseuille's equations were applied, respectively. We minimized the total energy function E, which was defined as the sum of kinetic, pressure, metabolic and thermal energies, and loss of each per unit time in a single artery transporting viscous incompressible blood. Assuming a scaling exponent α between the vessel radius (r) and length (l) to be 1.0, x resulted in 2.33 in the elastic model. The rigid model provided a continuously changing x from 2.33 to 3.0, which corresponded to Uylings’ and Murray's theories, respectively, through a function combining Reynolds number with a proportional coefficient of the l − r relationship. These results were expanded to an asymmetric arterial fractal tree with the blood flow preservation rule. While x in the optimal elastic model accounted for around 2.3 in proximal systemic (r >1 mm) and whole pulmonary arteries (r ≥0.004 mm), optimal x in the rigid model explained 2.7 in elastic‐muscular (0.1 < r ≤1 mm) and 3.0 in peripheral resistive systemic arteries (0.004 ≤ r ≤0.1 mm), in agreement with data obtained from angiographic, cast‐morphometric, and in vivo experimental studies in the literature. The least energy principle on the total energy basis provides an alternate concept of optimality relating to mammalian arterial fractal dimensions under α = 1.0. PMID:24744905

  12. Geothermal Energy: Tapping the Potential

    ERIC Educational Resources Information Center

    Johnson, Bill

    2008-01-01

    Ground source geothermal energy enables one to tap into the earth's stored renewable energy for heating and cooling facilities. Proper application of ground-source geothermal technology can have a dramatic impact on the efficiency and financial performance of building energy utilization (30%+). At the same time, using this alternative energy…

  13. Nonlinear elastic effects on the energy flux deviation of ultrasonic waves in gr/ep composites

    NASA Technical Reports Server (NTRS)

    Prosser, William H.; Kriz, R. D.; Fitting, Dale W.

    1992-01-01

    The effects of nonlinear elasticity on energy flux deviation in undirectional gr/ep composites are examined. The shift in the flux deviation is modeled using acoustoelasticity theory and the second- and third-order elastic stiffness coefficients for T300/5208 gr/ep. Two conditions of applied uniaxial stress are considered. In the first case, the direction of applied uniaxial stress was along the fiber axis (x3), while in the second case it was perpendicular to the fiber axis along the laminate stacking direction (x1). For both conditions, the change in the energy flux deviation angle from the condition of zero applied stress is computed over the range of propagation directions of 0 to 60 deg from the fiber axis at two-degree intervals. A positive flux deviation angle implies the energy deviates away from the fiber direction toward the x1 axis, while a negative deviation means that the energy deviates toward the fibers. Over this range of fiber orientation angles, the energy of the quasi-longitudinal and pure mode transverse waves deviates toward the fibers, while that of the quasi-transverse mode deviates away from the fibers.

  14. Numerical simulations for width fluctuations in compound elastic and inelastic scattering at low energies

    SciTech Connect

    Kawano, Toshihiko; Talou, Patrick

    2012-09-18

    The statistical theories - the Hauser-Feshbach model with the width fluctuation correction - play a central role in studying nuclear reactions in the fast energy region, hence the statistical model codes are essential for the nuclear data evaluations nowadays. In this paper, we revisit issues regarding the statistical model calculations in the fast energy range, such as the inclusion of the direct channels, and the energy averaged cross sections using different statistical assumptions. Although they have been discussed for a long time, we need more precise quantitative investigations to understand uncertainties coming from the models deficiencies in the fast energy range. For example, the partition of compound formation cross section into the elastic and inelastic channels depends on the elastic enhancement factor calculated from the statistical models. In addition, unitarity of S-matrix constrains this partition when the direct reactions are involved. Practically some simple assumptions, which many nuclear reaction model codes adopt, may work reasonably for the nuclear data evaluations. However, the uncertainties on the evaluated cross sections cannot go lower than the model uncertainty itself. We perform numerical simulations by generating the resonances using the R-matrix theory, and compare the energy (ensemble) averaged cross sections with the statistical theories, such as the theories of Moldauer, HRTW (Hofmann, Richert, Tepel, and Weidenmueller), KKM (Kawai-Kerman-McVoy), and GOE (Gaussian orthogonal ensemble).

  15. Energy functions for rubber from microscopic potentials

    NASA Astrophysics Data System (ADS)

    Johal, A. S.; Dunstan, D. J.

    2007-04-01

    The finite deformation theory of rubber and related materials is based on energy functions that describe the macroscopic response of these materials under deformation. Energy functions and elastic constants are here derived from a simple microscopic (ball-and-spring) model. Exact uniaxial force-extension relationships are given for Hooke's Law and for the thermodynamic entropy-based microscopic model using the Gaussian and the inverse Langevin statistical approximations. Methods are given for finding the energy functions as expansions of tensor invariants of deformation, with exact solutions for functions that can be expressed as expansions in even powers of the extension. Comparison with experiment shows good agreement with the neo-Hookean energy function and we show how this derives directly from the simple Gaussian statistical model with a small modification.

  16. Measurement of compartment elasticity using pressure related ultrasound: a method to identify patients with potential compartment syndrome.

    PubMed

    Sellei, R M; Hingmann, S J; Kobbe, P; Weber, C; Grice, J E; Zimmerman, F; Jeromin, S; Gansslen, A; Hildebrand, F; Pape, H C

    2015-01-01

    PURPOSE OF THE STUDY Decision-making in treatment of an acute compartment syndrome is based on clinical assessment, supported by invasive monitoring. Thus, evolving compartment syndrome may require repeated pressure measurements. In suspected cases of potential compartment syndromes clinical assessment alone seems to be unreliable. The objective of this study was to investigate the feasibility of a non-invasive application estimating whole compartmental elasticity by ultrasound, which may improve accuracy of diagnostics. MATERIAL AND METHODS In an in-vitro model, using an artificial container simulating dimensions of the human anterior tibial compartment, intracompartmental pressures (p) were raised subsequently up to 80 mm Hg by infusion of saline solution. The compartmental depth (mm) in the cross-section view was measured before and after manual probe compression (100 mm Hg) upon the surface resulting in a linear compartmental displacement (Δd). This was repeated at rising compartmental pressures. The resulting displacements were related to the corresponding intra-compartmental pressures simulated in our model. A hypothesized relationship between pressures related compartmental displacement and the elasticity at elevated compartment pressures was investigated. RESULTS With rising compartmental pressures, a non-linear, reciprocal proportional relation between the displacement (mm) and the intra-compartmental pressure (mm Hg) occurred. The Pearson's coefficient showed a high correlation (r2 = -0.960). The intraobserver reliability value kappa resulted in a statistically high reliability (κ = 0.840). The inter-observer value indicated a fair reliability (κ = 0.640). CONCLUSIONS Our model reveals that a strong correlation between compartmental strain displacements assessed by ultrasound and the intra-compartmental pressure changes occurs. Further studies are required to prove whether this assessment is transferable to human muscle tissue. Determining the complete compartmental elasticity by ultrasound enhancement, this application may improve detection of early signs of potential compartment syndrome. Key words: compartment syndrome, intra-compartmental pressure, non-invasive diagnostic, elasticity measurement, elastography. PMID:26317290

  17. Analysis of Elastic Scattering of 8He+208Pb System at around the Coulomb Barrier Energies

    NASA Astrophysics Data System (ADS)

    Direkci, M.; Kucuk, Y.; Boztosun, I.

    2015-04-01

    The elastic scattering angular distribution of 8He+208Pb system is investigated at Elab = 22.0 MeV within the framework of Optical Model by using phenomenological and microscopic potentials. For the phenomenological Optical Model calculations, both real and imaginary parts of the complex nuclear potential have been chosen to have the Wood-Saxon shape. In the microscopic Optical Model calculations, we have used double folding procedure to calculate the real part of optical potential for different kinds of density distributions of 8He. A comparative study of this system has been conducted for the fist time by using phenomenological and microscopic potentials. It is observed that large imaginary radius value due to the existence of long-range absorption mechanism acting at large distances provides a very good agreement between theoretical results and experimental data with small χ2/N values.

  18. Potential of renewable and alternative energy sources

    NASA Astrophysics Data System (ADS)

    Konovalov, V.; Pogharnitskaya, O.; Rostovshchikova, A.; Matveenko, I.

    2015-11-01

    The article deals with application potential of clean alternative renewable energy sources. By means of system analysis the forecast for consumption of electrical energy in Tomsk Oblast as well as main energy sources of existing energy system have been studied up to 2018. Engineering potential of renewable and alternative energy sources is evaluated. Besides, ranking in the order of their efficiency descending is performed. It is concluded that Tomsk Oblast has high potential of alternative and renewable energy sources, among which the most promising development perspective is implementation of gasification stations to save fuel consumed by diesel power stations as well as building wind-power plants.

  19. Elastic resistance change and action potential generation of non-faradaic Pt/TiO2/Pt capacitors

    NASA Astrophysics Data System (ADS)

    Lim, Hyungkwang; Jang, Ho Won; Lee, Doh-Kwon; Kim, Inho; Hwang, Cheol Seong; Jeong, Doo Seok

    2013-06-01

    Electric current in the mixed ionic-electronic conductor TiO2 is hysteretic, i.e. history-dependent, and its use is versatile in electronic devices. Nowadays, biologically inspired, analogue-type computing systems, known as neuromorphic systems, are being actively investigated owing to their new and intriguing physical concepts. The realization of artificial synapses is important for constructing neuromorphic systems. In mammalians' brains, the plasticity of synapses between neighbouring nerve cells arises from action potential firing. Emulating action potential firing via inorganic systems has therefore become important in neuromorphic engineering. In this work, the current-voltage hysteresis of TiO2-based non-faradaic capacitors is investigated to primarily focus on the correlation between the blocking contact and the elasticity, i.e. non-plasticity, of the capacitors' resistance change, in experimental and theoretical methods. The similarity between the action potential firing behaviour in nerve cells and the elasticity of the non-faradaic capacitors is addressed.Electric current in the mixed ionic-electronic conductor TiO2 is hysteretic, i.e. history-dependent, and its use is versatile in electronic devices. Nowadays, biologically inspired, analogue-type computing systems, known as neuromorphic systems, are being actively investigated owing to their new and intriguing physical concepts. The realization of artificial synapses is important for constructing neuromorphic systems. In mammalians' brains, the plasticity of synapses between neighbouring nerve cells arises from action potential firing. Emulating action potential firing via inorganic systems has therefore become important in neuromorphic engineering. In this work, the current-voltage hysteresis of TiO2-based non-faradaic capacitors is investigated to primarily focus on the correlation between the blocking contact and the elasticity, i.e. non-plasticity, of the capacitors' resistance change, in experimental and theoretical methods. The similarity between the action potential firing behaviour in nerve cells and the elasticity of the non-faradaic capacitors is addressed. Electronic supplementary information (ESI) available. See DOI: 10.1039/c3nr02154h

  20. Antihydrogen-hydrogen elastic scattering at thermal energies using an atomic-orbital technique

    NASA Astrophysics Data System (ADS)

    Sinha, Prabal K.; Chaudhuri, Puspitapallab; Ghosh, A. S.

    2003-05-01

    In view of the recent interest in the trapping of antihydrogen atom H¯, at very low temperatures, H¯-H scattering has been investigated at low incident energies using a close-coupling model with the basis set H¯(1s,2s,2p¯)+H(1s,2s,2p¯). The predicted s-wave elastic phase shifts, scattering length, and effective range are in a good agreement with the other recent predictions of Jonsell et al. and of Armour and Chamberlain. The results indicate that the atomic orbital expansion model is suitable to study the H¯-H scattering at ultracold temperatures.

  1. Elastic scattering of low energy electrons in partially ionized dense semiclassical plasma

    NASA Astrophysics Data System (ADS)

    Dzhumagulova, K. N.; Shalenov, E. O.; Ramazanov, T. S.

    2015-08-01

    Elastic scattering of electrons by hydrogen atoms in a dense semiclassical hydrogen plasma for low impact energies has been studied. Differential scattering cross sections were calculated within the effective model of electron-atom interaction taking into account the effect of screening as well as the quantum mechanical effect of diffraction. The calculations were carried out on the basis of the phase-function method. The influence of the diffraction effect on the Ramsauer-Townsend effect was studied on the basis of a comparison with results made within the effective polarization model of the Buckingham type.

  2. EMTA’s Evaluation of the Elastic Properties for Fiber Polymer Composites Potentially Used in Hydropower Systems

    SciTech Connect

    Nguyen, Ba Nghiep; Paquette, Joshua

    2010-08-01

    Fiber-reinforced polymer composites can offer important advantages over metals where lightweight, cost-effective manufacturing and high mechanical performance can be achieved. To date, these materials have not been used in hydropower systems. In view of the possibility to tailor their mechanical properties to specific applications, they now have become a subject of research for potential use in hydropower systems. The first step in any structural design that uses composite materials consists of evaluating the basic composite mechanical properties as a function of the as-formed composite microstructure. These basic properties are the elastic stiffness, stress-strain response, and strength. This report describes the evaluation of the elastic stiffness for a series of common discontinuous fiber polymer composites processed by injection molding and compression molding in order to preliminarily estimate whether these composites could be used in hydropower systems for load-carrying components such as turbine blades. To this end, the EMTA (Copyright © Battelle 2010) predictive modeling tool developed at the Pacific Northwest National Laboratory (PNNL) has been applied to predict the elastic properties of these composites as a function of three key microstructural parameters: fiber volume fraction, fiber orientation distribution, and fiber length distribution. These parameters strongly control the composite mechanical performance and can be tailored to achieve property enhancement. EMTA uses the standard and enhanced Mori-Tanaka type models combined with the Eshelby equivalent inclusion method to predict the thermoelastic properties of the composite based on its microstructure.

  3. Simultaneous optical model analysis of elastic scattering, fusion, and breakup for the {sup 9}Be+{sup 144}Sm system at near-barrier energies

    SciTech Connect

    Gomez Camacho, A.; Gomes, P. R. S.; Lubian, J.; Padron, I.

    2008-05-15

    A simultaneous optical model calculation of elastic scattering, complete fusion, and breakup cross sections for energies around the Coulomb barrier is presented for reactions involving the weakly bound projectile {sup 9}Be on the medium size target {sup 144}Sm. In the calculations, the nuclear polarization potential U is split into a volume part U{sub F}, which is responsible for fusion reactions, and a surface part U{sub DR}, which accounts for direct reactions. A simultaneous {chi}{sup 2} analysis of elastic and complete fusion data shows that the extracted optical potential parameters of the real V{sub F} and imaginary W{sub F} parts of U{sub F} and the corresponding parts V{sub DR} and W{sub DR} of U{sub DR} satisfy separately the dispersion relation. Energy-dependent forms for the fusion and direct reaction potentials indicate that, at the strong absorption radius, the direct reaction potentials dominate over the fusion potentials. Moreover, the imaginary direct reaction potential results in a rather smooth function of E around the barrier energy. These findings show that the threshold anomaly, usually present in reactions with tightly bound projectiles, is not exhibited for the system {sup 9}Be+{sup 144}Sm. Within this formalism, the effect of breakup reactions on complete fusion is studied by turning on and off the potentials responsible for breakup reactions.

  4. Energy scavenging from acousto-elastic metamaterial using local resonance phenomenon

    NASA Astrophysics Data System (ADS)

    Ahmed, Riaz U.; Adiba, Afifa; Banerjee, Sourav

    2015-04-01

    This article presents the possibility of energy scavenging (ES) utilizing the physics of acousto-elastic metamaterial (AEMM) and use them in a dual mode (Acoustic Filter and Energy Harvester), simultaneously. Concurrent wave filtering and energy harvesting mechanism is previously presented using local resonance phenomenon in phononic crystal, however energy harvesting capabilities of AEMM is not reported extensively. Traditionally acoustic metamaterials are used in filtering acoustic waves by trapping or guiding the acoustic energy, whereas this work presents that the trapped dynamic energy inside the soft constituent (matrix) of metamaterials can be significantly harvested by strategically embedding piezoelectric wafers in the matrix. With unit cell model, we asserted that at lower acoustic frequencies maximum power in the micro Watts (~36μW) range can be generated, which is significantly higher than the existing harvesters of same kind. Efficient energy scavengers at low acoustic frequencies are almost absent due to large required size relevant to the acoustic wavelength. In this work we propose sub wave length scale energy scavengers utilizing the coupled physics of local, structural and matrix resonances. Upon validation of the argument through analytical, numerical and experimental studies, a broadband energy scavenger (ES) with multi-cell model is designed with varying geometrical properties.

  5. Nudged-elastic band method with two climbing images: Finding transition states in complex energy landscapes

    DOE PAGESBeta

    Zarkevich, Nikolai A.; Johnson, Duane D.

    2015-01-09

    The nudged-elastic band (NEB) method is modified with concomitant two climbing images (C2-NEB) to find a transition state (TS) in complex energy landscapes, such as those with a serpentine minimal energy path (MEP). If a single climbing image (C1-NEB) successfully finds the TS, then C2-NEB finds it too. Improved stability of C2-NEB makes it suitable for more complex cases, where C1-NEB misses the TS because the MEP and NEB directions near the saddle point are different. Generally, C2-NEB not only finds the TS, but guarantees, by construction, that the climbing images approach it from the opposite sides along the MEP.more » In addition, C2-NEB provides an accuracy estimate from the three images: the highest-energy one and its climbing neighbors. C2-NEB is suitable for fixed-cell NEB and the generalized solid-state NEB.« less

  6. Shear effects on energy dissipation from an elastic beam on a rigid foundation

    SciTech Connect

    Brink, Adam Ray; Quinn, D. Dane

    2015-10-20

    This paper describes the energy dissipation arising from microslip for an elastic shell incorporating shear and longitudinal deformation resting on a rough-rigid foundation. This phenomenon is investigated using finite element (FE) analysis and nonlinear geometrically exact shell theory. Both approaches illustrate the effect of shear within the shell and observe a reduction in the energy dissipated from microslip as compared to a similar system neglecting shear deformation. In particular, it is found that the shear deformation allows for load to be transmitted beyond the region of slip so that the entire interface contributes to the load carrying capability of the shell. The energy dissipation resulting from the shell model is shown to agree well with that arising from the FE model, and this representation can be used as a basis for reduced order models that capture the microslip phenomenon.

  7. Shear effects on energy dissipation from an elastic beam on a rigid foundation

    DOE PAGESBeta

    Brink, Adam Ray; Quinn, D. Dane

    2015-10-20

    This paper describes the energy dissipation arising from microslip for an elastic shell incorporating shear and longitudinal deformation resting on a rough-rigid foundation. This phenomenon is investigated using finite element (FE) analysis and nonlinear geometrically exact shell theory. Both approaches illustrate the effect of shear within the shell and observe a reduction in the energy dissipated from microslip as compared to a similar system neglecting shear deformation. In particular, it is found that the shear deformation allows for load to be transmitted beyond the region of slip so that the entire interface contributes to the load carrying capability of themore » shell. The energy dissipation resulting from the shell model is shown to agree well with that arising from the FE model, and this representation can be used as a basis for reduced order models that capture the microslip phenomenon.« less

  8. Nudged-elastic band method with two climbing images: Finding transition states in complex energy landscapes

    SciTech Connect

    Zarkevich, Nikolai A.; Johnson, Duane D.

    2015-01-09

    The nudged-elastic band (NEB) method is modified with concomitant two climbing images (C2-NEB) to find a transition state (TS) in complex energy landscapes, such as those with a serpentine minimal energy path (MEP). If a single climbing image (C1-NEB) successfully finds the TS, then C2-NEB finds it too. Improved stability of C2-NEB makes it suitable for more complex cases, where C1-NEB misses the TS because the MEP and NEB directions near the saddle point are different. Generally, C2-NEB not only finds the TS, but guarantees, by construction, that the climbing images approach it from the opposite sides along the MEP. In addition, C2-NEB provides an accuracy estimate from the three images: the highest-energy one and its climbing neighbors. C2-NEB is suitable for fixed-cell NEB and the generalized solid-state NEB.

  9. Experimental study of {sup 6}He+{sup 9}Be elastic scattering at low energies

    SciTech Connect

    Pires, K. C. C.; Lichtenthaeler, R.; Lepine-Szily, A.; Guimaraes, V.; Faria, P. N. de; Barioni, A.; Mendes Junior, D. R.; Morcelle, V.; Pampa Condori, R.; Morais, M. C.; Zamora, J. C.; Crema, E.; Moro, A. M.; Rodriguez-Gallardo, M.; Assuncao, M.; Shorto, J. M. B.; Mukherjee, S.

    2011-06-15

    New data for the {sup 6}He+{sup 9}Be reaction at E{sub lab}=16.2 and 21.3 MeV have been taken and analyzed. The effect of the collective couplings to the excited states of the target has been studied by means of coupled-channels calculations, using a double-folding potential for the bare interaction between the colliding nuclei, supplemented with a phenomenological imaginary part of Woods-Saxon type. In addition, three- and four-body continuum-discretized coupled-channels calculations have been performed to investigate the effect of the projectile breakup on the elastic scattering. Both effects, the coupling to target and projectile excited states, are found to affect significantly the elastic scattering. The trivial local polarization potential extracted from the continuum-discretized coupled-channels calculations indicates that continuum couplings produce a repulsive real part and a long-range imaginary part in the projectile-target interaction.

  10. Prediction of Dyke Propagation using the Minimum Potential Energy Principle

    NASA Astrophysics Data System (ADS)

    Heimisson, Elas; Hooper, Andrew; Sigmundsson, Freysteinn

    2015-04-01

    An important aspect of eruption forecasting is the prediction and monitoring of dyke propagation. Eruptions occur where dykes propagate to the surface, with lava flows causing a major threat. When such eruption occur under ice, as is common in Iceland, they become explosive and often cause hazardous and destructive floods. Dykes have also been known to trigger explosive eruption when hot basaltic magma comes in contact with more developed volatile saturated magma. Such explosive eruptions pose a danger to both lives and property. At divergent plate boundaries new crust is formed primarily by dyke injections. These injections usually grow laterally away from a central volcano. Lateral growth of a dyke is expected to follow the minimum potential energy principle. Assuming a closed system, a dyke will tend to be emplaced such that it minimizes the total potential energy, ?T, given by: ?T = ?s + ?g (1) where ?s is the strain potential and ?g the gravitational energy potential. Assuming that the elastic medium behaves linearly the strain potential can be calculated by numerically integrating the strain energy density over a large volume. If the dyke is assumed to be propagating at a constant depth with respect to sea level the gravitational potential energy can be turned into a two dimensional integral. We do this by integrating the predicted vertical displacements multiplied by the local topographic load above a reference surface and the acceleration of gravity. We approximate strain and stress due to plate movements and then consider strain changes induced by the dyke formation. Opening of a dyke is energetically favourable when it releases strain energy built up at a divergent plate boundary, but once deviatoric stress in the crust adjacent to a segment is released it becomes favourable to propagate laterally. Dyke formation is associated with uplift on their flanks; the lower the topographic load over the flanks, the less energy it costs. For any given location on a volcano, the strike of a new dyke segment will influence the strain and gravitational potential energy change in a different way. This type of model was applied to the more than 45 km long dyke formed in the Brarbunga volcanic system in Iceland in a rifting event in August 2014. Large observed changes in strike can be explained mostly by interplay of gravitational effects of topography and plate boundary strain. The model minimizing the total potential energy explains this propagation path. Our results suggest that by applying the total minimum potential energy principle we can forecast dyke propagation.

  11. Water Holding as Determinant for the Elastically Stored Energy in Protein-Based Gels.

    PubMed

    Pouvreau, Laurice; van Wijlen, Emke; Klok, Jan; Urbonaite, Vaida; Munialo, Claire D; de Jongh, Harmen H J

    2016-04-01

    To evaluate the importance of the water holding capacity for the elastically stored energy of protein gels, a range of gels were created from proteins from different origin (plant: pea and soy proteins, and animal: whey, blood plasma, egg white proteins, and ovalbumin) varying in network morphology set by the protein concentration, pH, ionic strength, or the presence of specific ions. The results showed that the observed positive and linear relation between water holding (WH) and elastically stored energy (RE) is generic for globular protein gels studied. The slopes of this relation are comparable for all globular protein gels (except for soy protein gels) whereas the intercept is close to 0 for most of the systems except for ovalbumin and egg white gels. The slope and intercept obtained allows one to predict the impact of tuning WH, by gel morphology or network stiffness, on the mechanical deformation of the protein-based gel. Addition of charged polysaccharides to a protein system leads to a deviation from the linear relation between WH and RE and this deviation coincides with a change in phase behavior. PMID:26894687

  12. Elastic cross sections for low-energy electron collisions with tetrahydropyran

    NASA Astrophysics Data System (ADS)

    Souza Barbosa, Alessandra; Bettega, Márcio H. F.

    2016-02-01

    We report on calculated elastic cross sections for low-energy electron collisions with the cyclic ether tetrahydropyran (C5H10O). The calculations were carried out with the Schwinger multichannel method implemented with norm-conserving pseudopotentials in the static-exchange-polarization approximation for energies up to 20 eV. Our cross sections are compared with previous results obtained for cyclohexane and 1,4-dioxane, since the three molecules present similar structures. The calculated differential cross sections for these three molecules present similarities, except at low scattering angles, where the differential cross sections of tetrahydropyran present a sharp increase due to the permanent dipole moment of the molecule. The similarities observed in the cross sections reveal that the molecular geometry plays an important role in the description of scattering process. We also compared our calculated elastic integral cross section for tetrahydropyran with experimental total cross sections data available in the literature and found a good qualitative agreement between both results. Contribution to the Topical Issue "Advances in Positron and Electron Scattering", edited by Paulo Limao-Vieira, Gustavo Garcia, E. Krishnakumar, James Sullivan, Hajime Tanuma and Zoran Petrovic.

  13. Elastic cross sections for low-energy electron collisions with tetrahydropyran

    NASA Astrophysics Data System (ADS)

    Barbosa, Alessandra Souza; Bettega, Márcio H. F.

    2016-02-01

    We report on calculated elastic cross sections for low-energy electron collisions with the cyclic ether tetrahydropyran (C5H10O). The calculations were carried out with the Schwinger multichannel method implemented with norm-conserving pseudopotentials in the static-exchange-polarization approximation for energies up to 20 eV. Our cross sections are compared with previous results obtained for cyclohexane and 1,4-dioxane, since the three molecules present similar structures. The calculated differential cross sections for these three molecules present similarities, except at low scattering angles, where the differential cross sections of tetrahydropyran present a sharp increase due to the permanent dipole moment of the molecule. The similarities observed in the cross sections reveal that the molecular geometry plays an important role in the description of scattering process. We also compared our calculated elastic integral cross section for tetrahydropyran with experimental total cross sections data available in the literature and found a good qualitative agreement between both results.

  14. Potential Water and Energy Savings from Showerheads

    SciTech Connect

    Biermayer, Peter J.

    2005-09-28

    This paper estimates the benefits and costs of six water reduction scenarios. Benefits and costs of showerhead scenarios are ranked in this paper by an estimated water reduction percentage. To prioritize potential water and energy saving scenarios regarding showerheads, six scenarios were analyzed for their potential water and energy savings and the associated dollar savings to the consumer.

  15. Elastic Energy Storage and Radial Forces in the Myofilament Lattice Depend on Sarcomere Length

    PubMed Central

    Williams, C. David; Regnier, Michael; Daniel, Thomas L.

    2012-01-01

    We most often consider muscle as a motor generating force in the direction of shortening, but less often consider its roles as a spring or a brake. Here we develop a fully three-dimensional spatially explicit model of muscle to isolate the locations of forces and energies that are difficult to separate experimentally. We show the strain energy in the thick and thin filaments is less than one third the strain energy in attached cross-bridges. This result suggests the cross-bridges act as springs, storing energy within muscle in addition to generating the force which powers muscle. Comparing model estimates of energy consumed to elastic energy stored, we show that the ratio of these two properties changes with sarcomere length. The model predicts storage of a greater fraction of energy at short sarcomere lengths, suggesting a mechanism by which muscle function shifts as force production declines, from motor to spring. Additionally, we investigate the force that muscle produces in the radial or transverse direction, orthogonal to the direction of shortening. We confirm prior experimental estimates that place radial forces on the same order of magnitude as axial forces, although we find that radial forces and axial forces vary differently with changes in sarcomere length. PMID:23166482

  16. Sub-wavelength energy trapping of elastic waves in a metamaterial.

    PubMed

    Colombi, Andrea; Roux, Philippe; Rupin, Matthieu

    2014-08-01

    Deep sub-wavelength focusing has been demonstrated for locally resonant metamaterials using electromagnetic and acoustic waves. The elastic equivalents of such objects are made of sub-wavelength resonating beams fixed to a two-dimensional plate, as presented here. Independent of a random or regular arrangement of the resonators, the metamaterial shows large bandgaps that are independent of the incident wave direction. Numerical simulations demonstrate that the insertion of a defect in the layout, as a shorter resonator, creates strong amplification of the wave-field on the defect. This energy trapping, which is localized on a spatial scale that is much smaller than the wavelength in the two-dimensional plate, leads to a >1 factor in terms of the local density of energy. PMID:25096146

  17. Cross sections for elastic electron scattering by tetramethylsilane in the intermediate-energy range

    SciTech Connect

    Sugohara, R. T.; Lee, M.-T.; Iga, I.; Souza, G. L. C. de; Homem, M. G. P.

    2011-12-15

    Organosilicon compounds are of current interest due to the numerous applications of these species in industries. Some of these applications require the knowledge of electron collision cross sections, which are scarce for such compounds. In this work, we report absolute values of differential, integral, and momentum-transfer cross sections for elastic electron scattering by tetramethylsilane (TMS) measured in the 100-1000 eV energy range. The relative-flow technique is used to normalize our data. In addition, the independent-atom-model (IAM) and the additivity rule (AR), widely used to model electron collisions with light hydrocarbons, are also applied for e{sup -}-TMS interaction. The comparison of our measured results of cross sections and the calculated data shows good agreement, particularly near the higher-end of incident energies.

  18. A balance between membrane elasticity and polymerization energy sets the shape of spherical clathrin coats

    PubMed Central

    Saleem, Mohammed; Morlot, Sandrine; Hohendahl, Annika; Manzi, John; Lenz, Martin; Roux, Aurélien

    2015-01-01

    In endocytosis, scaffolding is one of the mechanisms to create membrane curvature by moulding the membrane into the spherical shape of the clathrin cage. However, the impact of membrane elastic parameters on the assembly and shape of clathrin lattices has never been experimentally evaluated. Here, we show that membrane tension opposes clathrin polymerization. We reconstitute clathrin budding in vitro with giant unilamellar vesicles (GUVs), purified adaptors and clathrin. By changing the osmotic conditions, we find that clathrin coats cause extensive budding of GUVs under low membrane tension while polymerizing into shallow pits under moderate tension. High tension fully inhibits polymerization. Theoretically, we predict the tension values for which transitions between different clathrin coat shapes occur. We measure the changes in membrane tension during clathrin polymerization, and use our theoretical framework to estimate the polymerization energy from these data. Our results show that membrane tension controls clathrin-mediated budding by varying the membrane budding energy. PMID:25695735

  19. Development of an elastic-impulse power transmission for wind energy conversion systems

    NASA Astrophysics Data System (ADS)

    Pahl, B.

    1986-01-01

    A multiload-capable elastic-impulse power transmission for use in Wind Energy Conversion Systems (WECS) was designed, prototype constructed and bench tested. The transmission interposes a temporary energy storage device between the input and output shafts, and therefore allows the two shafts to rotate at virtually independent speeds. For utility interface induction generators which must run at essentially constant speed, the transmission allows the turbine rotor to run at variable speed, thereby maintaining the constant tip-speed ratio corresponding to the peak-power point. The transmission was found to work in principle, but the first construction prototype exhibited low efficiencies (24%) due to the constraints imposed by the utilization of commercial components.

  20. A balance between membrane elasticity and polymerization energy sets the shape of spherical clathrin coats

    NASA Astrophysics Data System (ADS)

    Saleem, Mohammed; Morlot, Sandrine; Hohendahl, Annika; Manzi, John; Lenz, Martin; Roux, Aurélien

    2015-02-01

    In endocytosis, scaffolding is one of the mechanisms to create membrane curvature by moulding the membrane into the spherical shape of the clathrin cage. However, the impact of membrane elastic parameters on the assembly and shape of clathrin lattices has never been experimentally evaluated. Here, we show that membrane tension opposes clathrin polymerization. We reconstitute clathrin budding in vitro with giant unilamellar vesicles (GUVs), purified adaptors and clathrin. By changing the osmotic conditions, we find that clathrin coats cause extensive budding of GUVs under low membrane tension while polymerizing into shallow pits under moderate tension. High tension fully inhibits polymerization. Theoretically, we predict the tension values for which transitions between different clathrin coat shapes occur. We measure the changes in membrane tension during clathrin polymerization, and use our theoretical framework to estimate the polymerization energy from these data. Our results show that membrane tension controls clathrin-mediated budding by varying the membrane budding energy.

  1. The surface-forming energy release rate based fracture criterion for elastic-plastic crack propagation

    NASA Astrophysics Data System (ADS)

    Xiao, Si; Wang, He-Ling; Liu, Bin; Hwang, Keh-Chih

    2015-11-01

    The J-integral based criterion is widely used in elastic-plastic fracture mechanics. However, it is not rigorously applicable when plastic unloading appears during crack propagation. One difficulty is that the energy density with plastic unloading in the J-integral cannot be defined unambiguously. In this paper, we alternatively start from the analysis on the power balance, and propose a surface-forming energy release rate (ERR), which represents the energy available for separating the crack surfaces during the crack propagation and excludes the loading-mode-dependent plastic dissipation. Therefore the surface-forming ERR based fracture criterion has wider applicability, including elastic-plastic crack propagation problems. Several formulae are derived for calculating the surface-forming ERR. From the most concise formula, it is interesting to note that the surface-forming ERR can be computed using only the stress and deformation of the current moment, and the definition of the energy density or work density is avoided. When an infinitesimal contour is chosen, the expression can be further simplified. For any fracture behaviors, the surface-forming ERR is proven to be path-independent, and the path-independence of its constituent term, so-called Js-integral, is also investigated. The physical meanings and applicability of the proposed surface-forming ERR, traditional ERR, Js-integral and J-integral are compared and discussed. Besides, we give an interpretation of Rice paradox by comparing the cohesive fracture model and the surface-forming ERR based fracture criterion.

  2. Geothermal Energy Potential in Western United States

    ERIC Educational Resources Information Center

    Pryde, Philip R.

    1977-01-01

    Reviews types of geothermal energy sources in the western states, including hot brine systems and dry steam systems. Conversion to electrical energy is a major potential use of geothermal energy, although it creates environmental disruptions such as noise, corrosion, and scaling of equipment. (AV)

  3. Wave energy transfer in elastic half-spaces with soft interlayers.

    PubMed

    Glushkov, Evgeny; Glushkova, Natalia; Fomenko, Sergey

    2015-04-01

    The paper deals with guided waves generated by a surface load in a coated elastic half-space. The analysis is based on the explicit integral and asymptotic expressions derived in terms of Green's matrix and given loads for both laminate and functionally graded substrates. To perform the energy analysis, explicit expressions for the time-averaged amount of energy transferred in the time-harmonic wave field by every excited guided or body wave through horizontal planes and lateral cylindrical surfaces have been also derived. The study is focused on the peculiarities of wave energy transmission in substrates with soft interlayers that serve as internal channels for the excited guided waves. The notable features of the source energy partitioning in such media are the domination of a single emerging mode in each consecutive frequency subrange and the appearance of reverse energy fluxes at certain frequencies. These effects as well as modal and spatial distribution of the wave energy coming from the source into the substructure are numerically analyzed and discussed. PMID:25920833

  4. Elastic energy within the human plantar aponeurosis contributes to arch shortening during the push-off phase of running.

    PubMed

    Wager, Justin C; Challis, John H

    2016-03-21

    During locomotion, the lower limb tendons undergo stretch and recoil, functioning like springs that recycle energy with each step. Cadaveric testing has demonstrated that the arch of the foot operates in this capacity during simple loading, yet it remains unclear whether this function exists during locomotion. In this study, one of the arch׳s passive elastic tissues (the plantar aponeurosis; PA) was investigated to glean insights about it and the entire arch of the foot during running. Subject specific computer models of the foot were driven using the kinematics of eight subjects running at 3.1m/s using two initial contact patterns (rearfoot and non-rearfoot). These models were used to estimate PA strain, force, and elastic energy storage during the stance phase. To examine the release of stored energy, the foot joint moments, powers, and work created by the PA were computed. Mean elastic energy stored in the PA was 3.1±1.6J, which was comparable to in situ testing values. Changes to the initial contact pattern did not change elastic energy storage or late stance PA function, but did alter PA pre-tensioning and function during early stance. In both initial contact patterns conditions, the PA power was positive during late stance, which reveals that the release of the stored elastic energy assists with shortening of the arch during push-off. As the PA is just one of the arch׳s passive elastic tissues, the entire arch may store additional energy and impact the metabolic cost of running. PMID:26944691

  5. Low-energy electron elastic scattering from Os atom: New electron affinity

    NASA Astrophysics Data System (ADS)

    Felfli, Z.; Kiros, F.; Msezane, A. Z.

    2013-05-01

    Bilodeau and Haugan measured the binding energies (BEs) of the ground state and the excited state of the Os- ion to be 1.07780(12) eV and 0.553(3) eV, respectively. These values are consistent with those calculated in. Here our investigation, using the recent complex angular momentum methodology wherein is embedded the crucial electron-electron correlations and the vital core polarization interaction, has found that the near threshold electron-Os elastic scattering total cross section (TCS) is characterized by three stable bound states of the Os- ion formed as resonances during the slow electron collision, with BEs of 1.910 eV, 1.230 eV and 0.224 eV. The new extracted electron affinity (EA) value from the TCS of 1.910 eV for the Os atom is significantly different from that measured in. Our calculated elastic differential cross sections (DCSs) also yield the relevant BEs for the ground and the two excited states of the Os- ion. The complex characteristic resonance structure in the TCS for the Os atom is ideal for catalysis, but makes it difficult to execute the Wigner threshold law in describing the threshold detachment behavior of complex atoms and extracting the reliable attendant EAs. Supported by U.S. DOE, AFOSR and CAU CFNM, NSF-CREST Program.

  6. Exploring elasticity and energy dissipation in mussel-inspired hydrogel transient networks

    NASA Astrophysics Data System (ADS)

    Grindy, Scott; Learsch, Robert; Holten-Andersen, Niels

    Dynamic, reversible crosslinks have been shown to specifically control the mechanical properties of a wide variety of mechanically tough and resilient biomaterials. We have shown that reversible histidine-metal ion interactions, known to contribute to the strong mechanical properties and self-healing nature of mussel byssal threads, can be used to control and engineer the temporally-hierarchical mechanical properties of model hydrogels orthogonally from the spatial structure of the material. Here, we explore the scaling relationships in our model networks to further inform our abilities to control the relative elasticity and energy dissipation on hierarchical timescales. Scaling arguments suggest that the elasticity is dominated by long-range entanglements, while the dissipation is controlled by the exchange kinetics of the transient crosslinks. Further, we show that by using UV light, we can further control the viscoelastic properties of our mussel-inspired hydrogels in situ. This process opens the door for creating biocompatible hydrogel materials with arbitrary spatial control over their viscoelastic mechanical properties. Overall, we show that by understanding the interplay between bio-inspired dynamic crosslinks and soft matter physics allows us to rationally design high-strength hydrogels for specific states of dynamic loading.

  7. Investigation of contact electrification based broadband energy harvesting mechanism using elastic PDMS microstructures

    NASA Astrophysics Data System (ADS)

    Dhakar, Lokesh; Tay, F. E. H.; Lee, Chengkuo

    2014-10-01

    Triboelectric energy harvesting has recently garnered a lot of interest because of its easy fabrication and high power output. Contact electrification depends on the chemical properties of contacting materials. Another important factor in contact electrification mechanism is surfaces’ elastic and topographical characteristics. One of the biggest limitations of resonant mechanism based devices is their narrow operating bandwidth. This paper presents a broadband mechanism which utilizes stiffness induced in the cantilever motion due to contact between two triboelectric surfaces. We have conducted experiments using polydimethylsiloxane (PDMS) micropad patterns to study the effect of micropad array configuration on the performance of triboelectric energy harvesting devices. The maximum power output measured from the device was observed to be 0.69 μW at an acceleration of 1 g. Due to the non-linearity introduced by contact separation mechanism, the bandwidth of the triboelectric energy harvester was observed to be increased by 63% at an acceleration level of 1 g. A hybrid energy harvesting mechanism has also been demonstrated by compounding the triboelectric energy harvester with a piezoelectric bimorph.

  8. Elastic vs. radiative heavy quark energy loss within a transport model

    NASA Astrophysics Data System (ADS)

    Uphoff, Jan; Fochler, Oliver; Xu, Zhe; Greiner, Carsten

    2014-12-01

    The full space-time evolution of gluons, light and heavy quarks in ultra-relativistic heavy-ion collisions is studied within the partonic transport model Boltzmann Approach to MultiParton Scatterings (BAMPS). We discuss for light and heavy quarks the elastic and radiative energy loss with a running coupling. Radiative processes, in particular, are implemented through an improved version of the Gunion-Bertsch matrix element, which is derived from comparisons to the exact result, explicitly taking finite heavy quark masses into account. Subsequently, we present results with and without radiative processes and compare them to experimental data at LHC. A focus is put on the nuclear modification factor of charged hadrons and D mesons.

  9. Electro-magneto-thermo-elastic response of infinite functionally graded cylinders without energy dissipation

    NASA Astrophysics Data System (ADS)

    Zenkour, Ashraf M.; Abbas, Ibrahim A.

    2015-12-01

    The electro-magneto-thermo-elastic analysis problem of an infinite functionally graded (FG) hollow cylinder is studied in the context of Green-Naghdi's (G-N) generalized thermoelasticity theory (without energy dissipation). Material properties are assumed to be graded in the radial direction according to a novel power-law distribution in terms of the volume fractions of the metal and ceramic constituents. The inner surface of the FG cylinder is pure metal whereas the outer surface is pure ceramic. The equations of motion and the heat-conduction equation are used to derive the governing second-order differential equations. A finite element scheme is presented for the numerical purpose. The system of differential equations is solved numerically and some plots for displacement, radial and electromagnetic stresses, and temperature are presented. The radial displacement, mechanical stresses and temperature as well as the electromagnetic stress are all investigated along the radial direction of the infinite cylinder.

  10. Elastic proton scattering at intermediate energies as a probe of the He,86 nuclear matter densities

    NASA Astrophysics Data System (ADS)

    Chung, Le Xuan; Kiselev, Oleg A.; Khoa, Dao T.; Egelhof, Peter

    2015-09-01

    The Glauber model analysis of the elastic He,86+p scattering data at energies around 700 MeV/nucleon, measured in two separate experiments at GSI-Darmstadt, has been carried out using several phenomenological parametrizations of the nuclear matter density. By taking into account the new data points measured at high-momentum transfer, the nuclear matter radii of ,8He6 have been accurately determined from the Glauber model analysis of the data, with the spin-orbital interaction explicitly taken into account. The well-known geometry for the core and dineutron halo has been used with the new parametrizations of the 6He density to extract the detailed information on the structure of 6He in terms of the core and dineutron halo radii. An enhanced sensitivity of the data measured at high-momentum transfer to the core part of the 6,8He densities has been found.

  11. Markov Chain Monte Carlo Effective Range Analysis of Low-Energy Electron Elastic Scattering from Xenon

    NASA Astrophysics Data System (ADS)

    Fedus, Kamil

    2016-02-01

    Modified effective range theory formulated as a Bayesian statistical model through the combination with Markov Chain Monte Carlo integration and fitting techniques is used to check the compatibility of different e --Xe scattering data such as the total cross-sections, the momentum transfer cross-sections, and the differential cross-sections that were determined experimentally in the region of Ramsauer-Townsend minimum. On the basis of this predictive approach, the most probable value of the scattering length, (-6.51 ± 0.05) a 0, is proposed. The present analysis suggests that the non-relativistic spinless effective range theory is suitable for the description of angular and energy dependencies of e --Xe elastic scattering cross-sections below the threshold for first inelastic process.

  12. Enhanced piezoelectric energy harvesting of a bistable oscillator with an elastic magnifier

    NASA Astrophysics Data System (ADS)

    Wang, Guang Qing; Liao, Wei-Hsin

    2015-04-01

    This paper presents theoretical investigation on a coupling system consisting of bistable oscillator with an elastic magnifier (EM) to improve the output performances in vibration energy harvesting. Lumped-parameter nonlinear equations of the coupling system are derived to describe the broadband large-amplitude periodic displacement responses of the coupling system. The effects of the system mass ratio and stiffness ration on the output performances are studied. It shows that increasing the mass ratio and stiffness ratio can improve the system output performances. The distinct advantage in the coupling system lies in the existence of large-orbit periodic vibration over low level range. With the comparison of the electromechanical trajectories obtained from simulations, it shows that the coupling system can harvest more power at low excitation level with larger bandwidth as compared to the bistable oscillator without an EM.

  13. Reactions with Weakly Bound Nuclei, at near Barrier Energies, and the Breakup and Transfer Influences on the Fusion and Elastic Scattering

    NASA Astrophysics Data System (ADS)

    Gomes, P. R. S.; Lubian, J.; Canto, L. F.; Otomar, D. R.; Junior, D. R. Mendes; de Faria, P. N.; Linares, R.; Sigaud, L.; Rangel, J.; Ferreira, J. L.; Ferioli, E.; Paes, B.; Cardozo, E. N.; Cortes, M. R.; Ermamatov, M. J.; Lotti, P.; Hussein, M. S.

    2016-03-01

    We present a brief review of the reaction mechanisms involved in collisions of weakly bound projectiles with tightly bound targets, at near-barrier energies. We discuss systematic behaviors of the data, with emphasis in fusion, breakup, nucleon transfer and elastic scattering. The dependence of the breakup cross section on the charge and mass of the target is discussed, and the influence of the breakup channel on complete fusion is investigated. For this purpose, we compare reduced fusion cross sections with a benchmark universal curve. The behaviors observed in the comparisons are explained in terms of polarization potentials and of nucleon transfer followed by breakup. The influence of the breakup process on elastic scattering is also discussed. Some apparent contradictions between results of different authors are explained and some perspectives of the field are presented.

  14. Reactions with Weakly Bound Nuclei, at near Barrier Energies, and the Breakup and Transfer Influences on the Fusion and Elastic Scattering

    NASA Astrophysics Data System (ADS)

    Gomes, P. R. S.; Lubian, J.; Canto, L. F.; Otomar, D. R.; Junior, D. R. Mendes; de Faria, P. N.; Linares, R.; Sigaud, L.; Rangel, J.; Ferreira, J. L.; Ferioli, E.; Paes, B.; Cardozo, E. N.; Cortes, M. R.; Ermamatov, M. J.; Lotti, P.; Hussein, M. S.

    2015-12-01

    We present a brief review of the reaction mechanisms involved in collisions of weakly bound projectiles with tightly bound targets, at near-barrier energies. We discuss systematic behaviors of the data, with emphasis in fusion, breakup, nucleon transfer and elastic scattering. The dependence of the breakup cross section on the charge and mass of the target is discussed, and the influence of the breakup channel on complete fusion is investigated. For this purpose, we compare reduced fusion cross sections with a benchmark universal curve. The behaviors observed in the comparisons are explained in terms of polarization potentials and of nucleon transfer followed by breakup. The influence of the breakup process on elastic scattering is also discussed. Some apparent contradictions between results of different authors are explained and some perspectives of the field are presented.

  15. Theoretical studies of potential energy surfaces

    SciTech Connect

    Harding, L.B.

    1995-07-01

    MRCI (configuration interaction) calculations were used to examine possible pathways for the O{sub 2} + CCH reaction. The H{sub 2} + CN potential surface was examined. An initial survey was made of the HCl + CN potential energy surface at a low level of theory.

  16. Potential of energy production from conserved forages

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Forages have a potential role in meeting the demand for energy. Perennial forages are attractive for various reasons. One, both the monetary and energy cost of planting is spread over many years. Two, we already have the equipment for harvesting, storing and transporting this source of biomass. Thre...

  17. Sources and potential uses of wave energy

    NASA Astrophysics Data System (ADS)

    Woodbridge, D. D.

    An analysis of ocean wave energy and its uses is presented. The ocean energy conversion systems surveyed include the ocean valve, the spherical vane, the hinged raft and the oscillating water column systems. The configuration of the Ocean Swell and Wave Energy Converter (OSWEC) is detailed, and its potential power output is discussed. It is noted that the utilization of a single OSWEC system of 20 MW would result in a savings of nearly 25,000 barrels of oil a month.

  18. Economic Energy Savings Potential in Federal Buildings

    SciTech Connect

    Brown, Daryl R.; Dirks, James A.; Hunt, Diane M.

    2000-09-04

    The primary objective of this study was to estimate the current life-cycle cost-effective (i.e., economic) energy savings potential in Federal buildings and the corresponding capital investment required to achieve these savings, with Federal financing. Estimates were developed for major categories of energy efficiency measures such as building envelope, heating system, cooling system, and lighting. The analysis was based on conditions (building stock and characteristics, retrofit technologies, interest rates, energy prices, etc.) existing in the late 1990s. The potential impact of changes to any of these factors in the future was not considered.

  19. Applying supersymmetry to energy dependent potentials

    SciTech Connect

    Yekken, R.; Lassaut, M.; Lombard, R.J.

    2013-11-15

    We investigate the supersymmetry properties of energy dependent potentials in the D=1 dimensional space. We show the main aspects of supersymmetry to be preserved, namely the factorization of the Hamiltonian, the connections between eigenvalues and wave functions of the partner Hamiltonians. Two methods are proposed. The first one requires the extension of the usual rules via the concept of local equivalent potential. In this case, the superpotential becomes depending on the state. The second method, applicable when the potential depends linearly on the energy, is similar to what has been already achieved by means of the Darboux transform. -- Highlights: •Supersymmetry extended to energy dependent potentials. •Generalization of the concept of superpotential. •An alternative method used for linear E-dependence leads to the same results as Darboux transform.

  20. Free energy of contact formation in proteins: Efficient computation in the elastic network approximation

    NASA Astrophysics Data System (ADS)

    Hamacher, Kay

    2011-07-01

    Biomolecular simulations have become a major tool in understanding biomolecules and their complexes. However, one can typically only investigate a few mutants or scenarios due to the severe computational demands of such simulations, leading to a great interest in method development to overcome this restriction. One way to achieve this is to reduce the complexity of the systems by an approximation of the forces acting upon the constituents of the molecule. The harmonic approximation used in elastic network models simplifies the physical complexity to the most reduced dynamics of these molecular systems. The reduced polymer modeled this way is typically comprised of mass points representing coarse-grained versions of, e.g., amino acids. In this work, we show how the computation of free energy contributions of contacts between two residues within the molecule can be reduced to a simple lookup operation in a precomputable matrix. Being able to compute such contributions is of great importance: protein design or molecular evolution changes introduce perturbations to these pair interactions, so we need to understand their impact. Perturbation to the interactions occurs due to randomized and fixated changes (in molecular evolution) or designed modifications of the protein structures (in bioengineering). These perturbations are modifications in the topology and the strength of the interactions modeled by the elastic network models. We apply the new algorithm to (1) the bovine trypsin inhibitor, a well-known enzyme in biomedicine, and show the connection to folding properties and the hydrophobic collapse hypothesis and (2) the serine proteinase inhibitor CI-2 and show the correlation to Φ values to characterize folding importance. Furthermore, we discuss the computational complexity and show empirical results for the average case, sampled over a library of 77 structurally diverse proteins. We found a relative speedup of up to 10 000-fold for large proteins with respect to repeated application of the initial model.

  1. The study of dp-elastic scattering at the energies from 500 to 1000 MeV/nucleon

    NASA Astrophysics Data System (ADS)

    Terekhin, A. A.; Gurchin, Yu. V.; Isupov, A. Yu.; Khrenov, A. N.; Kurilkin, A. K.; Kurilkin, P. K.; Ladygin, V. P.; Ladygina, N. B.; Piyadin, S. M.; Reznikov, S. G.; Vnukov, I. E.

    2015-11-01

    The results of the differential cross section measurements of dp-elastic scattering at energies from 500 to 1000 MeV/nucleon at Nuclotron JINR are reported. The data were obtained for angels range of 75-120∘ in the c.m.s. The results are compared with existing world data.

  2. Decreased elastic energy storage, not increased material stiffness, characterizes central artery dysfunction in fibulin-5 deficiency independent of sex.

    PubMed

    Ferruzzi, J; Bersi, M R; Uman, S; Yanagisawa, H; Humphrey, J D

    2015-03-01

    Central artery stiffness has emerged over the past 15 years as a clinically significant indicator of cardiovascular function and initiator of disease. Loss of elastic fiber integrity is one of the primary contributors to increased arterial stiffening in aging, hypertension, and related conditions. Elastic fibers consist of an elastin core and multiple glycoproteins; hence defects in any of these constituents can adversely affect arterial wall mechanics. In this paper, we focus on mechanical consequences of the loss of fibulin-5, an elastin-associated glycoprotein involved in elastogenesis. Specifically, we compared the biaxial mechanical properties of five central arteries-the ascending thoracic aorta, descending thoracic aorta, suprarenal abdominal aorta, infrarenal abdominal aorta, and common carotid artery-from male and female wild-type and fibulin-5 deficient mice. Results revealed that, independent of sex, all five regions in the fibulin-5 deficient mice manifested a marked increase in structural stiffness but also a marked decrease in elastic energy storage and typically an increase in energy dissipation, with all differences being most dramatic in the ascending and abdominal aortas. Given that the primary function of large arteries is to store elastic energy during systole and to use this energy during diastole to work on the blood, fibulin-5 deficiency results in a widespread diminishment of central artery function that can have significant effects on hemodynamics and cardiac function. PMID:25532020

  3. Energy conservation in Kenya: progress, potentials, problems

    SciTech Connect

    Schipper, L.; Hollander, J.M.; Milukas, M.; Alcamo, J.; Meyers, S.; Noll, S.

    1981-09-01

    A study was carried out of the flows of commercial energy in the economy of Kenya. Indications were sought of the extent to which energy conservation, (i.e., increase in efficiency of energy use) has reduced the ratio of energy inputs to economic outputs, in the post-1973 years. An assessment was made of the potential for energy conservation to reduce the growth of Kenyan energy use in the future and of significant barriers to increasing energy efficiency. Consideration was given to the role of government policy and of international assistance in fostering energy conservation in Kenya and other developing countries. The study was performed by analyzing available energy data and statistics from the largest oil companies, the Kenyan electric utility, and the government. These sources were supplemented by conducting personal interviews with personnel of nearly 50 commercial firms in Kenya. Direct consumption of fuel accounts for 94% of the commercial energy use in Kenya, while electricity accounts for 6%. The sectoral division of fuel use is: transportation 53%, industry 21%, energy production 11%, agriculture 9%, buildings and residences 5%, and construction 1%. For electricity the division is: buildings and residences 48%, industry 45%, energy production 4%, agriculture 2%, and construction 1%. Recent progress in conservation is reported.

  4. Elastic field of a surface step: Atomistic simulations and anisotropic elastic theory

    NASA Astrophysics Data System (ADS)

    Shilkrot, L. E.; Srolovitz, D. J.

    1996-04-01

    Atomistic computer simulations and anisotropic elastic theory are employed to determine the elastic fields of surface steps and vicinal surfaces. The displacement field of and interaction energies between <100> steps on a \\{001\\} surface of Ni and Au are determined using atomistic simulations and embedded-atom method potentials. The step-step interaction energy found from the simulations is consistent with a surface line force dipole elastic model of a step. We derive an anisotropic form for the elastic field associated with a surface line force dipole using a two-dimensional surface Green tensor for a cubic elastic half-space within the Stroh formalism. Both the displacement fields and step-step interaction energy predicted by the theory are shown to be in excellent agreement with the simulations. The symmetry of the step displacement field is used to determine analytically the relative values of the components of the surface force dipole vector.

  5. Elastic energy and phase structure in a continuous spin Ising chain with applications to chiral homopolymers.

    PubMed

    Chernodub, M N; Lundgren, Martin; Niemi, Antti J

    2011-01-01

    We present a numerical Monte Carlo analysis of the phase structure in a continuous spin Ising chain that describes chiral homopolymers. We find that depending on the value of the Metropolis temperature, the model displays the three known nontrivial phases of polymers: At low temperatures the model is in a collapsed phase, at medium temperatures it is in a random walk phase, and at high temperatures it enters the self-avoiding random walk phase. By investigating the temperature dependence of the specific energy we confirm that the transition between the collapsed phase and the random walk phase is a phase transition, while the random walk phase and self-avoiding random walk phase are separated from each other by a crossover transition. We propose that the model can be applied to characterize the statistical properties of protein folding. For this we compare the predictions of the model to a phenomenological elastic energy formula, proposed by J. Lei and K. Huang [e-print arXiv:1002.5013; Europhys. Lett. 88, 68004 (2009)] to describe folded proteins. PMID:21405680

  6. Determination of solid material elastic modulus and surface energy based on JKR contact model

    NASA Astrophysics Data System (ADS)

    Wu, Kuang-Chung; You, Hsien-I.

    2007-08-01

    The JKR contact theory is employed to study the adhesion phenomena between two solid materials in intimate contact. The elastic contact modulus and the work of adhesion of solid materials are obtained during adhesion tests by utilizing a micro force-deflection measuring apparatus. Six of the plastic materials, including polyethylene polyoxymethlene (POM), polyamide (PA), terephthalate (PET), polyvinyl chloride (PVC), polypropylene (PP), and ultra-high molecular weight polyethylene (UHMWPE) are used to evaluate the adhesion effect implied by the JKR theory. Comparison is made between surface energy obtained from the adhesion tests with that by a dynamic contact angle analyser. Results show that the load/deflection data in the loading phase are in good agreement with the predictions of JKR equation, and the experimental data of unloading phase deviate significantly from the JKR theory. The phenomena of adhesion hysteresis in loading tests are responsible for these results due to the effects of molecular reconstruction on solid surfaces in contact. The work of adhesions, and hence surface energies of plastic materials, calculated by the best fitting of JKR equation with the experimental data in the loading phase, agree satisfactorily in a comparable manner with that obtained using the contact angle analyser.

  7. Dislocations and crowdions in two-dimensional crystals. II. Elastic fields and intrinsic energies in a 2D hexagonal lattice

    NASA Astrophysics Data System (ADS)

    Natsik, V. D.; Smirnov, S. N.

    2015-03-01

    The fields of elastic deformation and stress around the centers of dislocations and crowdions in 2D crystals with isotropic elastic properties are described in the continuum approximation. The elastic energy of both types of defects was calculated and its dependence on crystal size was discussed. Considered also was the quantitative uncertainty associated with the inapplicability of the continual description of deformation at atomic distances from the centers of the defects. The results obtained by using the continuum theory were further improved by comparing with the results of numerical analysis using the methods of molecular dynamics of atomic structure of dislocations and crowdions in a hexagonal 2D crystal. The present work continues the study that was commenced in the previous paper (Fiz. Nizk. Temp. 40, 1366 (2014)).

  8. Asymmetry measurement of pion elastic scattering from polarized 13C in the energy region of the P33 resonance

    NASA Astrophysics Data System (ADS)

    Yen, Yi-Fen; Brinkmöller, B.; Dehnhard, D.; Sterbenz, S. M.; Yu, Yi-Ju; Berman, Brian; Burleson, G. R.; Cranston, K.; Klein, A.; Kyle, G. S.; Alarcon, R.; Averett, T.; Comfort, J. R.; Görgen, J. J.; Ritchie, B. G.; Tinsley, J. R.; Barlett, M.; Hoffmann, G. W.; Johnson, K.; Moore, C. F.; Purcell, M.; Ward, H.; Williams, A.; Faucett, J. A.; Greene, S. J.; Jarmer, J. J.; McGill, J. A.; Morris, C. L.; Penttilä, S.; Tanaka, N.; Fortune, H. T.; Insko, E.; Ivie, R.; O'donnell, J. M.; Smith, D.; Khandaker, M. A.; Chakravarti, S.

    1991-04-01

    Analyzing powers Ay were measured for π+ and π- elastic scattering from polarized 13C at energies near the P33 resonance. At Tπ=132 MeV the values of Ay are significantly different from zero for π-. For π+ at 132 MeV and for both π- and π+ at all other energies, the Ay are mostly consistent with zero. These data differ from the predictions of present pion-nucleus reaction theories, especially at large momentum transfers.

  9. Potential energy function for the hydroperoxyl radical

    SciTech Connect

    Lemon, W.J.; Hase, W.L.

    1987-03-12

    A switching function formalism is used to derive an analytic potential energy surface for the O + OH in equilibrium HO/sub 2/ in equilibrium H + O/sub 2/ reactive system. Both experimental and ab initio data are used to derive parameters for the potential energy surface. Trajectory calculations for highly excited HO/sub 2/ are performed on this surface. From these trajectories quasi-periodic eigentrajectories are found for vibrational levels near the HO/sub 2/ dissociation threshold with small amounts of quanta in the OH stretch mode and large amounts of quanta in the OO stretch mode.

  10. Biomass resource potential using energy crops

    SciTech Connect

    Wright, L.L.; Cushman, J.H.; Martin, S.A.

    1993-09-01

    Biomass energy crops can provide a significant and environmentally beneficial source of renewable energy feedstocks for the future. They can revitalize the agricultural sector of the US economy by providing profitable uses for marginal cropland. Energy crops include fast-growing trees, perennial grasses, and annual grasses, all capable of collecting solar energy and storing it as cellulosic compounds for several months to several years. Once solar energy is thus captured, it can be converted by means of currently available technologies to a wide variety of energy products such as electricity, heat, liquid transportation fuels, and gases. Experimental results from field trials have generated optimism that selected and improved energy crops, established on cropland with moderate limitations for crop production, have the potential for producing high yields. Both trees and grasses, under very good growing conditions, have produced average annual yields of 20 to 40 dry Mg ha{sup {minus}1} year{sup {minus}1}. Sorghum has shown especially high yields in the Midwest. Hybrids between sugar cane and its wild relatives, called energy cane, have yielded as much as 50 dry Mg ha{sup {minus}1} year{sup {minus}1} in Florida. These experimental results demonstrate that some species have the genetic potential for very rapid growth rates. New wood energy crop systems developed by the Department of Energy`s Biofuels Feedstock Development Program offer, at a minimum, a 100% increase in biomass production rates over the 2 to 4 Mg ha{sup {minus}1} year{sup {minus}1} of dry leafless woody biomass produced by most natural forest systems. Experimental data indicate that short rotation wood crops established on cropland with moderate limitations are capable of producing biomass yields of 8--20 dry Mg ha{sup {minus}1} year{sup {minus}1} with a present average about 11 dry Mg ha{sup {minus}1} year{sup {minus}1} on typical cropland sites.

  11. Stress potential function formulation and complex variable function method for solving the elasticity of quasicrystals of point group 10 and the exact solution for the notch problem

    NASA Astrophysics Data System (ADS)

    Li, Lian He; You Fan, Tian

    2006-11-01

    The plane elasticity equations of two-dimensional quasicrystals of point group 10 are reduced to a single partial differential equation with eighth order by introducing a stress potential function. Further, we develop the complex variable function method for classical elasticity theory to that of the quasicrystals. The complex representations of stress and displacement components of phonon and phason fields in the quasicrystals are given. With the help of conformal transformation, an exact solution for the elliptic notch of the quasicrystals is presented. The solution of the Griffith crack problem as a special case of the results is also observed. This work shows that the stress potential and complex variable function methods are powerful for solving the complicated boundary value problems of higher order partial differential equations originating from quasicrystal elasticity.

  12. Potential reduction of DSN uplink energy cost

    NASA Technical Reports Server (NTRS)

    Dolinsky, S.; Degroot, N. F.

    1982-01-01

    DSN Earth stations typically transmit more power than that required to meet minimum specifications for uplink performance. Energy and cost savings that could result from matching the uplink power to the amount required for specified performance are studied. The Galileo mission was selected as a case study. Although substantial reduction in transmitted energy is possible, potential savings in source energy (oil or electricity) savings are much less. This is because of the rising inefficiency in power conversion and radio frequency power generation that accompanies reduced power output.

  13. Potential energy studies on silane dimers

    NASA Astrophysics Data System (ADS)

    Mahlanen, Riina; Pakkanen, Tapani A.

    2011-04-01

    Intermolecular interactions and parameters for use in MD studies of large molecule systems have earlier been determined for hydrocarbons, carbon tetrahalides and sulfur. The paper reports a model representing nonbonding interactions between silane molecules, which were examined in the same way as hydrocarbons in an earlier (neopentane, isopropane, propane, and ethane) study. Intermolecular potentials were determined for 11 combinations of silane compound pairs (silane SiH 4, disilane Si 2H 6, trisilane Si 3H 8, isotetrasilane Si 4H 10 and neopentasilane Si 5H 12) with MP2/aug(df)-6-311G ∗ab initio calculations. The most stable dimer configurations were identified. With use of the modified Morse potential model to represent the interactions, 276 new potential energy surfaces were generated for silane dimers. Separate and generic pair potentials were calculated for the silanes. The pair potentials can be used in MD studies of silanes.

  14. Effect of inelastic and elastic energy losses of Xe ions on the evolution of hydrogen blisters in silicon

    NASA Astrophysics Data System (ADS)

    Reutov, V. F.; Dmitriev, S. N.; Sokhatskii, A. S.; Zaluzhnyi, A. G.

    2016-01-01

    We analyze the effect of irradiation by heavy ions on the formation of blisters on the silicon surface preliminarily ion-doped with hydrogen. An attempt is made at differentiating inelastic and elastic processes of interaction between ions and Si atoms using bombardment of the sample with high-energy charged particles through a bent absorbing filter by varying the radiation doses and the energy of bombarding Xe ions. It is found that irrespective of specific ionization energy losses of heavy ions, the blister formation is completely suppressed in the zone of the inelastic interaction during postradiation annealing. Conversely, stimulated development of hydrogen porosity takes place at the same time in the zone of elastic interaction, which is manifested in the form of blisters and flaking.

  15. Elastic energy storage in the shoulder and the evolution of high-speed throwing in Homo.

    PubMed

    Roach, Neil T; Venkadesan, Madhusudhan; Rainbow, Michael J; Lieberman, Daniel E

    2013-06-27

    Some primates, including chimpanzees, throw objects occasionally, but only humans regularly throw projectiles with high speed and accuracy. Darwin noted that the unique throwing abilities of humans, which were made possible when bipedalism emancipated the arms, enabled foragers to hunt effectively using projectiles. However, there has been little consideration of the evolution of throwing in the years since Darwin made his observations, in part because of a lack of evidence of when, how and why hominins evolved the ability to generate high-speed throws. Here we use experimental studies of humans throwing projectiles to show that our throwing capabilities largely result from several derived anatomical features that enable elastic energy storage and release at the shoulder. These features first appear together approximately 2 million years ago in the species Homo erectus. Taking into consideration archaeological evidence suggesting that hunting activity intensified around this time, we conclude that selection for throwing as a means to hunt probably had an important role in the evolution of the genus Homo. PMID:23803849

  16. Wind energy potential in the United States

    SciTech Connect

    Elliott, D.L.; Schwartz, M.N.

    1993-06-01

    Estimates of the electricity that could potentially be generated by wind power and of the land area available for wind energy development have been calculated for the contiguous United States. The estimates are based on published wind resource data and exclude windy lands that are not suitable for development as a result of environmental and land-use considerations. Despite these exclusions, the potential electric power from wind energy is surprisingly large. Good wind areas, which cover 6% of the contiguous US land area, have the potential to supply more than one and a half times the current electricity consumption of the United States. Technology under development today will be capable of producing electricity economically from good wind sites in many regions of the country.

  17. First Principles Investigation of the Elastic, Optoelectronic and Thermal Properties of XRuSb: (X = V, Nb, Ta) Semi-Heusler Compounds Using the mBJ Exchange Potential

    NASA Astrophysics Data System (ADS)

    Bencherif, K.; Yakoubi, A.; Della, N.; Miloud Abid, O.; Khachai, H.; Ahmed, R.; Khenata, R.; Bin Omran, S.; Gupta, S. K.; Murtaza, G.

    2016-04-01

    Semi-Heusler materials are intensively investigated due to their potential use in diverse applications, such as in spintronics and green energy applications. In this work, we employ the density functional theory to calculate the structural, electronic, elastic, thermal and optical properties of the VRuSb, NbRuSb and TaRuSb semi-Heusler compounds. The calculated results for the lattice constants, bulk moduli and their corresponding pressure derivative values are in fairly good agreement with previous works. In addition, besides the local density approximation, the modified Becke-Johnson exchange potential is also used to improve the value of the band gaps. The bonding nature reveals a mixture of covalent and ionic bonding character of the VRuSb, NbRuSb and TaRuSb compounds. Furthermore, the elastic constants (C ij) and the related elastic moduli confirm their stability in the cubic phase and demonstrate their ductile nature. We also analyze the influence of the pressure and temperature on the primitive cell volume, heat capacity, volume expansion coefficient, and Debye temperature of the semi-Heusler compounds. Additionally, we investigate the optical properties, such as the complex dielectric function, refractive index, reflectivity, and the energy loss function.

  18. Potential energy savings from aquifer thermal energy storage

    SciTech Connect

    Anderson, M.R.; Weijo, R.O.

    1988-07-01

    Pacific Northwest Laboratory researchers developed an aggregate-level model to estimate the short- and long-term potential energy savings from using aquifer thermal storage (ATES) in the United States. The objectives of this effort were to (1) develop a basis from which to recommend whether heat or chill ATES should receive future research focus and (2) determine which market sector (residential, commercial, or industrial) offers the largest potential energy savings from ATES. Information was collected on the proportion of US land area suitable for ATES applications. The economic feasibility of ATES applications was then evaluated. The potential energy savings from ATES applications was calculated. Characteristic energy use in the residential, commercial, and industrial sectors was examined, as was the relationship between waste heat production and consumption by industrial end-users. These analyses provided the basis for two main conclusions: heat ATES applications offer higher potential for energy savings than do chill ATES applications; and the industrial sector can achieve the highest potential energy savings for the large consumption markets. Based on these findings, it is recommended that future ATES research and development efforts be directed toward heat ATES applications in the industrial sector. 11 refs., 6 figs., 9 tabs.

  19. How well do we understand quasi-elastic reactions at energies close to the barrier

    SciTech Connect

    Rehm, K.E.

    1988-01-01

    In collisions between too heavy nuclei a wide spectrum of different reaction modes is observed covering the range from simple processes like elastic scattering to complicated multistep transfers and fusion. On the theoretical side heavy ion reactions are usually analyzed using models that were developed first for light ion induced reactions: the optical model for elastic scattering and the DWBA for more inelastic processes like transfer and inelastic scattering. Some of the assumptions going into these approximations, however, are not valid for heavy ion induced reactions. The region between fusion and quasi-elastic reactions is not well understood theoretically. This region is associated with deep inelastic collisions, which are complex multiparticle reactions involving transfer of several protons and neutrons. In this paper, the author discusses to what extent experiments in the field of quasi-elastic scattering are understood within the framework of various theoretical models and in what areas more work is needed.

  20. Free energy perturbation method for measuring elastic constants of liquid crystals

    NASA Astrophysics Data System (ADS)

    Joshi, Abhijeet

    There is considerable interest in designing liquid crystals capable of yielding specific morphological responses in confined environments, including capillaries and droplets. The morphology of a liquid crystal is largely dictated by the elastic constants, which are difficult to measure and are only available for a handful of substances. In this work, a first-principles based method is proposed to calculate the Frank elastic constants of nematic liquid crystals directly from atomistic models. These include the standard splay, twist and bend deformations, and the often-ignored but important saddle-splay constant. The proposed method is validated using a well-studied Gay-Berne(3,5,2,1) model; we examine the effects of temperature and system size on the elastic constants in the nematic and smectic phases. We find that our measurements of splay, twist, and bend elastic constants are consistent with previous estimates for the nematic phase. We further outline the implementation of our approach for the saddle-splay elastic constant, and find it to have a value at the limits of the Ericksen inequalities. We then proceed to report results for the elastic constants commonly known liquid crystals namely 4-pentyl-4'-cynobiphenyl (5CB) using atomistic model, and show that the values predicted by our approach are consistent with a subset of the available but limited experimental literature.

  1. Predicting the Drop Performance of Solder Joints by Evaluating the Elastic Strain Energy from High-Speed Ball Pull Tests

    NASA Astrophysics Data System (ADS)

    You, Taehoon; Kim, Yunsung; Kim, Jina; Lee, Jaehong; Jung, Byungwook; Moon, Jungtak; Choe, Heeman

    2009-03-01

    Despite being expensive and time consuming, board-level drop testing has been widely used to assess the drop or impact resistance of the solder joints in handheld microelectronic devices, such as cellphones and personal digital assistants (PDAs). In this study, a new test method, which is much simpler and quicker, is proposed. The method involves evaluating the elastic strain energy and relating it to the impact resistance of the solder joint by considering the Young’s modulus of the bulk solder and the fracture stress of the solder joint during a ball pull test at high strain rates. The results show that solder joints can be ranked in order of descending elastic strain energy as follows: Sn-37Pb, Sn-1Ag-0.5Cu, Sn-3Ag-0.5Cu, and Sn-4Ag-0.5Cu. This order is consistent with the actual drop performances of the samples.

  2. Measurements of the energy dependence of the analyzing power in pp elastic scattering in the CNI region

    SciTech Connect

    Bazilevsky A.; Alekseev, I.; Aschenauer, E.; Atoyan, G.; Bravar, A.; Bunce, G.; Boyle, K.; Gill, R.; Huang, H.; Lee, S.; Makdisi, Y.; Morozov, B.; Nakagawa, I.; Okada, H.; Svirida, D.; Zelenski, A.

    2010-09-27

    We present new measurements of the analyzing power A{sub N} in proton-proton elastic scattering in the Coulomb-Nuclear Interference region at {radical}s = 7.7 and 21.7 GeV obtained with the polarized atomic hydrogen jet target at RHIC. These measurements complement our earlier results at {radical}s = 6.8 and 13.7 GeV confirming the presence of a hadronic helicity flip amplitude contribution in proton-proton elastic scattering at lower energies ({radical}s <8 GeV) while higher energy data ({radical}s >13 GeV) are consistent with no hadronic helicity flip contribution.

  3. Numerical experiments for effects of elastic strain energy on decomposition process of binary alloy in a two-dimensional system

    NASA Astrophysics Data System (ADS)

    Hatta, N.; Kaneko, T.; Ishii, R.

    1990-06-01

    This paper is concerned with phase decomposition of a supersaturated solid solution in a two-dimensional system. We have investigated the behavior of numerical solutions to the Cahn equation including an elastic strain energy term in such a way as to follow the time evolution of composition modulation by computer. It is found that in our numerical experiment the introduction of the elastic strain energy gives no anisotropic effect on the crystallographic direction of the composition modulation, but leads to the decrease in the decomposition rate and quantity at the equilibrium state. Again, it is demonstrated that for a high solute alloy system inside the spinodal region a large circular precipitate is formed at the center of the flat matrix through a very complicated process accompanied with the aggregation and annihilation of particles. The results so obtained are discussed from a numerical point of view.

  4. Differential elastic electron scattering cross sections for CCl4 by 1.5-100 eV energy electron impact.

    PubMed

    Limão-Vieira, P; Horie, M; Kato, H; Hoshino, M; Blanco, F; García, G; Buckman, S J; Tanaka, H

    2011-12-21

    We report absolute elastic differential, integral and momentum transfer cross sections for electron interactions with CCl(4). The incident electron energy range is 1.5-100 eV, and the scattered electron angular range for the differential measurements varies from 15°-130°. The absolute scale of the differential cross section was set using the relative flow technique with helium as the reference species. Comparison with previous total cross sections shows good agreement. Atomic-like behaviour in this scattering system is shown here for the first time, and is further investigated by comparing the CCl(4) elastic cross sections to recent results on the halomethanes and atomic chlorine at higher impact energies [H. Kato, T. Asahina, H. Masui, M. Hoshino, H. Tanaka, H. Cho, O. Ingólfsson, F. Blanco, G. Garcia, S. J. Buckman, and M. J. Brunger, J. Chem. Phys. 132, 074309 (2010)]. PMID:22191877

  5. Computed potential energy surfaces for chemical reactions

    NASA Technical Reports Server (NTRS)

    Walch, Stephen P.

    1994-01-01

    Quantum mechanical methods have been used to compute potential energy surfaces for chemical reactions. The reactions studied were among those believed to be important to the NASP and HSR programs and included the recombination of two H atoms with several different third bodies; the reactions in the thermal Zeldovich mechanism; the reactions of H atom with O2, N2, and NO; reactions involved in the thermal De-NO(x) process; and the reaction of CH(squared Pi) with N2 (leading to 'prompt NO'). These potential energy surfaces have been used to compute reaction rate constants and rates of unimolecular decomposition. An additional application was the calculation of transport properties of gases using a semiclassical approximation (and in the case of interactions involving hydrogen inclusion of quantum mechanical effects).

  6. Computed potential energy surfaces for chemical reactions

    NASA Technical Reports Server (NTRS)

    Walch, Stephen P.

    1990-01-01

    The objective was to obtain accurate potential energy surfaces (PES's) for a number of reactions which are important in the H/N/O combustion process. The interest in this is centered around the design of the SCRAM jet engine for the National Aerospace Plane (NASP), which was envisioned as an air-breathing hydrogen-burning vehicle capable of reaching velocities as large as Mach 25. Preliminary studies indicated that the supersonic flow in the combustor region of the scram jet engine required accurate reaction rate data for reactions in the H/N/O system, some of which was not readily available from experiment. The most important class of combustion reactions from the standpoint of the NASP project are radical recombinaton reactions, since these reactions result in most of the heat release in the combustion process. Theoretical characterizations of the potential energy surfaces for these reactions are presented and discussed.

  7. Low energy positron interactions with uracil—Total scattering, positronium formation, and differential elastic scattering cross sections

    SciTech Connect

    Anderson, E. K.; Boadle, R. A.; Machacek, J. R.; Makochekanwa, C.; Sullivan, J. P.; Chiari, L.; Buckman, S. J.; Brunger, M. J.; Garcia, G.; Blanco, F.; Ingolfsson, O.

    2014-07-21

    Measurements of the grand total and total positronium formation cross sections for positron scattering from uracil have been performed for energies between 1 and 180 eV, using a trap-based beam apparatus. Angular, quasi-elastic differential cross section measurements at 1, 3, 5, 10, and 20 eV are also presented and discussed. These measurements are compared to existing experimental results and theoretical calculations, including our own calculations using a variant of the independent atom approach.

  8. Bulk elastic moduli and solute potentials in leaves of freshwater, coastal and marine hydrophytes. Are marine plants more rigid?

    PubMed Central

    Touchette, Brant W.; Marcus, Sarah E.; Adams, Emily C.

    2014-01-01

    Bulk modulus of elasticity (ɛ), depicting the flexibility of plant tissues, is recognized as an important component in maintaining internal water balance. Elevated ɛ and comparatively low osmotic potential (Ψπ) may work in concert to effectively maintain vital cellular water content. This concept, termed the ‘cell water conservation hypothesis’, may foster tolerance for lower soil-water potentials in plants while minimizing cell dehydration and shrinkage. Therefore, the accumulation of solutes in marine plants, causing decreases in Ψπ, play an important role in plant–water relations and likely works with higher ɛ to achieve favourable cell volumes. While it is generally held that plants residing in marine systems have higher leaf tissue ɛ, to our knowledge no study has specifically addressed this notion in aquatic and wetland plants residing in marine and freshwater systems. Therefore, we compared ɛ and Ψπ in leaf tissues of 38 freshwater, coastal and marine plant species using data collected in our laboratory, with additional values from the literature. Overall, 8 of the 10 highest ɛ values were observed in marine plants, and 20 of the lowest 25 ɛ values were recorded in freshwater plants. As expected, marine plants often had lower Ψπ, wherein the majority of marine plants were below −1.0 MPa and the majority of freshwater plants were above −1.0 MPa. While there were no differences among habitat type and symplastic water content (θsym), we did observe higher θsym in shrubs when compared with graminoids, and believe that the comparatively low θsym observed in aquatic grasses may be attributed to their tendency to develop aerenchyma that hold apoplastic water. These results, with few exceptions, support the premise that leaf tissues of plants acclimated to marine environments tend to have higher ɛ and lower Ψπ, and agree with the general tenets of the cell water conservation hypothesis. PMID:24876296

  9. Energy Savings Potential of Radiative Cooling Technologies

    SciTech Connect

    Fernandez, Nicholas; Wang, Weimin; Alvine, Kyle J.; Katipamula, Srinivas

    2015-11-30

    Pacific Northwest National Laboratory (PNNL), with funding from the U.S. Department of Energy’s (DOE’s) Building Technologies Program (BTP), conducted a study to estimate, through simulation, the potential cooling energy savings that could be achieved through novel approaches to capturing free radiative cooling in buildings, particularly photonic ‘selective emittance’ materials. This report documents the results of that study.

  10. Convective Available Potential Energy of World Ocean

    NASA Astrophysics Data System (ADS)

    Su, Z.; Ingersoll, A. P.; Thompson, A. F.

    2012-12-01

    Here, for the first time, we propose the concept of Ocean Convective Available Potential Energy (OCAPE), which is the maximum kinetic energy (KE) per unit seawater mass achievable by ocean convection. OCAPE occurs through a different mechanism from atmospheric CAPE, and involves the interplay of temperature and salinity on the equation of state of seawater. The thermobaric effect, which arises because the thermal coefficient of expansion increases with depth, is an important ingredient of OCAPE. We develop an accurate algorithm to calculate the OCAPE for a given temperature and salinity profile. We then validate our calculation of OCAPE by comparing it with the conversion of OCAPE to KE in a 2-D numerical model. We propose that OCAPE is an important energy source of ocean deep convection and contributes to deep water formation. OCAPE, like Atmospheric CAPE, can help predict deep convection and may also provide a useful constraint for modelling deep convection in ocean GCMs. We plot the global distribution of OCAPE using data from the World Ocean Atlas 2009 (WOA09) and see many important features. These include large values of OCAPE in the Labrador, Greenland, Weddell and Mediterranean Seas, which are consistent with our present observations and understanding, but also identify some new features like the OCAPE pattern in the Antarctic Circumpolar Current (ACC). We propose that the diagnosis of OCAPE can improve our understanding of global patterns of ocean convection and deep water formation as well as ocean stratification, the meridional overturning circulation and mixed layer processes. The background of this work is briefly introduced as below. Open-ocean deep convection can significantly modify water properties both at the ocean surface and throughout the water column (Gordon 1982). Open-ocean convection is also an important mechanism for Ocean Deep Water formation and the transport of heat, freshwater and nutrient (Marshall and Schott 1999). Open-ocean convection may arise through strong surface buoyancy fluxes (Schott et al. 1996), or by thermobaric instability (Akitomo 1999a, b). Ingersoll (2005) demonstrated that thermobaric-induced deep convection is due to the abrupt release of ocean potential energy into kinetic energy. In atmospheric dynamics, Convective Available Potential Energy (CAPE) has long been an important thermodynamic variable (Arakawa and Schubert 1974) that has been used to forecast moist convection (Doswell and Rasmussen 1994) and to test the performance of GCMs (Ye et al. 1998). However, the development of a similar diagnostic in the ocean has received little attention.; World Ocean Convective Available Potential Energy distribution in North-Hemisphere Autumn (J/kg)

  11. Non-contacting transfer of elastic energy into explosive simulants for dynamic property estimation

    SciTech Connect

    Greeney, Nathan S.; Strovink, Kurt M.; Scales, John A.; Jessop, Andrew M.; Stuart Bolton, J.; Watson, Christopher C.; Adams, Douglas E.

    2014-05-21

    Non-contacting acoustical methods can be used to extract various material properties of liquid or solid samples without disturbing the sample. These methods are useful even in the lab since they do not involve coupling anything to the sample, which might change its properties. A forteriori, when dealing with potentially dangerous materials, non-contacting methods may be the only safe solutions to mechanical characterization. Here, we show examples of using laser ultrasound to remotely insonify and monitor the elastic properties of several granular explosive simulants. The relatively short near-infrared laser pulse length (a few hundred nanoseconds) provides a broad-band thermoelastic source of ultrasound; we intentionally stay in the thermoelastic regime to avoid damaging the material. Then, we use a scanning laser Doppler vibrometer to measure the ultrasonic response of the sample. LDV technology is well established and very sensitive at ultrasonic frequencies; atomic level motions can be measured with modest averaging. The resulting impulse response of the explosive simulant can be analyzed to determine decay rates and wave speeds, with stiffer samples showing faster wave speeds and lower decay rates. On the other hand, at the low-frequency end of the acoustic spectrum, we use an electronically phased array to couple into a freely suspended sample's normal modes. This allows us to gently heat up the sample (3 °C in just under 5 min, as shown with a thermal IR camera). In addition to the practical interest in making the sample more chemically visible through heat, these two measurements (low-frequency resonant excitation vs high-frequency wave propagation) bracket the frequency range of acoustic non-destructive evaluation methods available.

  12. Non-contacting transfer of elastic energy into explosive simulants for dynamic property estimation

    NASA Astrophysics Data System (ADS)

    Greeney, Nathan S.; Strovink, Kurt M.; Scales, John A.; Jessop, Andrew M.; Stuart Bolton, J.; Watson, Christopher C.; Adams, Douglas E.

    2014-05-01

    Non-contacting acoustical methods can be used to extract various material properties of liquid or solid samples without disturbing the sample. These methods are useful even in the lab since they do not involve coupling anything to the sample, which might change its properties. A forteriori, when dealing with potentially dangerous materials, non-contacting methods may be the only safe solutions to mechanical characterization. Here, we show examples of using laser ultrasound to remotely insonify and monitor the elastic properties of several granular explosive simulants. The relatively short near-infrared laser pulse length (a few hundred nanoseconds) provides a broad-band thermoelastic source of ultrasound; we intentionally stay in the thermoelastic regime to avoid damaging the material. Then, we use a scanning laser Doppler vibrometer to measure the ultrasonic response of the sample. LDV technology is well established and very sensitive at ultrasonic frequencies; atomic level motions can be measured with modest averaging. The resulting impulse response of the explosive simulant can be analyzed to determine decay rates and wave speeds, with stiffer samples showing faster wave speeds and lower decay rates. On the other hand, at the low-frequency end of the acoustic spectrum, we use an electronically phased array to couple into a freely suspended sample's normal modes. This allows us to gently heat up the sample (3 °C in just under 5 min, as shown with a thermal IR camera). In addition to the practical interest in making the sample more chemically visible through heat, these two measurements (low-frequency resonant excitation vs high-frequency wave propagation) bracket the frequency range of acoustic non-destructive evaluation methods available.

  13. The Wind Energy Potential of Iceland

    NASA Astrophysics Data System (ADS)

    Nawri, Nikolai; Nína Petersen, Guðrún; Bjornsson, Halldór; Hahmann, Andrea N.; Jónasson, Kristján; Bay Hasager, Charlotte; Clausen, Niels-Erik

    2014-05-01

    While Iceland has an abundant wind energy resource, its use for electrical power production has so far been limited. Electricity in Iceland is generated primarily from hydro- and geothermal sources, and adding wind energy has so far not been considered practical or even necessary. However, wind energy is becoming a more viable option, as opportunities for new hydro- or geothermal power installations become limited. In order to obtain an estimate of the wind energy potential of Iceland, a wind atlas has been developed as part of the joint Nordic project 'Improved Forecast of Wind, Waves and Icing' (IceWind). Downscaling simulations performed with the Weather Research and Forecasting (WRF) model were used to determine the large-scale wind energy potential of Iceland. Local wind speed distributions are represented by Weibull statistics. The shape parameter across Iceland varies between 1.2 and 3.6, with the lowest values indicative of near-exponential distributions at sheltered locations, and the highest values indicative of normal distributions at exposed locations in winter. Compared with summer, average power density in winter is increased throughout Iceland by a factor of 2.0 - 5.5. In any season, there are also considerable spatial differences in average wind power density. Relative to the average value within 10 km of the coast, power density across Iceland varies between 50 - 250%, excluding glaciers, or between 300 - 1500 W m-2 at 50 m above ground level in winter. At intermediate elevations of 500 - 1000 m above mean sea level, power density is independent of the distance to the coast. In addition to seasonal and spatial variability, differences in average wind speed and power density also exist for different wind directions. Along the coast in winter, power density of onshore winds is higher by 100 - 700 W m-2 than that of offshore winds. The regions with the highest average wind speeds are impractical for wind farms, due to the distances from road infrastructure and the power grid, as well as due to the harsh winter climate. However, even in easily accessible regions, wind energy potential in Iceland, as measured by annual average power density, is among the highest in Western Europe. Based on these results, 14 test sites were selected for more detailed analyses using the Wind Atlas Analysis and Application Program (WAsP). These calculations show that a modest wind farm of ten medium size turbines would produce more energy throughout the year than a small hydro power plant, making wind energy a viable additional option.

  14. Potential energy surfaces of Polonium isotopes

    NASA Astrophysics Data System (ADS)

    Nerlo-Pomorska, B.; Pomorski, K.; Schmitt, C.; Bartel, J.

    2015-11-01

    The evolution of the potential energy landscape is analysed in detail for ten even-even polonium isotopes in the mass range 188\\lt A\\lt 220 as obtained within the macroscopic-microscopic approach, relying on the Lublin-Strasbourg drop model and the Yukawa-folded single-particle energies for calculating the microscopic shell and pairing corrections. A variant of the modified Funny-Hills nuclear shape parametrization is used to efficiently map possible fission paths. The approach explains the main features of the fragment partition as measured in low-energy fission along the polonium chain. The latter lies in a transitional region of the nuclear chart, and will be essential to consistently understand the evolution of fission properties from neutron-deficient mercury to heavy actinides. The ability of our method to predict fission observables over such an extended region looks promising.

  15. Elastic scattering of {sup 16}O+{sup 16}O at energies E/A between 5 and 8 MeV

    SciTech Connect

    Nicoli, M. P.; Haas, F.; Freeman, R. M.; Aissaoui, N.; Beck, C.; Elanique, A.; Nouicer, R.; Morsad, A.; Szilner, S.; Basrak, Z.

    1999-12-01

    The elastic scattering of {sup 16}O+{sup 16}O has been measured at nine energies between E{sub lab}=75 and 124 MeV. The data cover up to 100 degree sign in the c.m. and can be described in terms of phenomenological and folding model potentials which reproduce the main features observed. In agreement with studies at higher energies in this and similar systems, refractive effects are present in the angular distributions at all energies. In particular, the passage of Airy minima through 90 degree sign at E{sub c.m.}=40, 47.5, and 62 MeV explains the deep minima observed in the excitation function. The real part of the optical potential is found to vary very little with energy over the studied interval, but the imaginary part shows a rapid change in its shape at incident energy about 90 MeV. Nonetheless, the energy dependence of the volume integral of the real and imaginary parts is in agreement with dispersion relation predictions. (c) 1999 The American Physical Society.

  16. The Effect of VMoS3 Point Defect on the Elastic Properties of Monolayer MoS2 with REBO Potentials

    NASA Astrophysics Data System (ADS)

    Li, Minglin; Wan, Yaling; Tu, Liping; Yang, Yingchao; Lou, Jun

    2016-03-01

    Structural defects in monolayer molybdenum disulfide (MoS2) have significant influence on the electric, optical, thermal, chemical, and mechanical properties of the material. Among all the types of structural defects of the chemical vapor phase-grown monolayer MoS2, the VMoS3 point defect (a vacancy complex of Mo and three nearby S atoms) is another type of defect preferentially generated by the extended electron irradiation. Here, using the classical molecular dynamics simulation with reactive empirical bond-order (REBO) potential, we first investigate the effect of VMoS3 point defects on the elastic properties of monolayer MoS2 sheets. Under the constrained uniaxial tensile test, the elastic properties of monolayer MoS2 sheets containing VMoS3 vacancies with defect fraction varying from 0.01 to 0.1 are obtained based on the plane anisotropic constitutive relations of the material. It is found that the increase of VMoS3 vacancy concentration leads to the noticeable decrease in the elastic modulus but has a slight effect on Poisson's ratio. The maximum decrease of the elastic modulus is up to 25 %. Increasing the ambient temperature from 10 K to 500 K has trivial influences on the elastic modulus and Poisson's ratio for the monolayer MoS2 without defect and with 5 % VMoS3 vacancies. However, an anomalous parabolic relationship between the elastic modulus and the temperature is found in the monolayer MoS2 containing 0.1 % VMoS3 vacancy, bringing a crucial and fundamental issue to the application of monolayer MoS2 with defects.

  17. The Effect of VMoS3 Point Defect on the Elastic Properties of Monolayer MoS2 with REBO Potentials.

    PubMed

    Li, Minglin; Wan, Yaling; Tu, Liping; Yang, Yingchao; Lou, Jun

    2016-12-01

    Structural defects in monolayer molybdenum disulfide (MoS2) have significant influence on the electric, optical, thermal, chemical, and mechanical properties of the material. Among all the types of structural defects of the chemical vapor phase-grown monolayer MoS2, the VMoS3 point defect (a vacancy complex of Mo and three nearby S atoms) is another type of defect preferentially generated by the extended electron irradiation. Here, using the classical molecular dynamics simulation with reactive empirical bond-order (REBO) potential, we first investigate the effect of VMoS3 point defects on the elastic properties of monolayer MoS2 sheets. Under the constrained uniaxial tensile test, the elastic properties of monolayer MoS2 sheets containing VMoS3 vacancies with defect fraction varying from 0.01 to 0.1 are obtained based on the plane anisotropic constitutive relations of the material. It is found that the increase of VMoS3 vacancy concentration leads to the noticeable decrease in the elastic modulus but has a slight effect on Poisson's ratio. The maximum decrease of the elastic modulus is up to 25 %. Increasing the ambient temperature from 10 K to 500 K has trivial influences on the elastic modulus and Poisson's ratio for the monolayer MoS2 without defect and with 5 % VMoS3 vacancies. However, an anomalous parabolic relationship between the elastic modulus and the temperature is found in the monolayer MoS2 containing 0.1 % VMoS3 vacancy, bringing a crucial and fundamental issue to the application of monolayer MoS2 with defects. PMID:27000023

  18. Synergy of elastic and inelastic energy loss on ion track formation in SrTiO3

    PubMed Central

    Weber, William J.; Zarkadoula, Eva; Pakarinen, Olli H.; Sachan, Ritesh; Chisholm, Matthew F.; Liu, Peng; Xue, Haizhou; Jin, Ke; Zhang, Yanwen

    2015-01-01

    While the interaction of energetic ions with solids is well known to result in inelastic energy loss to electrons and elastic energy loss to atomic nuclei in the solid, the coupled effects of these energy losses on defect production, nanostructure evolution and phase transformations in ionic and covalently bonded materials are complex and not well understood due to dependencies on electron-electron scattering processes, electron-phonon coupling, localized electronic excitations, diffusivity of charged defects, and solid-state radiolysis. Here we show that a colossal synergy occurs between inelastic energy loss and pre-existing atomic defects created by elastic energy loss in single crystal strontium titanate (SrTiO3), resulting in the formation of nanometer-sized amorphous tracks, but only in the narrow region with pre-existing defects. These defects locally decrease the electronic and atomic thermal conductivities and increase electron-phonon coupling, which locally increase the intensity of the thermal spike for each ion. This work identifies a major gap in understanding on the role of defects in electronic energy dissipation and electron-phonon coupling; it also provides insights for creating novel interfaces and nanostructures to functionalize thin film structures, including tunable electronic, ionic, magnetic and optical properties. PMID:25578009

  19. Elastic internal flywheel gimbal

    SciTech Connect

    Rabenhorst, D.W.

    1981-01-13

    An elastic joint mounting and rotatably coupling a rotary inertial energy storage device or flywheel, to a shaft, the present gimbal structure reduces vibration and shock while allowing precession of the flywheel without the need for external gimbal mounts. The present elastic joint usually takes the form of an annular elastic member either integrally formed into the flywheel as a centermost segment thereof or attached to the flywheel or flywheel hub member at the center thereof, the rotary shaft then being mounted centrally to the elastic member.

  20. N3LO Chiral Predictions for Spin Observables in Nucleon-Deuteron Elastic Scattering at Low Energies

    NASA Astrophysics Data System (ADS)

    Skibiński, R.; Golak, J.; Topolnicki, K.; Witała, H.

    2016-02-01

    The chiral next-to-next-to-next-to leading order nuclear forces1‑3 are used to obtain predictions for spin observables in elastic nucleon-deuteron scattering at E=13 MeV. The three-nucleon force is taken into account with all its complexity, including the short-range part and relativistic corrections. Presented examples of the polarization observables for elastic nucleon-deuteron scattering show visible contributions from these new structures in the three-nucleon potential which emerge for the first time at the next-to-next-to-next-to leading order. However, our results suggest that some modifications of the currently used model of the nuclear forces are necessary.

  1. A method for using neutron elastic scatter to create a variable energy neutron beam from a nearly monoenergetic neutron source

    NASA Astrophysics Data System (ADS)

    Whetstone, Z. D.; Kearfott, K. J.

    2015-07-01

    This work describes preliminary investigation into the design of a compact, portable, variable energy neutron source. The proposed method uses elastic neutron scatter at specific angles to reduce the energy of deuterium-deuterium or deuterium-tritium (D-T) neutrons. The research focuses on D-T Monte Carlo simulations, both in idealized and more realistic scenarios. Systematic uncertainty of the method is also analyzed. The research showed promise, but highlighted the need for discrimination of multiply-scattered neutrons, either through a pulsed generator or associated particle imaging.

  2. Relativistic and close-coupling effects in the spin polarization of low-energy electrons scattered elastically from cadmium.

    PubMed

    Bostock, Christopher J; Berrington, Michael J; Fursa, Dmitry V; Bray, Igor

    2011-08-26

    The measurements of the Sherman function in elastic electron-cadmium scattering by Bartsch et al. [J. Phys. B 25, 1511 (1992)] have been in serious disagreement with scattering theories for nearly two decades. The recently developed relativistic convergent close-coupling method is applied to the problem and found to be in excellent agreement with experiment over the complete energy range measured. The unusually rapid variation in the spin asymmetry parameter in the vicinity of 4 eV projectile energy is now explained in terms of unitarity of the close-coupling formalism. PMID:21929240

  3. Absolute elastic differential electron scattering cross sections in the intermediate energy region. III - SF6 and UF6

    NASA Technical Reports Server (NTRS)

    Srivastava, S. K.; Trajmar, S.; Chutjian, A.; Williams, W.

    1976-01-01

    A recently developed technique has been used to measure the ratios of elastic differential electron scattering cross sections (DCS) for SF6 and UF6 to those of He at electron impact energies of 5, 10, 15, 20, 30, 40, 50, 60, and 75 eV and at scattering angles of 20 to 135 deg. In order to obtain the absolute values of DCS from these ratios, He DCS of McConkey and Preston have been employed in the 20 to 90 deg range. At angles in the 90 to 135 deg range the recently determined cross sections of Srivastava and Trajmar have been utilized. From these DCS, elastic integral and momentum transfer cross sections have been obtained.

  4. Computed potential energy surfaces for chemical reactions

    NASA Technical Reports Server (NTRS)

    Walch, Stephen P.; Levin, Eugene

    1993-01-01

    A new global potential energy surface (PES) is being generated for O(P-3) + H2 yields OH + H. This surface is being fit using the rotated Morse oscillator method, which was used to fit the previous POL-CI surface. The new surface is expected to be more accurate and also includes a much more complete sampling of bent geometries. A new study has been undertaken of the reaction N + O2 yields NO + O. The new studies have focused on the region of the surface near a possible minimum corresponding to the peroxy form of NOO. A large portion of the PES for this second reaction has been mapped out. Since state to state cross sections for the reaction are important in the chemistry of high temperature air, these studies will probably be extended to permit generation of a new global potential for reaction.

  5. California's biomass and its energy potential

    SciTech Connect

    Lucarelli, F.B. Jr.

    1980-04-01

    The potentials for using California's biomass for energy have been assessed. The study relies on the recent work of Amory Lovins and Lawrence Berkeley Laboratory's (LBL) Distributed Energy System's Project to specify an energy future for Californians. These works identify transportation fuels as the most valuable energy conversion for biomass. Within this context, the extent of five categories of terrestial biomass is estimated, in addition to the environmental impacts and monetary cost of collecting and transporting each biomass category. Estimates of the costs of transforming biomass into different fuels as well as a survey of government's role in a biomass energy program are presented. The major findings are summarized below. (1) California's existing biomass resources are sufficient to provide only 20 percent of its future liquid fuel requirements. (2) Meeting the full transportation demand with biomass derived fuels will require the development of exotic biomass sources such as kelp farms and significant reductions in automobile travel in the State. (3) Under assumptions of moderate increases in gasoline prices and without major new government incentives, the cost of transforming biomass into transport fuels will be competitive with the price of gasoline on a Btu basis by the year 1990. (4) The environmental impacts of collecting most forms of biomass are beneficial and should reduce air pollution from agricultural burning and water pollution from feedlot and dairy farm runoff. Moreover, the collection of logging residues should improve timber stand productivity and the harvest of chaparral should reduce the risk of wildfire in the State. (5) The institutional context for implementing biomass energy projects is complex and fragmented.

  6. Theoretical studies of potential energy surfaces

    SciTech Connect

    Harding, L.B.

    1993-12-01

    The goal of this program is to calculate accurate potential energy surfaces (PES) for both reactive and nonreactive systems. To do this the electronic Schrodinger equation must be solved. Our approach to this problem starts with multiconfiguration self-consistent field (MCSCF) reference wavefunctions. These reference wavefunctions are designed to be sufficiently flexible to accurately describe changes in electronic structure over a broad range of geometries. Electron correlation effects are included via multireference, singles and doubles configuration interaction (MRSDCI) calculations. With this approach, the authors are able to provide useful predictions of the energetics for a broad range of systems.

  7. Nucleon scattering from very light nuclei: Intermediate energy expansions for transition potentials and breakup processes

    SciTech Connect

    Elster, C.; Gloeckle, W.

    1997-03-01

    Transition potentials for elastic p-d scattering and the coupled processes p+{sup 3}He {r_arrow} p+{sup 3}He and n+{sup 3}He {r_arrow} d+d are derived in the Faddeev-Yakubovsky framework with special emphasis on leading order terms, which are expected to be valid at intermediate energies. In addition, equations for the fragmentations {sup 3}He(p,ppp)n and {sup 3}He(p,pp)d are derived within the same framework. Again leading order terms for intermediate energies are considered. {copyright} {ital 1997} {ital The American Physical Society}

  8. Potential energy surfaces of superheavy nuclei

    SciTech Connect

    Bender, M.; Rutz, K.; Maruhn, J.A.; Greiner, W.; Reinhard, P.-G. Rutz, K.; Maruhn, J.A.; Greiner, W.

    1998-10-01

    We investigate the structure of the potential energy surfaces of the superheavy nuclei {sub 158}{sup 258}Fm{sub 100}, {sub 156}{sup 264}Hs{sub 108}, {sub 166}{sup 278}112, {sub 184}{sup 298}114, and {sub 172}{sup 292}120 within the framework of self-consistent nuclear models, i.e., the Skyrme-Hartree-Fock approach and the relativistic mean-field model. We compare results obtained with one representative parametrization of each model which is successful in describing superheavy nuclei. We find systematic changes as compared to the potential energy surfaces of heavy nuclei in the uranium region: there is no sufficiently stable fission isomer any more, the importance of triaxial configurations to lower the first barrier fades away, and asymmetric fission paths compete down to rather small deformation. Comparing the two models, it turns out that the relativistic mean-field model gives generally smaller fission barriers. {copyright} {ital 1998} {ital The American Physical Society}

  9. Energy potential of sugarcane and sweet sorghum

    SciTech Connect

    Elawad, S.H.; Gascho, G.J.; Shih, S.F.

    1980-01-01

    The potential of sugarcane and sweet sorghum as raw materials for the production of ethanol and petrochemical substitutes is discussed. Both crops belong to the grass family and are classified as C/sub 4/ malateformers which have the highest rate of photosynthesis among terrestrial plants. Large amounts of biomass are required to supply a significant fraction of US energy consumption. Biomass production could be substantially increased by including tops and leaves, adopting narrow row spacing and improving cultural practices. This presents challenges for cultivating, harvesting, and hauling the biomass to processing centers. Large plants and heavy capital investment are essential for energy production. Ethanol and ammonia are the most promising candidates of a biomass program. If sugarcane were to be used for biomass production, breeding programs should be directed for more fermentable sugars and fiber. Energy research on sweet sorghum should be done with syrup varieties. Sweet sorghum needs to be incorporated with other crops because of its short growing season. The disposal of stillage from an extensive ethanol industry may pose environmental problems.

  10. Coulomb suppression in the low-energy p-p elastic scattering via the Trojan Horse Method

    SciTech Connect

    Tumino, A.; Spitaleri, C.; Rapisarda, G. G.; Cherubini, S.; Crucilla, V.; Gulino, M.; La Cognata, M.; Lamia, L.; Pizzone, R. G.; Puglia, S. M. R.; Romano, S.; Sergi, M. L.; Mukhamedzhanov, A.; Campajola, L.; Elekes, Z.; Fueloep, Zs.; Gyuerky, G.; Kiss, G. G.; Somorjai, E.; Gialanella, L.

    2010-11-24

    We present here an important test of the main feature of the Trojan Horse Method (THM), namely the suppression of Coulomb effects in the entrance channel due to off-energy-shell effects. This is done by measuring the THM p-p elastic scattering via the p+d{yields}p+p+n reaction at 4.7 and 5 MeV, corresponding to a p-p relative energy ranging from 80 to 670 keV. In contrast to the on-energy-shell (OES) case, the extracted p-p cross section does not exhibit the Coulomb-nuclear interference minimum due to the suppression of the Coulomb amplitude. This is confirmed by the half-off-energy shell (HOES) calculations and strengthened by the agreement with the calculated OES nuclear cross sections.

  11. Certification and the potential energy landscape

    SciTech Connect

    Mehta, Dhagash; Hauenstein, Jonathan D.; Wales, David J.

    2014-06-14

    Typically, there is no guarantee that a numerical approximation obtained using standard nonlinear equation solvers is indeed an actual solution, meaning that it lies in the quadratic convergence basin. Instead, it may lie only in the linear convergence basin, or even in a chaotic region, and hence not converge to the corresponding stationary point when further optimization is attempted. In some cases, these non-solutions could be misleading. Proving that a numerical approximation will quadratically converge to a stationary point is termed certification. In this report, we provide details of how Smale's α-theory can be used to certify numerically obtained stationary points of a potential energy landscape, providing a mathematical proof that the numerical approximation does indeed correspond to an actual stationary point, independent of the precision employed.

  12. Lunar ion energy spectra and surface potential

    NASA Technical Reports Server (NTRS)

    Manka, R. H.; Michel, F. C.

    1973-01-01

    The acceleration model for lunar ions and the resulting ionosphere dynamics are reviewed briefly. An application is made to lunar atmosphere trapped in the surface fines, and the enhancement in the Ar-40/Ar-36 ratio in samples from the Apennine Front compared to the adjacent mare is calculated to be about 2.0. The predicted lunar ion energy spectra is shown and found to agree well with Suprathermal Ion Detector measurements; from this spectra, the neutral atmosphere scale height can be studied and the neutral atmosphere number density is found to be 100,000 to 300,000 per cu cm at the sunrise and sunset terminators. The lunar surface potential is calculated and is found to be several volts positive over much of the sunlit face of the moon but to go tens of volts negative at the terminator.

  13. Low energy positron interactions with uracil--total scattering, positronium formation, and differential elastic scattering cross sections.

    PubMed

    Anderson, E K; Boadle, R A; Machacek, J R; Chiari, L; Makochekanwa, C; Buckman, S J; Brunger, M J; Garcia, G; Blanco, F; Ingolfsson, O; Sullivan, J P

    2014-07-21

    Measurements of the grand total and total positronium formation cross sections for positron scattering from uracil have been performed for energies between 1 and 180 eV, using a trap-based beam apparatus. Angular, quasi-elastic differential cross section measurements at 1, 3, 5, 10, and 20 eV are also presented and discussed. These measurements are compared to existing experimental results and theoretical calculations, including our own calculations using a variant of the independent atom approach. PMID:25053319

  14. Molecular Multipole Potential Energy Functions for Water.

    PubMed

    Tan, Ming-Liang; Tran, Kelly N; Pickard, Frank C; Simmonett, Andrew C; Brooks, Bernard R; Ichiye, Toshiko

    2016-03-01

    Water is the most common liquid on this planet, with many unique properties that make it essential for life as we know it. These properties must arise from features in the charge distribution of a water molecule, so it is essential to capture these features in potential energy functions for water to reproduce its liquid state properties in computer simulations. Recently, models that utilize a multipole expansion located on a single site in the water molecule, or "molecular multipole models", have been shown to rival and even surpass site models with up to five sites in reproducing both the electrostatic potential around a molecule and a variety of liquid state properties in simulations. However, despite decades of work using multipoles, confusion still remains about how to truncate the multipole expansions efficiently and accurately. This is particularly important when using molecular multipole expansions to describe water molecules in the liquid state, where the short-range interactions must be accurate, because the higher order multipoles of a water molecule are large. Here, truncation schemes designed for a recent efficient algorithm for multipoles in molecular dynamics simulations are assessed for how well they reproduce results for a simple three-site model of water when the multipole moments and Lennard-Jones parameters of that model are used. In addition, the multipole analysis indicates that site models that do not account for out-of-plane electron density overestimate the stability of a non-hydrogen-bonded conformation, leading to serious consequences for the simulated liquid. PMID:26562223

  15. Energy Functionals from Low-Momentum Potentials

    NASA Astrophysics Data System (ADS)

    Bogner, S. K.

    2006-04-01

    The nonperturbative nature of conventional inter-nucleon interactions is strongly scale or resolution dependent, and can be radically modified by using the renormalization group to lower the momentum cutoff of the two-nucleon potential. Recent calculations demonstrate that using low-momentum potentials (``Vlow k'') with consistent three-body forces leads to saturating nuclear matter at the Hartree-Fock level, with rapidly converging perturbative corrections in the particle-particle channel ^a. With these interactions, the density matrix expansion (DME) becomes a natural tool for the microscopic construction of a universal energy functional for nuclei ^b. By varying the cutoff, the resolution dependence of the functional can be studied. The use of sharp momentum cutoffs in Vlow k complicates the application of the DME in coordinate space. This problem is resolved with the recent generalization of Vlow k to smooth cutoff regulators. ^aS. K. Bogner, A. Schwenk, R. J. Furnstahl and A. Nogga, Nucl. Phys. A 763, 59 (2005). ^bJ. W. Negele and D. Vautherin, Phys. Rev. C 5, 1472 (1972).

  16. Energy resource potential of natural gas hydrates

    USGS Publications Warehouse

    Collett, T.S.

    2002-01-01

    The discovery of large gas hydrate accumulations in terrestrial permafrost regions of the Arctic and beneath the sea along the outer continental margins of the world's oceans has heightened interest in gas hydrates as a possible energy resource. However, significant to potentially insurmountable technical issues must be resolved before gas hydrates can be considered a viable option for affordable supplies of natural gas. The combined information from Arctic gas hydrate studies shows that, in permafrost regions, gas hydrates may exist at subsurface depths ranging from about 130 to 2000 m. The presence of gas hydrates in offshore continental margins has been inferred mainly from anomalous seismic reflectors, known as bottom-simulating reflectors, that have been mapped at depths below the sea floor ranging from about 100 to 1100 m. Current estimates of the amount of gas in the world's marine and permafrost gas hydrate accumulations are in rough accord at about 20,000 trillion m3. Disagreements over fundamental issues such as the volume of gas stored within delineated gas hydrate accumulations and the concentration of gas hydrates within hydrate-bearing strata have demonstrated that we know little about gas hydrates. Recently, however, several countries, including Japan, India, and the United States, have launched ambitious national projects to further examine the resource potential of gas hydrates. These projects may help answer key questions dealing with the properties of gas hydrate reservoirs, the design of production systems, and, most important, the costs and economics of gas hydrate production.

  17. Computed potential energy surfaces for chemical reactions

    NASA Technical Reports Server (NTRS)

    Walch, Stephen P.

    1988-01-01

    The minimum energy path for the addition of a hydrogen atom to N2 is characterized in CASSCF/CCI calculations using the (4s3p2d1f/3s2p1d) basis set, with additional single point calculations at the stationary points of the potential energy surface using the (5s4p3d2f/4s3p2d) basis set. These calculations represent the most extensive set of ab initio calculations completed to date, yielding a zero point corrected barrier for HN2 dissociation of approx. 8.5 kcal mol/1. The lifetime of the HN2 species is estimated from the calculated geometries and energetics using both conventional Transition State Theory and a method which utilizes an Eckart barrier to compute one dimensional quantum mechanical tunneling effects. It is concluded that the lifetime of the HN2 species is very short, greatly limiting its role in both termolecular recombination reactions and combustion processes.

  18. Momentum-space calculation of electron—CO elastic collision

    NASA Astrophysics Data System (ADS)

    Wang, Yuan-Cheng; Ma, Jia; Zhou, Ya-Jun

    2013-02-01

    We report a momentum-space study on low-energy electron-CO collisions. Elastic differential cross sections (DCS) are obtained using a static-exchange-optical (SEO) model for the incident energies of 2, 3, 5, and 10 eV. Polarization effect of higher reaction channels, including the ionization continuum, on the elastic collision is represented by an ab initio equivalent-local optical potential. The cross sections are compared with experimental measurements and other theoretical results.

  19. Low-energy electron elastic collision cross sections for ground and excited Tm, Lu and Hf atoms

    NASA Astrophysics Data System (ADS)

    Felfli, Z.; Msezane, A. Z.; Sokolovski, D.

    2011-05-01

    Low-energy 0 ⩽ E ⩽ 1.0 eV electron elastic scattering from ground and excited Tm, Lu and Hf atoms has been investigated. Both total and differential cross sections have been calculated; the latter at the scattering angles θ = 0°, 90° and 180°. The recent Regge-pole methodology has been used for the calculations. In the method the crucial electron-electron correlation effects are accounted for through the Mulholland formula. We find that the total cross sections are characterized generally by shape resonances, Ramsauer-Townsend minima and dramatically sharp long-lived resonances from which we extract the binding energies of the negative ions. Our extracted binding energy of the Hf - negative ion from the total cross section is compared with that of Pan and Beck [14].

  20. Elastic and Inelastic Scattering of Low Energy Nucleons from SILICON-28, SULFUR-32, SULFUR-34, and Calcium -40.

    NASA Astrophysics Data System (ADS)

    Alarcon, Ricardo

    1985-12-01

    Differential cross sections for the elastic and inelastic scattering of neutrons from the s-d shell nuclei ('28)Si, ('32)S, ('34)S and ('40)Ca have been measured in the 19-26 MeV region. For ('28)Si and ('32)S the measurements were done at 21.7 MeV. For ('34)S the neutron measurements were done at 21.7 and 25.5 MeV. Also data for the elastic and inelastic scattering of protons from ('34)S were measured at 29.8 MeV. For ('40)Ca the neutron measurements were done at 19.0, 21.7 and 25.5 MeV. The present data for ('28)Si and ('32)S were analyzed in terms of rotation-vibration and anharmonic vibration collective models respectively. Isoscalar E2, E3 and E4 transition matrix elements were obtained from the normalized multipole moments of the real potential and the results were compared with those obtained from electromagnetic probes and from nuclear structure theoretical calculations. The present nucleon data for ('34)S were used in a consistent analysis to obtain values and relative signs for proton (M(,p)) and neutron (M(,n)) multipole matrix elements for E2 transitions to the first three 2('+) states in ('34)S. The present neutron data were also analyzed in terms of an anharmonic vibration collective model. The present neutron elastic data for ('40)Ca along with previous neutron measurements and additional proton elastic scattering data were analyzed using three different approaches to the optical model potential : Woods-Saxon parametrization, model independent analysis and microscopic. The difference between the phenomenological neutron and proton real potentials was studied in terms of Coulomb effects, nuclear polarization and charge symmetry breaking in the nuclear mean field. The present neutron inelastic data from ('40)Ca were studied in terms of a vibration collective model using both standard Woods-Saxon and model independent form factors.

  1. Calculation of Average Collision Cross Sections of Low Energy for Elastic e-Ar Scattering Using MERT4

    NASA Astrophysics Data System (ADS)

    Hassanpour, S.; Nguyen-Kuok, S.

    2015-01-01

    Cross sections in the very low energy range are also represented by the modified effective-range theory (MERT) for low-energy electron scattering from the rare gas (argon). Simulations using published (theoretical) phase shifts indicate that extended versions of the standard effective-range theory with four adjustable parameters are required to give an adequate description of the phase shifts for argon. A four-parameter MERT fit gives a good representation of a recent electron-argon (e-Ar) total cross section experiment at energies less than 10.0 eV. Cross section Q(l) (E) for collision in dilute gases is given for any order l. Here Q(l) (E) are presented for l = 1. . .6. We present calculations for the elastic cross sections for electron scattering from argon. The improvement in the agreement between our theoretical calculations and the experimental measurements in the case of argon in scattering calculations are showed. Differential scattering experiments have been performed for the systems e-Ar in the energy range E = 0-10 eV and the angular range θ = 0-20° using a crossed-beam arrangement. Differential and integrated cross sections for the elastic scattering of low- and intermediate-energy (0-50 eV) electrons by argon atoms are calculated. For each impact energy, the phase shifts of the lower partial waves are obtained exactly by numerical integration of the radial equation. Transport coefficients of argon plasma are requested exactly, which is why we calculated the average collision cross sections for s = 1. . .11, l = 1. . .6.

  2. The {sup 6}He Optical Potential at energies around the Coulomb barrier

    SciTech Connect

    Fernandez-Garcia, J. P.; Alvarez, M. A. G.; Moro, A. M.

    2010-04-26

    We present an Optical Model (OM) study of {sup 6}He on {sup 208}Pb elastic scattering data, measured at laboratory energies around the Coulomb barrier (E{sub lab} = 14, 16, 18, 22, and 27 MeV)[1]. For the projectile-target bare interaction, we use the microscopic Sao Paulo Potential (SPP). This bare interaction is supplemented with a Coulomb Dipole Polarization (CDP) potential, as well as a diffuse complex Woods-Saxon potential. Four-body Continuum-Discretized-Coupled-Channels (CDCC) calculations have been performed in order to support the optical model analysis. We have also studied the alpha channel, which is the dominant reaction process. In the analysis of this channel, we compare the angular and energy distributions of the alpha particles measured at 22 MeV, with Distorted Wave Born Approximation (DWBA) calculations.

  3. The 6He Optical Potential at energies around the Coulomb barrier

    NASA Astrophysics Data System (ADS)

    Fernández-García, J. P.; Rodríguez-Gallardo, M.; Alvarez, M. A. G.; Moro, A. M.

    2010-04-01

    We present an Optical Model (OM) study of 6He on 208Pb elastic scattering data, measured at laboratory energies around the Coulomb barrier (Elab = 14, 16, 18, 22, and 27 MeV) [1]. For the projectile-target bare interaction, we use the microscopic São Paulo Potential (SPP). This bare interaction is supplemented with a Coulomb Dipole Polarization (CDP) potential, as well as a diffuse complex Woods-Saxon potential. Four-body Continuum-Discretized-Coupled-Channels (CDCC) calculations have been performed in order to support the optical model analysis. We have also studied the α channel, which is the dominant reaction process. In the analysis of this channel, we compare the angular and energy distributions of the α particles measured at 22 MeV, with Distorted Wave Born Approximation (DWBA) calculations.

  4. Measurement of the elastic scattering /sup 12/C+/sup 28/Si at energies 56 MeV--69 MeV

    SciTech Connect

    SHEN Wen-qing; YIN Shu-zhi; GUO Zhong-yan; ZHU Yong-tai; CHEN Ju-shen; WU En-chiu; GUO Chi-di; FENG En-pu; XIE Yaun-xiang

    1985-07-01

    The angular distributions of the elastic scattering reaction /sup 12/C+/sup 28/Si have been measured at the energies 69.5 MeV, 66 MeV, 59 MeV, 56 MeV using a large area position sensitive ionization chamber. The experimental data are fitted in the framework of the optical model. The probable reasons of the oscillations and enhancement of the elastic scattering angular distributions are discussed.

  5. Energy dependence of the optical model potential for fast neutron scattering from cobalt

    NASA Astrophysics Data System (ADS)

    Smith, A. B.; Guenther, P. T.; Lawson, R. D.

    1988-06-01

    Differential elastic- and inelastic-scattering cross sections were measured from ˜ 1.5 to 10.0 MeV over the scattering-angle range ˜18° to 160°, with sufficient detail to define the energy-averaged behavior. Inelastic neutron groups were observed corresponding to measured excitation energies of: 1115 ± 29, 1212 ± 24, 1307 ± 24, 1503 ± 33, 1778 ± 40, 2112 ± 40, 2224 ± 35, 2423 ± 39, 2593 ± 41 and 2810 ± 67 keV. The experimental results were interpreted in terms of spherical-optical-statistical and coupled-channels models. A successful description of the differential elastic scattering below 10 MeV and the total cross section in the range 0-20 MeV was achieved using the spherical optical model with energy-dependent strengths and geometries. These energy dependencies are large below approximately 7.0 MeV, but become smaller and similar to those reported for "global" potentials at higher energies. This change in the energy dependence of the parameters, which occurs about 19 MeV above the Fermi energy, was also seen in the analysis of the 209Bi data and probably marks the onset of the Fermi surface anomaly. Inelastic scattering to the levels below 1.8 MeV displays a forward peaked behavior. This non-statistical component is interpreted using the weak coupling model in which the f{7}/{2} proton hole is coupled to the 2 + state in 60Ni. This vibrational characteristic provides an explanation of the unusual energy dependence and relatively small radius found for the imaginary optical model potential. In conjunction with the fact that cobalt is four neutrons away from the N = 28 closed shell, the coupling also provides an explanation for the large value of this potential. The real spherical optical-model potential derived from the neutron-scattering results was extrapolated to bound energies using the dispersion relationship and the method of moments. The resulting real-potential strength and radius peak at ˜ -10.0 MeV, whereas the real diffuseness is at a minimum at this energy. The extrapolated potential is ˜8% larger than that implied by reported particle-state energies, and ˜13% smaller than indicated by hole-state energies.

  6. Determination of Multidimensional Intermolecular Potential Energy Surfaces

    NASA Astrophysics Data System (ADS)

    Cohen, Ronald Carl

    High resolution spectroscopy of the low frequency van der Waals vibrations (also referred to as Vibration -Rotation-Tunneling (VRT) spectroscopy) in weakly bound complexes provides the means to probe intermolecular forces with unprecedented detail and precision. We present an overview of the experimental information on intermolecular forces and intermolecular dynamics which has been obtained by far infrared VRT spectroscopy of 18 complexes. We then turn to a detailed examination of the Ar-H_2O complex, a simple prototype for the study of intermolecular forces. The measurement and analysis of 9 VRT bands is described. These data are first used to obtain a qualitative description of the intermolecular potential energy surface (IPS). A new simple and efficient method for calculating the eigenvalues of the multidimensional intermolecular dynamics on the IPS has been developed. This algorithm (an adaptation of the Collocation Method) was then used in a direct fit to obtain an accurate and detailed description of the intermolecular forces acting within the Ar-H_2O complex.

  7. ASSESSMENT OF ENERGY RECOVERY POTENTIAL OF INDUSTRIAL COMBUSTION EQUIPMENT

    EPA Science Inventory

    An assessment was conducted to evaluate the waste heat content and energy recovery potential of flue gases from 30 industrial combustion devices. Pollution controls on nine of the devices were evaluated to estimate energy requirements and particulate reduction; energy requirement...

  8. Calcium Binding Restores Gel Formation of Succinylated Gelatin and Reduces Brittleness with Preservation of the Elastically Stored Energy.

    PubMed

    Baigts Allende, Diana; de Jongh, Harmen H J

    2015-08-12

    To better tailor gelatins for textural characteristics in (food) gels, their interactions are destabilized by introduction of electrostatic repulsions and creation of affinity sites for calcium to "lock" intermolecular interactions. For that purpose gelatins with various degrees of succinylation are obtained. Extensive succinylation hampers helix formation and gel strength is slightly reduced. At high degrees of succinylation the helix propensity, gelling/melting temperatures, concomitant transition enthalpy, and gel strength become calcium-sensitive, and relatively low calcium concentrations largely restore these properties. Although succinylation has a major impact on the brittleness of the gels formed and the addition of calcium makes the material less brittle compared to nonmodified gelatin, the modification has no impact on the energy balance in the gel, where all energy applied is elastically stored in the material. This is explained by the unaffected stress relaxation by the network and high water-holding capacity related to the small mesh sizes in the gels. PMID:26154824

  9. Absolute differential cross sections for the elastic scattering of electrons from atomic hydrogen at low incident energies

    NASA Astrophysics Data System (ADS)

    James, Kenneth; Leonard, Linda; Proctor, Stephanie; Childers, J. G.; Khakoo, Murtadha A.

    2003-05-01

    Absolute differential cross sections for electrons elastically scattered from atomic hydrogen have been measured at low incident energies. The measurements were facilitated by the moveable nozzle source recently developed in our lab. Data taken at the incident energies of 20 eV, 40 eV, and 100 eV, and spanning the angular range of 10^rc to 120^rc will be presented. The results will be compared to the earlier measurements of Williams(Joseph Callaway and J. F. Williams, Phys. Rev. A) 12, 2312 (1975), J. F. Williams, J. Phys. B 8, 2191 (1975) and Shyn(T. W. Shyn and S. Y. Cho, Phys. Rev. A) 40, 1315 (1989), T. W. Shyn and Alan Grafe, Phys. Rev. A 46, 2949 (1992), and the theoretical calculations of Bray(Igor Bray, Phys. Rev. A) 46, 6995 (1992). Funded by the National Science Foundation under Grant # NSF-RUI-PHY-0096808.

  10. Search for rapid angular and energy dependence of dsigma/d. cap omega. and iT/sub 11/ in large angle. pi. -d elastic scattering

    SciTech Connect

    Mathie, E.L.; Smith, G.R.; Boschitz, E.T.; Meyer, M.; Vogler, F.; Daum, M.; Mango, S.; Konter, J.A.

    1983-12-01

    The ..pi..-d elastic differential cross-section and the vector analyzing power have been measured between CTHETA/sub c.m./ = 95/sup 0/ and 165/sup 0/ at incident pion energies between 117 and 151 MeV. Both observables show a smooth behavior as a function of angle and energy.

  11. Mechanism of Resilin Elasticity

    PubMed Central

    Qin, Guokui; Hu, Xiao; Cebe, Peggy; Kaplan, David L.

    2012-01-01

    Resilin is critical in the flight and jumping systems of insects as a polymeric rubber-like protein with outstanding elasticity. However, insight into the underlying molecular mechanisms responsible for resilin elasticity remains undefined. Here we report the structure and function of resilin from Drosophila CG15920. A reversible beta-turn transition was identified in the peptide encoded by exon III and for full length resilin during energy input and release, features that correlate to the rapid deformation of resilin during functions in vivo. Micellar structures and nano-porous patterns formed after beta-turn structures were present via changes in either the thermal or mechanical inputs. A model is proposed to explain the super elasticity and energy conversion mechanisms of resilin, providing important insight into structure-function relationships for this protein. Further, this model offers a view of elastomeric proteins in general where beta-turn related structures serve as fundamental units of the structure and elasticity. PMID:22893127

  12. An Accurate Potential Energy Surface for Methane

    NASA Astrophysics Data System (ADS)

    Wang, Xiao-Gang; Carrington, Tucker, Jr.

    2013-06-01

    An accurate full dimensional methane potential energy surface (PES) will aid in assigning and understanding its complicated spectrum. Heretofore, there is no pure ab initio PES of methane on which rovibrational levels have errors less than one cm^{-1}. % In this work, we obtain an accurate methane PES by starting with the ab initio PES of Schwenke and Partridge [Spectrochim. Acta A {57}, 887 (2001)] and adjusting 5 of their parameters to reproduce 39 reliable vibrational levels of CH_4. This reduces the rmsd from 4.3 cm^{-1} to 0.4 cm^{-1}. %which include all vibrational levels up to the Octad polyad %and only 4 levels of the Tetradecad polyad Since not all of the Tetradecad levels are certain, only 4, those confirmed by direct experimental transitions, are included in the fit. The new PES ought therefore to aid in the ongoing analysis of the Tetradecad polyad. To further test the accuracy of the new PES, vibrational and rovibrational levels are computed for CH_4, CH_3D, CHD_3 and CH_2D_2 and are compared with the extensive experimental data. The errors are all within about one cm^{-1}. The fitting is made possible by a contracted-iterative method for computing vibrational levels in a product of contracted stretch and bend functions. The fitting process is efficient because these contracted basis functions are not changed during the fitting cycles, which greatly reduces the time (to about 3 hours) to compute a new set of vibrational levels when the PES is slightly changed. X.-G. Wang and T. Carrington, Jr., J. Chem. Phys. {119}, 101 (2003).

  13. Computer simulation study of a two-dimensional nematogenic lattice model based on a mapping from elastic free-energy density

    NASA Astrophysics Data System (ADS)

    Romano, S.

    2003-04-01

    Over the last few years, it has been recognized that on can construct, in different ways, a nematogenic lattice model with pairwise additive interactions, which approximately reproduce the elastic free energy density, and where the parameters defining the pair potential are expressed in terms of elastic constants. An anisotropic nematogenic pair interaction of this kind, originally proposed by Gruhn and Hess [Z. Naturforsch. A 51 (1996) 1] has been investigated by Monte Carlo simulation, for particle centers of mass associated with both a three- and a two-dimensional lattice. Another approximate procedure for the mapping had also been proposed, and studied by simulation on a three-dimensional lattice (Luckhurst and Romano [Liq. Cryst. 26 (1999) 871]) continuing along this line, we investigate here the 2-dimensional lattice counterpart, by means of Mean Field theory and Monte Carlo simulations. In 2 dimensions, the anisotropic character of these potential models does not preclude the existence of orientational order at finite temperature. The model produces a ground state where particles are aligned in the lattice plane; both Mean Field (MF) predictions and simulation results for the second-rank ordering tensor show a low-temperature régime where the system becomes biaxial, with the main director aligned along a lattice axis; at higher temperature there is a transition to uniaxial order with negative order parameter, and director orthogonal to the lattice plane; this orientational order survives up to temperatures higher than the transition temperature of the 3-dimensional counterpart, possibly at all finite temperatures. MF predictions and simulation results appear to agree qualitatively, but in quantitative terms the MF prediction for the transition temperature is some 56% too high.

  14. Vanishing rainbows near orbiting and the energy dependence of rainbow scattering - Relation to properties of the potential. [molecular beam scattering cross sections

    NASA Technical Reports Server (NTRS)

    Greene, E. F.; Hall, R. B.; Mason, E. A.

    1975-01-01

    The energy threshold behavior of elastic rainbow scattering near the transition to orbiting is derived. Analysis of the energy dependence of the rainbow angle shows that the full range from high energies down to orbiting can be fitted with two parameters. Thus, measurements of the rainbow angle can give essentially only two pieces of information about the potential. For potentials of common shapes, such measurements are sensitive to regions of the potential just beyond the minimum and give information about the shape of the potential in this range. However, neither a minimum nor a point of inflection in the potential is necessary for rainbow scattering.

  15. The interfascicular matrix enables fascicle sliding and recovery in tendon, and behaves more elastically in energy storing tendons

    PubMed Central

    Thorpe, Chavaunne T.; Godinho, Marta S.C.; Riley, Graham P.; Birch, Helen L.; Clegg, Peter D.; Screen, Hazel R.C.

    2015-01-01

    While the predominant function of all tendons is to transfer force from muscle to bone and position the limbs, some tendons additionally function as energy stores, reducing the cost of locomotion. Energy storing tendons experience extremely high strains and need to be able to recoil efficiently for maximum energy storage and return. In the equine forelimb, the energy storing superficial digital flexor tendon (SDFT) has much higher failure strains than the positional common digital extensor tendon (CDET). However, we have previously shown that this is not due to differences in the properties of the SDFT and CDET fascicles (the largest tendon subunits). Instead, there is a greater capacity for interfascicular sliding in the SDFT which facilitates the greater extensions in this particular tendon (Thorpe et al., 2012). In the current study, we exposed fascicles and interfascicular matrix (IFM) from the SDFT and CDET to cyclic loading followed by a test to failure. The results show that IFM mechanical behaviour is not a result of irreversible deformation, but the IFM is able to withstand cyclic loading, and is more elastic in the SDFT than in the CDET. We also assessed the effect of ageing on IFM properties, demonstrating that the IFM is less able to resist repetitive loading as it ages, becoming stiffer with increasing age in the SDFT. These results provide further indications that the IFM is important for efficient function in energy storing tendons, and age-related alterations to the IFM may compromise function and predispose older tendons to injury. PMID:25958330

  16. Rapid Hydrogel Microactuator Using Elastic Instability

    NASA Astrophysics Data System (ADS)

    Lee, Howon; Xia, Chunguang; Fang, Nicholas

    2009-03-01

    Rapid Hydrogel Microactuator Using Elastic Instability Inspired by rapid movement of sensitive plants such as Venus flytrap [1], we present an innovative way to enhance actuation speed of hydrogel micro devices by exploiting elastic instability. In this work, hydrogel micro devices in doubly curved shape are designed and fabricated using projection micro-stereolithography[2], with embedded microfluidic channels on the surface. Local swelling of hydrogel around channels causes bending which subsequently induces stretching of the soft structure. Such coupling gives rise to elastic instability, the onset of which triggers rapid conversion of stored elastic energy into kinetic energy in fast motion. We further designed a set of devices with different dimensions, which leads to different coupling of elastic energy in bending and stretching [1]. Our experimental results verified the critical coupling parameter that triggers snap-buckling motion. Ongoing experiments are investigating the actuation speed as a function of coupling parameter. This novel approach promises new potential applications for hydrogel based devices in various fields of study including microfluidics, soft robotics, artificial muscle, and drug delivery. Reference [1] Forterre, Y., et al, Nature, 433, 421-425 (2005) [2] Sun, C., et al, Sensors and Actuators A, 121:1, 113-120 (2005)

  17. Design guidance for elastic followup

    SciTech Connect

    Naugle, F.V.

    1983-01-01

    The basic mechanism of elastic followup is discussed in relation to piping design. It is shown how mechanistic insight gained from solutions for a two-bar problem can be used to identify dominant design parameters and to determine appropriate modifications where elastic followup is a potential problem. It is generally recognized that quantitative criteria are needed for elastic followup in the creep range where badly unbalanced lines can pose potential problems. Approaches for criteria development are discussed.

  18. Complex, energy-independent, local potential reproducing an absorptive phase shift and a bound state

    SciTech Connect

    Alt, E.O.; Howell, L.L.; Rauh, M.; Sofianos, S.A. Physics Department, University of South Africa, Pretoria )

    1994-01-01

    The triton binding energy, and the partly real and partly complex neutron-deuteron doublet channel elastic scattering phase shifts, calculated by means of the exact three-body theory, are used as input in the fixed-[ital l] inverse scattering theory of Marchenko. The local potentials obtained hereby are independent of energy, and complex. Their strong imaginary part reflects the strong absorption in the doublet channel arising from the opening of the deuteron breakup channel. For total orbital angular momentum [ital l] different from zero the potentials are unique, reproducing the input phase shift in the whole energy region. For [ital l]=0 where there exists, in addition, a bound state we construct a one-parameter class of complex local potentials which are phase--binding-energy equivalent; that is, each of its members reproduces, in addition to the partly complex phase shifts, the bound state with the physical, i.e., real binding energy. Correlations between the oscilliations in the radial independence of these equivalent potentials and physical properties of the input data are established.

  19. Elastic Barrier Dynamical Freezing in Free Energy Calculations: A Way To Speed Up Nonequilibrium Molecular Dynamics Simulations by Orders of Magnitude.

    PubMed

    Giovannelli, Edoardo; Cardini, Gianni; Chelli, Riccardo

    2016-03-01

    An important issue concerning computer simulations addressed to free energy estimates via nonequilibrium work theorems, such as the Jarzynski equality [ Phys. Rev. Lett. 1997 , 78 , 2690 ], is the computational effort required to achieve results with acceptable accuracy. In this respect, the dynamical freezing approach [ Phys. Rev. E 2009 , 80 , 041124 ] has been shown to improve the efficiency of this kind of simulations, by blocking the dynamics of particles located outside an established mobility region. In this report, we show that dynamical freezing produces a systematic spurious decrease of the particle density inside the mobility region. As a consequence, the requirements to apply nonequilibrium work theorems are only approximately met. Starting from these considerations, we have developed a simulation scheme, called "elastic barrier dynamical freezing", according to which a stiff potential-energy barrier is enforced at the boundaries of the mobility region, preventing the particles from leaving this region of space during the nonequilibrium trajectories. The method, tested on the calculation of the distance-dependent free energy of a dimer immersed into a Lennard-Jones fluid, provides an accuracy comparable to the conventional steered molecular dynamics, with a computational speedup exceeding a few orders of magnitude. PMID:26771534

  20. Effective potential for e-neon and e-argon scattering by DCS minimization at intermediate energies

    SciTech Connect

    Paikeday, J.M.; Longstreet, A.

    1998-11-01

    The differential scattering cross-section (DCS) for electrons scattered elastically by neon and argon atoms is studied using a model potential. In the present study the long-range polarization potential is represented by an energy-dependent function, and the short-range part is constructed from the nonrelativistic Hartree-Fock wave function of the target atom. The computed differential cross section obtained using the approximate effective interaction potential for electrons scattered by neon and argon atoms in their ground state is compared with available published results. In the present study the parameters contained in the energy-dependent effective potential are determined by the minimization of the DCS with respect to angle {theta} and the incident energy. The resulting DCS in the angular range 2{degree} < {theta} < 178{degree} is found to be in good agreement with the available experimental and theoretical results in the intermediate energy range.

  1. Effective potential for e-argon and e-krypton scattering by DCS and minimization at intermediate energies

    SciTech Connect

    Paikeday, J.M.

    1999-12-01

    The differential scattering cross section (DCS) for electrons scattered elastically by argon and krypton atoms is studied using a model potential. In the present study, the long-range polarization potential is represented by an energy-dependent function and the short-range part is constructed from the nonrelativistic Hartree-Fock wave function of the target atom. The computed differential cross section obtained using the approximate effective interaction potential for electrons scattered by neon and argon atoms in their ground state is compared with available published results. In the present study, the parameters contained in the energy-dependent effective potential are determined by the minimization of the DCS with respect to angle {theta} and the incident energy. The resulting DCS in the angular range 2{degree} {lt} {theta} {lt} 178{degree} is found to be in good agreement with the available experimental and theoretical results in the intermediate energy range.

  2. Full potential study of the elastic, electronic, and optical properties of spinels MgIn{sub 2}S{sub 4} and CdIn{sub 2}S{sub 4} under pressure effect

    SciTech Connect

    Semari, F.; Khenata, R.; Rabah, M.; Bouhemadou, A.; Bin Omran, S.; Reshak, Ali H.; Rached, D.

    2010-12-15

    The structural, elastic, electronic, and optical properties of cubic spinel MgIn{sub 2}S{sub 4} and CdIn{sub 2}S{sub 4} compounds have been calculated using a full relativistic version of the full-potential linearized-augmented plane wave with the mixed basis FP/APW+lo method. The exchange and correlation potential is treated by the generalized-gradient approximation (GGA). Moreover, the Engel-Vosko GGA formalism is also applied to optimize the corresponding potential for band structure calculations. The ground state properties, including the lattice constants, the internal parameter, the bulk modulus, and the pressure derivative of the bulk modulus are in reasonable agreement with the available data. Using the total energy-strain technique, we have determined the full set of first-order elastic constants C{sub ij} and their pressure dependence, which have not been calculated or measured yet. The shear modulus, Young's modulus, and Poisson's ratio are calculated for polycrystalline XIn{sub 2}S{sub 4} aggregates. The Debye temperature is estimated from the average sound velocity. Electronic band structures show a direct band gap ({Gamma}-{Gamma}) for MgIn{sub 2}S{sub 4} and an indirect band gap (K-{Gamma}) for CdIn{sub 2}S{sub 4}. The calculated band gaps with EVGGA show a significant improvement over the GGA. The optical constants, including the dielectric function {epsilon}({omega}), the refractive index n({omega}), the reflectivity R({omega}), and the energy loss function L({omega}) were calculated for radiation up to 30 eV. -- Graphical abstract: Calculated total and partial densities of states for MgIn{sub 2}S{sub 4} and CdIn{sub 2}S{sub 4}

  3. Light element analysis in steel by high energy heavy ion time of flight elastic recoil detection analysis

    NASA Astrophysics Data System (ADS)

    Hong, Wan; Hayakawa, Shinjiro; Maeda, Kuniko; Fukuda, Shigekazu; Gohshi, Yohichi

    1999-01-01

    Time of flight elastic recoil detection analysis (TOF-ERDA) using high-energy heavy ions has been applied to determining the composition of light elements in stainless-steel (SUS304) samples before and after welding in order to monitor the variation in the composition of light elements in sample surfaces during a welding process. An argon-welding method using a welding rod (SUS304) and an arc-welding method using a welding rod were used to prepare samples. Four samples, welded and non-welded using two welding methods, were measured. 40Ar ions accelerated to 40.3 MeV were used as a probe. Carbon, oxygen and sodium were measured. It was found that the oxygen distributions near to the surfaces of the welded samples increased compared with those of the non-welded samples. However, variations in the carbon distributions were relatively smaller than that of oxygen distributions.

  4. Magnetic inhomogeneity on a triangular lattice: the magnetic-exchange versus the elastic energy and the role of disorder.

    PubMed

    Zorko, A; Kokalj, J; Komelj, M; Adamopoulos, O; Luetkens, H; Arčon, D; Lappas, A

    2015-01-01

    Inhomogeneity in the ground state is an intriguing, emergent phenomenon in magnetism. Recently, it has been observed in the magnetostructural channel of the geometrically frustrated α-NaMnO2, for the first time in the absence of active charge degrees of freedom. Here we report an in-depth numerical and local-probe experimental study of the isostructural sister compound CuMnO2 that emphasizes and provides an explanation for the crucial differences between the two systems. The experimentally verified, much more homogeneous, ground state of the stoichiometric CuMnO2 is attributed to the reduced magnetoelastic competition between the counteracting magnetic-exchange and elastic-energy contributions. The comparison of the two systems additionally highlights the role of disorder and allows the understanding of the puzzling phenomenon of phase separation in uniform antiferromagnets. PMID:25786810

  5. Monte Carlo simulation and parameterized treatment on the effect of nuclear elastic scattering in high-energy proton radiography

    NASA Astrophysics Data System (ADS)

    Xu, Hai-Bo; Zheng, Na

    2015-07-01

    A version of Geant4 has been developed to treat high-energy proton radiography. This article presents the results of calculations simulating the effects of nuclear elastic scattering for various test step wedges. Comparisons with experimental data are also presented. The traditional expressions of the transmission should be correct if the angle distribution of the scattering is Gaussian multiple Coulomb scattering. The mean free path (which depends on the collimator angle) and the radiation length are treated as empirical parameters, according to transmission as a function of thickness obtained by simulations. The results can be used in density reconstruction, which depends on the transmission expressions. Supported by NSAF (11176001) and Science and Technology Developing Foundation of China Academy of Engineering Physics (2012A0202006)

  6. Magnetic inhomogeneity on a triangular lattice: the magnetic-exchange versus the elastic energy and the role of disorder

    PubMed Central

    Zorko, A.; Kokalj, J.; Komelj, M.; Adamopoulos, O.; Luetkens, H.; Ar?on, D.; Lappas, A.

    2015-01-01

    Inhomogeneity in the ground state is an intriguing, emergent phenomenon in magnetism. Recently, it has been observed in the magnetostructural channel of the geometrically frustrated ?-NaMnO2, for the first time in the absence of active charge degrees of freedom. Here we report an in-depth numerical and local-probe experimental study of the isostructural sister compound CuMnO2 that emphasizes and provides an explanation for the crucial differences between the two systems. The experimentally verified, much more homogeneous, ground state of the stoichiometric CuMnO2 is attributed to the reduced magnetoelastic competition between the counteracting magnetic-exchange and elastic-energy contributions. The comparison of the two systems additionally highlights the role of disorder and allows the understanding of the puzzling phenomenon of phase separation in uniform antiferromagnets. PMID:25786810

  7. Magnetic inhomogeneity on a triangular lattice: the magnetic-exchange versus the elastic energy and the role of disorder

    NASA Astrophysics Data System (ADS)

    Zorko, A.; Kokalj, J.; Komelj, M.; Adamopoulos, O.; Luetkens, H.; Arčon, D.; Lappas, A.

    2015-03-01

    Inhomogeneity in the ground state is an intriguing, emergent phenomenon in magnetism. Recently, it has been observed in the magnetostructural channel of the geometrically frustrated α-NaMnO2, for the first time in the absence of active charge degrees of freedom. Here we report an in-depth numerical and local-probe experimental study of the isostructural sister compound CuMnO2 that emphasizes and provides an explanation for the crucial differences between the two systems. The experimentally verified, much more homogeneous, ground state of the stoichiometric CuMnO2 is attributed to the reduced magnetoelastic competition between the counteracting magnetic-exchange and elastic-energy contributions. The comparison of the two systems additionally highlights the role of disorder and allows the understanding of the puzzling phenomenon of phase separation in uniform antiferromagnets.

  8. Energy in America: Progress and Potential.

    ERIC Educational Resources Information Center

    American Petroleum Inst., Washington, DC.

    An overview of America's energy situation is presented with emphasis on recent progress, the risk of depending upon foreign oil, and policy choices. Section one reviews the energy problems of the 1970s, issues of the 1980s, concerns for the future, and choices that if made today could alleviate future problems. Section two examines past problems,

  9. Energy in America: Progress and Potential.

    ERIC Educational Resources Information Center

    American Petroleum Inst., Washington, DC.

    An overview of America's energy situation is presented with emphasis on recent progress, the risk of depending upon foreign oil, and policy choices. Section one reviews the energy problems of the 1970s, issues of the 1980s, concerns for the future, and choices that if made today could alleviate future problems. Section two examines past problems,…

  10. HIGH ENERGY PHYSICS POTENTIAL AT MUON COLLIDERS

    SciTech Connect

    PARSA,Z.

    2000-04-07

    In this paper, high energy physics possibilities and future colliders are discussed. The {mu}{sup +} {mu}{sup {minus}} collider and experiments with high intensity muon beams as the stepping phase towards building Higher Energy Muon Colliders (HEMC) are briefly reviewed and encouraged.

  11. Energy conservation potential of surface modification technologies

    SciTech Connect

    Le, H.K.; Horne, D.M.; Silberglitt, R.S.

    1985-09-01

    This report assesses the energy conservation impact of surface modification technologies on the metalworking industries. The energy conservation impact of surface modification technologies on the metalworking industries is assessed by estimating their friction and wear tribological sinks and the subsequent reduction in these sinks when surface modified tools are used. Ion implantation, coatings, and laser and electron beam surface modifications are considered.

  12. The energy absorption potential of chain composites

    SciTech Connect

    Cox, B.N.; Sridhar, N.; Davis, J.B.; Gong, X.Y.; Zok, F.W.

    2000-02-09

    Various chain composites designed to exhibit delocalized damage and high-energy absorption have been fabricated and tested. The energy absorbed per unit volume ranges up to 55 MJ/m{sup 3} and the specific energy absorption up to 14 J/g, figures comparable to or exceeding the best current candidate materials for energy absorption. Observations of damage mechanisms are reported and related to a previously derived model appropriate to chain composites with matrices that are relatively weak in tension. Estimates of the energy absorption levels that could be achieved in the optimal case are then made based on modeling arguments. These are found to exceed 160 MH/m{sup 3} or 40 J/g.

  13. Stretching the inflaton potential with kinetic energy

    SciTech Connect

    Lidsey, James E.

    2007-08-15

    Inflation near a maximum of the potential is studied when nonlocal derivative operators are included in the inflaton Lagrangian. Such terms can impose additional sources of friction on the field. For an arbitrary spacetime geometry, these effects can be quantified in terms of a local field theory with a potential whose curvature around the turning point is strongly suppressed. This implies that a prolonged phase of slow-roll inflation can be achieved with potentials that are otherwise too steep to drive quasiexponential expansion. We illustrate this mechanism within the context of p-adic string theory.

  14. Synergistic effects from graphene and carbon nanotubes endow ordered hierarchical structure foams with a combination of compressibility, super-elasticity and stability and potential application as pressure sensors

    NASA Astrophysics Data System (ADS)

    Kuang, Jun; Dai, Zhaohe; Liu, Luqi; Yang, Zhou; Jin, Ming; Zhang, Zhong

    2015-05-01

    Nanostructured carbon material based three-dimensional porous architectures have been increasingly developed for various applications, e.g. sensors, elastomer conductors, and energy storage devices. Maintaining architectures with good mechanical performance, including elasticity, load-bearing capacity, fatigue resistance and mechanical stability, is prerequisite for realizing these functions. Though graphene and CNT offer opportunities as nanoscale building blocks, it still remains a great challenge to achieve good mechanical performance in their microarchitectures because of the need to precisely control the structure at different scales. Herein, we fabricate a hierarchical honeycomb-like structured hybrid foam based on both graphene and CNT. The resulting materials possess excellent properties of combined high specific strength, elasticity and mechanical stability, which cannot be achieved in neat CNT and graphene foams. The improved mechanical properties are attributed to the synergistic-effect-induced highly organized, multi-scaled hierarchical architectures. Moreover, with their excellent electrical conductivity, we demonstrated that the hybrid foams could be used as pressure sensors in the fields related to artificial skin.Nanostructured carbon material based three-dimensional porous architectures have been increasingly developed for various applications, e.g. sensors, elastomer conductors, and energy storage devices. Maintaining architectures with good mechanical performance, including elasticity, load-bearing capacity, fatigue resistance and mechanical stability, is prerequisite for realizing these functions. Though graphene and CNT offer opportunities as nanoscale building blocks, it still remains a great challenge to achieve good mechanical performance in their microarchitectures because of the need to precisely control the structure at different scales. Herein, we fabricate a hierarchical honeycomb-like structured hybrid foam based on both graphene and CNT. The resulting materials possess excellent properties of combined high specific strength, elasticity and mechanical stability, which cannot be achieved in neat CNT and graphene foams. The improved mechanical properties are attributed to the synergistic-effect-induced highly organized, multi-scaled hierarchical architectures. Moreover, with their excellent electrical conductivity, we demonstrated that the hybrid foams could be used as pressure sensors in the fields related to artificial skin. Electronic supplementary information (ESI) available. See DOI: 10.1039/c5nr00841g

  15. Potential hydroelectric energy resources of Idaho

    SciTech Connect

    Warnick, C.C.; Filler, J.R.; Vance, P.J.

    1981-06-01

    Data are compiled and presented on 1300 potential hydroelectric power sites in Idaho, on hydropower resource inventories and evaluations, and on existing hydroelectric facilities. The data include geographic location, head, and power capacity. (LCL)

  16. Relaxed elastic lines of second kind in semi-dual spaces

    NASA Astrophysics Data System (ADS)

    Aydin Şekerci, Gülşah; Ceylan Çöken, A.

    2015-09-01

    Theory of elasticity is a topic that keeps improving by using on many fields such as geometry, physics, chemistry and engineering. Energy density is given as some functions of curvature and torsion. If the curve of the Is will be an external for the variation problem that minimizes the value of energy density: then this curve is called as relaxed elastic line. The relaxed elastic line on an oriented surface is considered as a model of DNA molecule. In this study, we worked on the second type relaxed elastic lines on the semi-dual spaces which has an important point on kinematic and Einstein's relativity theory. We also obtained boundary conditions for this type of curves. Moreover, the minimization problem of the energy which occurs with an applied force on an elastic line was discussed. Then, we researched the formed potential energy due to the applied force. Also, during the calculation of the potential energy on the elastic line, the amount of the potential energy for unit length of the elastic line was used. Afterwards, by integrating that amount, total potential energy calculated. So, we study to make a contribute both Einstein's relativity theory and kinematic.

  17. A model for creep life prediction of thin tube using strain energy density as a function of stress triaxiality under quasistatic loading employing elastic-creep & elastic-plastic-creep deformation

    NASA Astrophysics Data System (ADS)

    Mahmood, Tahir; Kanapathipillai, Sangarapillai; Chowdhury, Mahiuddin

    2013-06-01

    This paper demonstrates the application of a new multiaxial creep damage model developed by authors using stress traixiality to predict the failure time of a component made of 0.5%Cr-0.5%Mo-0.25%V low alloy steel. The model employs strain energy density and assumes that the uniaxial strain energy density of a component can be easily calculated and can be converted to multi-axial strain energy density by multiplying it to a function of stress trixiality which is a ratio of mean stress to equivalent stress. For comparison, an elastic-creep and elastic-plastic-creep finite element analysis (FEA) is performed to get multi-axial strain energy density of the component which is compared with the calculated strain energy density for both cases. The verification and application of the model are demonstrated by applying it to thin tube for which the experimental data are available. The predicted failure times by the model are compared with the experimental results. The results show that the proposed model is capable of predicting failure times of the component made of the above-mentioned material with an accuracy of 4.0%.

  18. Nanoscale elastic properties of montmorillonite upon water adsorption.

    PubMed

    Ebrahimi, Davoud; Pellenq, Roland J-M; Whittle, Andrew J

    2012-12-11

    Smectites are an important group of clay minerals that experience swelling upon water adsorption. This paper uses molecular dynamics with the CLAYFF force field to simulate isothermal isobaric water adsorption of interlayer Wyoming Na-montmorillonite, a member of the smectite group. Nanoscale elastic properties of the clay-interlayer water system are calculated from the potential energy of the model system. The transverse isotropic symmetry of the elastic constant matrix was assessed by calculating Euclidean and Riemannian distance metrics. Simulated elastic constants of the clay mineral are compared with available results from acoustic and nanoindentation measurements. PMID:23181550

  19. Zeta-function approach to Casimir energy with singular potentials

    SciTech Connect

    Khusnutdinov, Nail R.

    2006-01-15

    In the framework of zeta-function approach the Casimir energy for three simple model system: single delta potential, step function potential and three delta potentials are analyzed. It is shown that the energy contains contributions which are peculiar to the potentials. It is suggested to renormalize the energy using the condition that the energy of infinitely separated potentials is zero which corresponds to subtraction all terms of asymptotic expansion of zeta-function. The energy obtained in this way obeys all physically reasonable conditions. It is finite in the Dirichlet limit, and it may be attractive or repulsive depending on the strength of potential. The effective action is calculated, and it is shown that the surface contribution appears. The renormalization of the effective action is discussed.

  20. Potential Energy Sources Pose Mining Problem

    ERIC Educational Resources Information Center

    Chemical and Engineering News, 1974

    1974-01-01

    Summarizes the discussions of a Division of Industrial and Engineering Chemistry symposium on solids handling for synthetic fuels production. Included is a description of technical difficulties with the use of coal seams and deposits of oil shale and oil sand as potential sources of fuel. (CC)

  1. The role of elasticity in slab bending

    NASA Astrophysics Data System (ADS)

    Fourel, Loic; Goes, Saskia; Morra, Gabriele

    2014-11-01

    studies showed that plate rheology exerts a dominant control on the shape and velocity of subducting plates. Here, we perform a systematic investigation of the role of elasticity in slab bending, using fully dynamic 2-D models where an elastic, viscoelastic, or viscoelastoplastic plate subducts freely into a purely viscous mantle. We derive a scaling relationship between the bending radius of viscoelastic slabs and the Deborah number, De, which is the ratio of Maxwell time over deformation time. We show that De controls the ratio of elastically stored energy over viscously dissipated energy and find that at De>10-2, substantially less energy is required to bend a viscoelastic slab to the same shape as a purely viscous slab with the same intrinsic viscosity. Elastically stored energy at higher De favors retreating modes of subduction via unbending, while trench advance only occurs for some cases with De<10-2. We estimate the apparent Deborah numbers of natural subduction zones and find values ranging from 10-3 to > 1, where most zones have low De<10-2, but a few young plates have De > 0.1. Slabs with De<10-2 either have very low viscosities or they may be yielding, in which case our De estimates may be underestimated by up to an order of magnitude, potentially pointing towards a significant role of elasticity in ˜60% of the subduction zones. In support of such a role of elasticity in subduction, we find that increasing De correlates with increasing proportion of larger seismic events in both instrumental and historic catalogues.

  2. Energy Savings Potential and Research & Development Opportunities for Commercial Refrigeration

    SciTech Connect

    none,

    2009-09-01

    This study documents the energy consumption of commercial refrigeration equipment (CRE) in the U.S. and evaluated the energy savings potential of various technologies and energy efficiency measures that could be applied to such equipment. The study provided an overview of CRE applications, assessed the energy-savings potential of CRE in the U.S., outline key barriers to adoption of energy-savings technologies, and recommended opportunities for advanced energy saving technology research. The study was modeled after an earlier 1996 report by Arthur D. Little, Inc., and updated key information, examined more equipment types, and outlined long-term research and development opportunities.

  3. Energy savings potential from energy-conserving irrigation systems

    SciTech Connect

    Wilfert, G.L.; Patton, W.P.; Harrer, B.J.; Clark, M.A.

    1982-11-01

    This report systematically compares, within a consistent framework, the technical and economic characteristics of energy-conserving irrigation systems with those of conventional irrigation systems and to determine total energy savings. Levelized annual costs of owning and operating both energy-conserving and conventional irrigation systems have been developed and compared for all 17 states to account for the differences in energy costs and irrigation conditions in each state. Market penetration of energy-conserving systems is assessed for those systems having lower levelized annual costs than conventional systems performing the same function. Annual energy savings were computed by matching the energy savings per system with an assumed maximum market penetration of 100 percent in those markets where the levelized annual costs of energy-conserving systems are lower than the levelized annual costs of conventional systems.

  4. First principles phase transition, elastic properties and electronic structure calculations for cadmium telluride under induced pressure: density functional theory, LDA, GGA and modified Becke-Johnson potential

    NASA Astrophysics Data System (ADS)

    Kabita, Kh; Maibam, Jameson; Indrajit Sharma, B.; Brojen Singh, R. K.; Thapa, R. K.

    2016-01-01

    We report first principles phase transition, elastic properties and electronic structure for cadmium telluride (CdTe) under induced pressure in the light of density functional theory using the local density approximation (LDA), generalised gradient approximation (GGA) and modified Becke-Johnson (mBJ) potential. The structural phase transition of CdTe from a zinc blende (ZB) to a rock salt (RS) structure within the LDA calculation is 2.2 GPa while that within GGA is found to be at 4 GPa pressure with a volume collapse of 20.9%. The elastic constants and parameters (Zener anisotropy factor, Shear modulus, Poisson’s ratio, Young’s modulus, Kleinmann parameter and Debye’s temperature) of CdTe at different pressures of both the phases have been calculated. The band diagram of the CdTe ZB structure shows a direct band gap of 1.46 eV as predicted by mBJ calculation which gives better results in close agreement with experimental results as compared to LDA and GGA. An increase in the band gap of the CdTe ZB phase is predicted under induced pressure while the metallic nature is retained in the CdTe RS phase.

  5. Elastic differential cross sections for C₄F₆ isomers in the 1.5-200 eV energy electron impact: similarities with six fluorine containing molecules and evidence of F-atom like scattering.

    PubMed

    Hoshino, M; Limão-Vieira, P; Anzai, K; Kato, H; Cho, H; Mogi, D; Tanioka, T; Ferreira da Silva, F; Almeida, D; Blanco, F; García, G; Ingólfsson, O; Tanaka, H

    2014-09-28

    We report absolute elastic differential cross sections for electron interactions with the C4F6 isomers, hexafluoro-1,3-butadiene (1,3-C4F6), hexafluoro-2-butyne (2-C4F6), and hexafluorocyclobutene (c-C4F6). The incident electron energy range is 1.5-200 eV, and the scattered electron angular range for the differential measurements varies from 15° to 150°. In all cases the absolute scale of the differential cross section was set using the relative flow technique, with helium as the reference species. Atomic-like behaviour in these scattering systems is shown here for the first time, and is further investigated by comparing the elastic cross sections for the C4F6 isomers with other fluorinated molecules, such as SF6 and CnF6 (n = 2, 3, and 6). We note that for all the six-F containing molecules, the scattering process for electron energies above 30 eV is indistinguishable. Finally, we report results for calculations of elastic differential cross sections for electron scattering from each of these isomers, within an optical potential method and assuming a screened corrected independent atom representation. The level of agreement between these calculations and our measurements is found to be quite remarkable in all cases. PMID:25273432

  6. Evidence of Cholesterol Accumulated in High Curvature Regions: Implication ot the Curvature Elastic Energy for Lipid Mixtures

    SciTech Connect

    Wang,W.; Yang, L.; Huang, H.

    2007-01-01

    Recent experiments suggested that cholesterol and other lipid components of high negative spontaneous curvature facilitate membrane fusion. This is taken as evidence supporting the stalk-pore model of membrane fusion in which the lipid bilayers go through intermediate structures of high curvature. How do the high-curvature lipid components lower the free energy of the curved structure? Do the high-curvature lipid components modify the average spontaneous curvature of the relevant monolayer, thereby facilitate its bending, or do the lipid components redistribute in the curved structure so as to lower the free energy? This question is fundamental to the curvature elastic energy for lipid mixtures. Here we investigate the lipid distribution in a monolayer of a binary lipid mixture before and after bending, or more precisely in the lamellar, hexagonal, and distorted hexagonal phases. The lipid mixture is composed of 2:1 ratio of brominated di18:0PC and cholesterol. Using a newly developed procedure for the multiwavelength anomalous diffraction method, we are able to isolate the bromine distribution and reconstruct the electron density distribution of the lipid mixture in the three phases. We found that the lipid distribution is homogenous and uniform in the lamellar and hexagonal phases. But in the distorted hexagonal phase, the lipid monolayer has nonuniform curvature, and cholesterol almost entirely concentrates in the high curvature region. This finding demonstrates that the association energies between lipid molecules vary with the curvature of membrane. Thus, lipid components in a mixture may redistribute under conditions of nonuniform curvature, such as in the stalk structure. In such cases, the spontaneous curvature depends on the local lipid composition and the free energy minimum is determined by lipid distribution as well as curvature.

  7. Regional Differences in the Price-Elasticity of Demand for Energy

    SciTech Connect

    Bernstein, M. A.; Griffin, J.

    2006-02-01

    At the request of the National Renewable Energy Laboratory (NREL), the RAND Corporation examined the relationship between energy demand and energy prices with the focus on whether the relationships between demand and price differ if these are examined at different levels of data resolution. In this case, RAND compares national, regional, state, and electric utility levels of data resolution. This study is intended as a first step in helping NREL understand the impact that spatial disaggregation of data can have on estimating the impacts of their programs. This report should be useful to analysts in NREL and other national laboratories, as well as to policy nationals at the national level. It may help them understand the complex relationships between demand and price and how these might vary across different locations in the United States.

  8. Potential production of energy cane for fuel in the Caribbean

    SciTech Connect

    Samuels, G.

    1984-12-01

    Sugarcane presents a tremendous potential as a renewable energy source for the non-oil producing countries of the Caribbean. The energy cane concept is sugarcane managed for maximum dry matter (total fermentable solids for alcohol fuel and combustible solids for electricity) rather than sucrose. The use of sugarcane as a renewable energy source can provide a solution, either partial or total, to the Caribbean energy problem. Sugar cane production and the use of this crop as a renewable energy source are described.

  9. Elastic scattering and transfer reactions for the system 7Be + 58Ni at Coulomb barrier energies

    NASA Astrophysics Data System (ADS)

    Mazzocco, M.; Torresi, D.; Acosta, L.; Boiano, A.; Boiano, C.; Glodariu, T.; Guglielmetti, A.; Keeley, N.; La Commara, M.; Lay, J. A.; Martel, I.; Mazzocchi, C.; Molini, P.; Parascandolo, C.; Parkar, V. V.; Pierroutsakou, D.; Romoli, M.; Rusek, K.; Sanchez-Benitez, A. M.; Sandoli, M.; Signorini, C.; Silvestri, R.; Soramel, F.; Strano, E.; Stroe, L.

    2015-09-01

    We investigated the reaction induced by the Radioactive Ion Beam 7Be on the closed proton shell nucleus 58Ni at 22.0 MeV bombarding energy. The 7Be beam was produced by means of the in-flight technique with the facility EXOTIC at INFN-LNL (Italy). Charged reaction products were mass and charge identified in a rather wide angular range and their energy distributions were analyzed to infer some information on the production mechanism. The relevance of direct processes, especially 3He- and 4He-stripping, as well as compound nucleus reactions is critically reviewed.

  10. The energy of naturally curved elastic rods with an application to the stretching and contraction of a free helical spring as a model for DNA.

    PubMed

    Manning, Gerald S

    2015-09-14

    We give a contemporary and direct derivation of a classical, but insufficiently familiar, result in the theory of linear elasticity-a representation for the energy of a stressed elastic rod with central axis that intrinsically takes the shape of a general space curve. We show that the geometric torsion of the space curve, while playing a crucial role in the bending energy, is physically unrelated to the elastic twist. We prove that the twist energy vanishes in the lowest-energy states of a rod subject to constraints that do not restrict the twist. The stretching and contraction energies of a free helical spring are computed. There are local high-energy minima. We show the possibility of using the spring to model the chirality of DNA. We then compare our results with an available atomic level energy simulation that was performed on DNA unconstrained in the same sense as the free spring. We find some possible reflections of springlike behavior in the mechanics of DNA, but, unsurprisingly, the base pairs lend a material substance to the core of DNA that a spring does not capture. PMID:26374056

  11. Effects of bonding on the energy distribution of electrons scattered elastically at high momentum transfer

    SciTech Connect

    Vos, M.; Went, M. R.

    2006-11-15

    High-resolution measurements of 40-keV electrons scattered over 44.3 deg. from evaporated carbon films are presented. The observed width of the energy distribution of electrons scattered from carbon is significantly larger than the experimental energy resolution, and its position is shifted to lower energy. Measurements were done for transmission and reflection geometries for thin films with thicknesses varying from 90 A ring to 1400 A ring . The observed peak shape is largely independent of the thickness and measurement geometry. The peak shape deviates from Gaussian in all cases, in a way consistent with theories that describe these processes beyond the impulse approximation. The energy shift of the carbon peak is measured by evaporating a small amount of Au on these films. Separation of the Au and C peak is somewhat smaller than calculated assuming scattering from free C and Au atoms, but independent of measurement geometry. Finally spectra were measured from highly oriented pyrolytic graphite (HOPG) films. Now different widths are observed in reflection geometry and transmission geometry. This is attributed to the anisotropy of the motion of the C atoms in HOPG. Also the Au-C separation is slightly orientation dependent for HOPG. All observations agree at least semiquantitatively with neutron Compton scattering results, a related scattering experiment that studies neutron-atom collisions at similar momentum transfers.

  12. High-energy transmission Laue micro-beam X-ray diffraction: a probe for intra-granular lattice orientation and elastic strain in thicker samples.

    PubMed

    Hofmann, Felix; Song, Xu; Abbey, Brian; Jun, Tea-Sung; Korsunsky, Alexander M

    2012-05-01

    An understanding of the mechanical response of modern engineering alloys to complex loading conditions is essential for the design of load-bearing components in high-performance safety-critical aerospace applications. A detailed knowledge of how material behaviour is modified by fatigue and the ability to predict failure reliably are vital for enhanced component performance. Unlike macroscopic bulk properties (e.g. stiffness, yield stress, etc.) that depend on the average behaviour of many grains, material failure is governed by `weakest link'-type mechanisms. It is strongly dependent on the anisotropic single-crystal elastic-plastic behaviour, local morphology and microstructure, and grain-to-grain interactions. For the development and validation of models that capture these complex phenomena, the ability to probe deformation behaviour at the micro-scale is key. The diffraction of highly penetrating synchrotron X-rays is well suited to this purpose and micro-beam Laue diffraction is a particularly powerful tool that has emerged in recent years. Typically it uses photon energies of 5-25 keV, limiting penetration into the material, so that only thin samples or near-surface regions can be studied. In this paper the development of high-energy transmission Laue (HETL) micro-beam X-ray diffraction is described, extending the micro-beam Laue technique to significantly higher photon energies (50-150 keV). It allows the probing of thicker sample sections, with the potential for grain-level characterization of real engineering components. The new HETL technique is used to study the deformation behaviour of individual grains in a large-grained polycrystalline nickel sample during in situ tensile loading. Refinement of the Laue diffraction patterns yields lattice orientations and qualitative information about elastic strains. After deformation, bands of high lattice misorientation can be identified in the sample. Orientation spread within individual scattering volumes is studied using a pattern-matching approach. The results highlight the inability of a simple Schmid-factor model to capture the behaviour of individual grains and illustrate the need for complementary mechanical modelling. PMID:22514163

  13. Elastic field of a surface step: Atomistic simulations and anisotropic elastic theory

    SciTech Connect

    Shilkrot, L.E.; Srolovitz, D.J.

    1996-04-01

    Atomistic computer simulations and anisotropic elastic theory are employed to determine the elastic fields of surface steps and vicinal surfaces. The displacement field of and interaction energies between {l_angle}100{r_angle} steps on a {l_brace}001{r_brace} surface of Ni and Au are determined using atomistic simulations and embedded-atom method potentials. The step-step interaction energy found from the simulations is consistent with a surface line force dipole elastic model of a step. We derive an anisotropic form for the elastic field associated with a surface line force dipole using a two-dimensional surface Green tensor for a cubic elastic half-space within the Stroh formalism. Both the displacement fields and step-step interaction energy predicted by the theory are shown to be in excellent agreement with the simulations. The symmetry of the step displacement field is used to determine analytically the relative values of the components of the surface force dipole vector. {copyright} {ital 1996 The American Physical Society.}

  14. Brittle fracture in a periodic structure with internal potential energy

    PubMed Central

    Mishuris, Gennady S.; Slepyan, Leonid I.

    2014-01-01

    We consider a brittle fracture taking account of self-equilibrated distributed stresses existing at microlevel in the absence of external forces. To determine how the latter can affect the crack equilibrium and growth, a model of a structured linearly elastic body is introduced, consisting of two equal symmetrically arranged layers (or half-planes) connected by an interface as a prospective crack path. The interface comprises a discrete set of elastic bonds. In the initial state, the bonds are assumed to be stressed in such a way that tensile and compressive forces of the same value alternate. In the general considerations, the layers are assumed to be of an unspecified periodic structure, where such self-equilibrated stresses may also exist. A two-line chain and a lattice are examined as the specified structure. We consider the states of the body-with-a-crack under such microlevel stresses (MS) and under a combined action of the remote forces and MS. Analytical solutions to the considered problems are presented based on the introduction of a selective discrete transform. We demonstrate that MS can increase as well as decrease the crack resistance depending on the internal energy level. We also discuss different scenarios of the crack growth. PMID:24808756

  15. Preliminary evaluation of wind energy potential: Cook Inlet area, Alaska

    SciTech Connect

    Hiester, T.R.

    1980-06-01

    This report summarizes work on a project performed under contract to the Alaska Power Administration (APA). The objective of this research was to make a preliminary assessment of the wind energy potential for interconnection with the Cook Inlet area electric power transmission and distribution systems, to identify the most likely candidate regions (25 to 100 square miles each) for energy potential, and to recommend a monitoring program sufficient to quantify the potential.

  16. Analysis of energy dissipation in an elastic moving string with a viscous damper at one end

    NASA Astrophysics Data System (ADS)

    Chen, E. W.; Ferguson, N. S.

    2014-04-01

    In this paper transverse vibration of an axially moving viscoelastic string with a viscous damper at one end is investigated analytically. The string is assumed to be travelling with constant velocity and the length of string is constant or time varying. The linear and nonlinear mathematical models are derived using the Lagrangian function and implemented using a finite element method. The method considers a time varying state space function applied to the linear model, the Newmark-Beta method is used to solve the response for the nonlinear problem numerically. The case of energy dissipated by a viscoelastic damper at one end of the string for different axial string velocities is considered. When a disturbance arrives at the boundary an exact value for the damper which provides maximum energy dissipation is investigated. Finally, numerical simulations are presented to establish the feasibility of the method.

  17. Theoretical study of the elastic breakup of weakly bound nuclei at near-barrier energies

    NASA Astrophysics Data System (ADS)

    Otomar, D. R.; Gomes, P. R. S.; Lubian, J.; Canto, L. F.; Hussein, M. S.

    2015-12-01

    We have performed continuum discretized coupled channel (CDCC) calculations for collisions of 7Li projectiles on 59Co,144Sm, and 208Pb targets at near-barrier energies, to assess the importance of the Coulomb and the nuclear couplings in the breakup of 7Li, as well as the Coulomb-nuclear interference. We have also investigated scaling laws, expressing the dependence of the cross sections on the charge and the mass of the target. This work is complementary to that previously reported by us on the breakup of 6Li. Here we explore the similarities and differences between the results for the two lithium isotopes. The relevance of the Coulomb dipole and quadrupole strengths at low energy for the two-cluster projectile is investigated in detail.

  18. Geothermal energy potential in the San Luis Valley, Colorado

    SciTech Connect

    Coe, B.A.

    1980-01-01

    The background of the area itself is investigated considering the geography, population, economy, attitudes of residents, and energy demands of the area. The requirements for geothermal energy development are considered, including socio-economic, institutional, and environmental conditions as well as some technical aspects. The current, proposed, and potential geothermal energy developments are described. The summary, conclusions, and methodology are included. (MHR)

  19. Turbine under Gulf Stream: Potential energy source

    SciTech Connect

    Venezia, W.A.; Holt, J.

    1995-09-01

    Turbine under the Gulf Stream (TUGS) is a project to design, build, and deploy the prototypes necessary to demonstrate the economic and technical feasibility of generating electric power from the Gulf Stream. The project is based in part on new generator designs and emerging materials technologies. Its successful completion would demonstrate the technology and produce prototype turbines that can be mass produced and sold with service support. Past research and experimentation indicates that energy can be generated from the Gulf Stream. Problems exist such as fluctuations in the current`s axis and inconsistency. Above all, the ocean is a difficult environment in which to work. Therefore, the question is not whether or not a generator can be put in the ocean to generate electricity, but rather can it be done in an economically and environmentally sound way and still be practical?

  20. [Energy cost of postextrasystolic potentiation in man].

    PubMed

    Geschwind, H; Huet, Y; Laine, J F; Teisseire, B; Dhainaut, J F; Laurent, D

    1984-07-01

    The energetic costs of post-extrasystolic potentiation (PEP) were assessed by evaluating left ventricular function and coronary blood flow in 16 patients with different forms of cardiac disease during cardiac catheterisation under basal conditions and sustained coupled right ventricular pacing. The coronary blood flow was measured by thermodilution techniques with sampling in the aorta and coronary sinus to measure O2 concentration, glucose, and plasma lactate and catecholamine levels. Parameters of LV function were calculated from data obtained from biplane left cineventriculography. During PEP, the ejection fraction increased from 0.48 +/- 0.8 to 0.62 +/- 0.22, the mean velocity of circumferential fibre shortening from 0.79 +/- 0.37 to 1.12 +/- 0.45 circ/s (p less than 0.001) and systolic work from 97 +/- 46 to 139 +/- 67 g/m2 (p less than 0.05). Coronary blood flow increased from 176 +/- 60 to 305 +/- 155 ml/min; myocardial oxygen consumption per potentialized beat rose from 0.15 +/- 0.07 to 0.50 +/- 0.33 ml/beat (p less than 0.001) whilst cardiac efficiency fell from 19.1 +/- 8 to 9.2 +/- 4% (p less than 0.001). PEP was associated with increased myocardial noradrenaline secretion (-3.1 +/- 31.5 ng/min under basal conditions to 30.2 +/- 42.8 ng/min, p less than 0.05). Therefore, the inotropic effect of PEP imposes a high metabolic demand and is associated with increased myocardial noradrenaline secretion. PMID:6433837

  1. Elastic and rotationally inelastic cross sections for low-energy electron scattering by SO2 molecules

    NASA Astrophysics Data System (ADS)

    Natalense, A. P. P.; Varella, M. T. do N.; Bettega, M. H. F.; Ferreira, L. G.; Lima, M. A. P.

    1999-12-01

    We show rotationally summed and rotationally inelastic differential, integral and momentum transfer cross sections for electron scattering by SO2 in the 3-30 eV impact energy range in the static exchange approximation. Our results were obtained with the Schwinger multichannel method with pseudopotentials, including a first Born approximation to describe the influence of the molecular permanent dipole moment on the scattering cross sections. The rotational excitation cross sections were obtained through the adiabatic-nuclei-rotation approximation. Our results show good agreement with available experimental and theoretical data. The rotationally inelastic cross sections were found to be very large.

  2. Energy Consumption and Renewable Energy Development Potential on Indian Lands

    EIA Publications

    2000-01-01

    Includes information on the electricity use and needs of Indian households and tribes, the comparative electricity rates that Indian households are paying, and the potential for renewable resources development of Indian lands.

  3. Regge pole analysis of elastic scattering of ? particles by even isotopes of Ni target nuclei at incident energies above Coulomb barrier

    NASA Astrophysics Data System (ADS)

    Badran, R. I.; Istaiti, A. I.; Mashaqbeh, W. N.; Al-Lehyani, I. H.

    2015-10-01

    Regge pole model is adopted to account for the angular distribution at backward angles for a set of elastic scattering processes of incident ?-particles by different isotopes of nickel ions, 58,60,62,64Ni, at different laboratory energies above Coulomb barrier. The reproduction of cross-sections at backward angles is preceded by an attempt to fit the experimental data at forward angles of the scattering. Three-parameter McIntyre model which is based on concept of strong absorption parametrization of the scattering matrix elements, has been employed to analyze and reproduce the experimental data of angular distribution of different elastic scattering reactions at forward angles. The three parameters extracted from McIntyre model analysis are employed as fixed entries in the fitting process of the full angle-range of angular distribution where another four free parameters are employed using the Regge pole model. Diffractive features observed in the angular distributions are studied. The Fresnel-type diffraction pattern is found dominant for all investigated elastic scatterings where Coulomb interaction is strong. The interaction radius of elastic scattering is found decreasing and the total cross-section increasing when the incident projectile energy increases. Moreover, the interaction radius and total reaction cross-section are found increasing with the increase in the size of target ion. Such diffractive behavior is consistent with the prescriptions of strong absorption model (SAM). Furthermore, the explanation of the diffractive features of studied elastic scattering reactions is model-independent. The Regge pole analysis reveals the existence of a pole which has its location, width, amplitude and phase angle exhibiting a common peak at energy of 24.1MeV with oscillatory behaviour at energies around this peak energy, for all elastic scattering of alpha particle on isotopes of Ni targets except that of 58Ni target which exhibits extra peaks for energy larger than 24.1MeV. We believe that the presence of poles is responsible for the oscillatory structure of the backward cross-sections. The variation of Regge pole parameters with both incident energy and size of target nucleus is illustrated.

  4. Visualization of the energy flow for a guided forward wave in and around a fluid loaded elastic cylindrical shell: Color coding of the Poynting vector field

    NASA Astrophysics Data System (ADS)

    Dean, Cleon E.; Braselton, James P.

    2002-05-01

    Previous work [Cleon E. Dean and James P. Braselton, ``Visualization of the energy flow for a guided forward wave in and around a fluid loaded elastic cylindrical shell,'' J. Acoust. Soc. Am. 109, 2379 (2001)] showed the energy flow for a forward propagating fluid loaded elastic cylindrical shell at the resonance frequency. The results were difficult to interpret since although the two counterpropagating guided waves were separated and displayed independently, the conventional grid of vector arrows was hard to interpret in part because they were hard to see individually. The current work uses color encoding to show the Poynting vector field. Hue is used to indicate the direction of the energy flow while intensity of the color is used to denote the magnitude of the Poynting vector at that point.

  5. Bandwidth Study on Energy Use and Potential Energy Saving Opportunities in U.S. Chemical Manufacturing

    SciTech Connect

    Sabine Brueske, Caroline Kramer, Aaron Fisher

    2015-06-01

    Energy bandwidth studies of U.S. manufacturing sectors can serve as foundational references in framing the range (or bandwidth) of potential energy savings opportunities. This bandwidth study examines energy consumption and potential energy savings opportunities in U.S. chemical manufacturing. The study relies on multiple sources to estimate the energy used in the production of 74 individual chemicals, representing 57% of sector-wide energy consumption. Energy savings opportunities for individual chemicals and for 15 subsectors of chemicals manufacturing are based on technologies currently in use or under development; these potential savings are then extrapolated to estimate sector-wide energy savings opportunity.

  6. Bandwidth Study on Energy Use and Potential Energy Savings Opportunities in U.S. Petroleum Refining

    SciTech Connect

    Sabine Brueske, Caroline Kramer, Aaron Fisher

    2015-06-01

    Energy bandwidth studies of U.S. manufacturing sectors can serve as foundational references in framing the range (or bandwidth) of potential energy savings opportunities. This bandwidth study examines energy consumption and potential energy savings opportunities in U.S. petroleum refining. The study relies on multiple sources to estimate the energy used in nine individual process areas, representing 68% of sector-wide energy consumption. Energy savings opportunities for individual processes are based on technologies currently in use or under development; these potential savings are then extrapolated to estimate sector-wide energy savings opportunity.

  7. Exploring wind energy potential off the California coast

    NASA Astrophysics Data System (ADS)

    Jiang, Qingfang; Doyle, James D.; Haack, Tracy; Dvorak, Michael J.; Archer, Cristina L.; Jacobson, Mark Z.

    2008-10-01

    Wind energy represents the nearest term cost-effective renewable energy source. While efforts have been made to assess wind energy potential over land around the world, offshore wind energy resources are largely unexplored, in part because these regions have relatively sparse wind observations. In this study, the wind energy potential offshore of the California coast is evaluated using a well-tested high-resolution numerical model dataset. We found that along the coastline, the low-level winds exhibit strong spatial variation and are characterized by alternating windspeed maxima and minima near coastal promontories associated with the interaction between the marine boundary layer and coastal topography. Further analysis highlights the enormous and reliable wind energy development potential in these persistent offshore windspeed maxima.

  8. New approach to calculating the potential energy of colliding nuclei

    SciTech Connect

    Kurmanov, R. S.; Kosenko, G. I.

    2014-12-15

    The differential method proposed by the present authors earlier for the reduction of volume integrals in calculating the potential energy of a compound nucleus is generalized to the case of two interacting nuclei. The Coulomb interaction energy is obtained for the cases of a sharp and a diffuse boundary of nuclei, while the nuclear interaction energy is found only for nuclei with a sharp boundary, the finiteness of the nuclear-force range being taken into account. The present method of calculations permits reducing the time it takes to compute the potential energy at least by two orders of magnitude.

  9. Extended Hartree-Fock study of the single-particle potential: The nuclear symmetry energy, nucleon effective mass, and folding model of the nucleon optical potential

    NASA Astrophysics Data System (ADS)

    Loan, Doan Thi; Loc, Bui Minh; Khoa, Dao T.

    2015-09-01

    The nucleon mean-field potential has been thoroughly investigated in an extended Hartree-Fock (HF) calculation of nuclear matter (NM) using the CDM3Y3 and CDM3Y6 density dependent versions of the M3Y interaction. The single-particle (SP) energies of nucleons in NM are determined according to the Hugenholtz-Van Hove theorem, which gives rise naturally to a rearrangement term (RT) of the SP potential at the Fermi momentum. Using the RT obtained exactly at the different NM densities and neutron-proton asymmetries, a consistent method is suggested to take into account effectively the momentum dependence of the RT of the SP potential within the standard HF scheme. To obtain a realistic momentum dependence of the nucleon optical potential (OP), the high-momentum part of the SP potential was accurately readjusted to reproduce the observed energy dependence of the nucleon OP over a wide range of energies. The impact of the RT and momentum dependence of the SP potential on the density dependence of the nuclear symmetry energy and nucleon effective mass has been studied in detail. The high-momentum tail of the SP potential was found to have a sizable effect on the slope of the symmetry energy and the neutron-proton effective mass splitting at supranuclear densities of the NM. Based on a local density approximation, the folding model of the nucleon OP of finite nuclei has been extended to take into account consistently the RT and momentum dependence of the nucleon OP in the same mean-field manner, and successfully applied to study the elastic neutron scattering on the lead target at the energies around the Fermi energy.

  10. Intermolecular potential energy surface for CS2 dimer.

    PubMed

    Farrokhpour, Hossein; Mombeini, Zainab; Namazian, Mansoor; Coote, Michelle L

    2011-04-15

    A new four-dimensional intermolecular potential energy surface for CS(2) dimer is obtained by ab initio calculation of the interaction energies for a range of configurations and center-of-mass separation distances for the first time. The calculations were performed using the supermolecular approach at the Møller-Plesset second-order perturbation (MP2) level of theory with the augmented correlation consistent basis sets (aug-cc-pVxZ, x = D, T) and corrected for the basis-set superposition error using the full counterpoise correction method. A two-point extrapolation method was used to extrapolate the calculated energy points to the complete basis set limit. The effect of using the higher levels of theory, quadratic configuration interaction containing single, double, and perturbative triple excitations QCISD(T) and coupled cluster singles, doubles and perturbative triples excitations CCSD(T), on the shape of potential energy surface was investigated. It is shown that the MP2 level of theory apparently performs extremely poorly for describing the intermolecular potential energy surface, overestimating the total energy by a factor of nearly 1.73 in comparison with the QCISD(T) and CCSD(T) values. The value of isotropic dipole-dipole dispersion coefficient (C(6) ) of CS(2) fluid was obtained from the extrapolated MP2 potential energy surface. The MP2 extrapolated energy points were fitted to well-known analytical potential functions using two different methods to represent the potential energy surface analytically. The most stable configuration of the dimer was determined at R = 6.23 au, α = 90°, β = 90°, and γ = 90°, with a well depth of 3.980 kcal mol(-1) at the MP2 level of theory. Finally, the calculated second virial coefficients were compared with experimental values to test the quality of the presented potential energy surface. PMID:20941736

  11. Re-examining Potential for Geothermal Energy in United States

    NASA Astrophysics Data System (ADS)

    Showstack, Randy

    New technological initiatives, along with potential policy and economic incentives, could help to bring about a resurgence in geothermal energy development in the United States, said several experts at a 22 May forum in Washington, D.C. The forum was sponsored by the House and Senate Renewable Energy and Energy Efficiency Caucuses, the Sustainable Energy Coalition, and the Environmental and Energy Study Institute. Among these initiatives is an ambitious program of the U.S. Department of Energy to expand existing geothermal energy fields and potentially create new fields through ``enhanced geothermal systems.'' In addition, a program of the Bush administration encourages geothermal development on some public lands, and current legislation would provide tax credits and other incentives for geothermal development.

  12. Biomass energy: the scale of the potential resource.

    PubMed

    Field, Christopher B; Campbell, J Elliott; Lobell, David B

    2008-02-01

    Increased production of biomass for energy has the potential to offset substantial use of fossil fuels, but it also has the potential to threaten conservation areas, pollute water resources and decrease food security. The net effect of biomass energy agriculture on climate could be either cooling or warming, depending on the crop, the technology for converting biomass into useable energy, and the difference in carbon stocks and reflectance of solar radiation between the biomass crop and the pre-existing vegetation. The area with the greatest potential for yielding biomass energy that reduces net warming and avoids competition with food production is land that was previously used for agriculture or pasture but that has been abandoned and not converted to forest or urban areas. At the global scale, potential above-ground plant growth on these abandoned lands has an energy content representing approximately 5% of world primary energy consumption in 2006. The global potential for biomass energy production is large in absolute terms, but it is not enough to replace more than a few percent of current fossil fuel usage. Increasing biomass energy production beyond this level would probably reduce food security and exacerbate forcing of climate change. PMID:18215439

  13. Coupled channel effect in elastic scattering and fusion for 6,7Li+28Si

    NASA Astrophysics Data System (ADS)

    Sinha, Mandira; Roy, Subinit; Basu, P.; Majumdar, H.; Santra, S.; Parkar, V. V.; Golda, K. S.; Kailas, S.

    2011-10-01

    The fusion excitation and elastic angular distribution were measured for 6,7Li+28Si from below to above Coulomb barrier (≤ 3Vb) energies. The barrier distribution derived from the fusion data was found to be broad and asymmetric at the sub-barrier region, compared to 1D BPM estimation. Effect of rotational coupling on fusion was found to be not so dominant. Phenomenological optical potential parameters, with surface and volume type imaginary potentials, were obtained from f tting of elastic scattering data and energy dependence of real and imaginary surface strengths were investigated around the barrier. CDCC calculations considering only breakup of projectile were performed for 6,7Li+28Si with the elastic scattering data, using the code FRESCO. The effects of breakup of projectile on elastic cross section do not agree with the energy dependence of real and imaginary strength with volume type imaginary potential around the barrier.

  14. A minimally invasive blood-extraction system: elastic self-recovery actuator integrated with an ultrahigh- aspect-ratio microneedle.

    PubMed

    Li, Cheng Guo; Lee, Kwang; Lee, Chang Yeol; Dangol, Manita; Jung, Hyungil

    2012-08-28

    A minimally invasive blood-extraction system is fabricated by the integration of an elastic self-recovery actuator and an ultrahigh-aspect-ratio microneedle. The simple elastic self-recovery actuator converts finger force to elastic energy to provide power for blood extraction and transport without requiring an external source of power. This device has potential utility in the biomedical field within the framework of complete micro-electromechanical systems. PMID:22807158

  15. Potential production of energy cane for fuel in the Caribbean

    SciTech Connect

    Samuels, G.

    1984-08-01

    Sugarcane grown as energy cane presents a new potential to the Caribbean countries to provide their own energy needs and to reduce or eliminate fuel oil imports. The use of proper agronomic techniques can convert conventional sugarcane growing to a crop capable of giving energy feedstocks in the form of fiber for boiler fuel for electricity and fermentable solids for alcohol for motor fuel. Sugarcane can still be obtained from the energy cane for domestic consumption and export if desired. The aerable land now devoted to sugarcane can utilized for energy-cane production without causing any serious imbalance in food crop production.

  16. Fusion at deep subbarrier energies: potential inversion revisited

    SciTech Connect

    Hagino, K.; Rowley, N.

    2009-03-04

    For a single potential barrier, the barrier penetrability can be inverted based on the WKB approximation to yield the barrier thickness. We apply this method to heavy-ion fusion reactions at energies well below the Coulomb barrier and directly determine the inter-nucleus potential between the colliding nuclei. To this end, we assume that fusion cross sections at deep subbarrier energies are governed by the lowest barrier in the barrier distribution. The inverted inter-nucleus potentials for the {sup 16}O+{sup 144}Sm and {sup 16}O+{sup 208}Pb reactions show that they are much thicker than phenomenological potentials. We discuss a consequence of such thick potential by fitting the inverted potentials with the Bass function.

  17. Energy density for chiral lattice fermions with chemical potential

    SciTech Connect

    Gattringer, Christof; Liptak, Ludovit

    2007-09-01

    We study a recently proposed formulation of overlap fermions at finite density. In particular, we compute the energy density as a function of the chemical potential and the temperature. It is shown that overlap fermions with chemical potential approach the correct continuum behavior.

  18. Potential geothermal energy applications for Idaho Elks Rehabilitation Hospital

    NASA Astrophysics Data System (ADS)

    Austin, J. C.

    1981-11-01

    Several potential applications of geothermal energy for the Idaho Elks Rehabilitation Hospital are outlined. A brief background on the resource and distribution system, is provided; which hospital heating systems should be considered for potential geothermal retrofit is discussed; and technical and economic feasibility are addressed.

  19. Geospatial Analysis of Renewable Energy Technical Potential on Tribal Lands

    SciTech Connect

    Doris, E.; Lopez, A.; Beckley, D.

    2013-02-01

    This technical report uses an established geospatial methodology to estimate the technical potential for renewable energy on tribal lands for the purpose of allowing Tribes to prioritize the development of renewable energy resources either for community scale on-tribal land use or for revenue generating electricity sales.

  20. Investigating Energy-Saving Potentials in the Cloud

    PubMed Central

    Lee, Da-Sheng

    2014-01-01

    Collecting webpage messages can serve as a sensor for investigating the energy-saving potential of buildings. Focusing on stores, a cloud sensor system is developed to collect data and determine their energy-saving potential. The owner of a store under investigation must register online, report the store address, area, and the customer ID number on the electric meter. The cloud sensor system automatically surveys the energy usage records by connecting to the power company website and calculating the energy use index (EUI) of the store. Other data includes the chain store check, company capital, location price, and the influence of weather conditions on the store; even the exposure frequency of store under investigation may impact the energy usage collected online. After collecting data from numerous stores, a multi-dimensional data array is constructed to determine energy-saving potential by identifying stores with similarity conditions. Similarity conditions refer to analyzed results that indicate that two stores have similar capital, business scale, weather conditions, and exposure frequency on web. Calculating the EUI difference or pure technical efficiency of stores, the energy-saving potential is determined. In this study, a real case study is performed. An 8-dimensional (8D) data array is constructed by surveying web data related to 67 stores. Then, this study investigated the savings potential of the 33 stores, using a site visit, and employed the cloud sensor system to determine the saving potential. The case study results show good agreement between the data obtained by the site visit and the cloud investigation, with errors within 4.17%. Among 33 the samples, eight stores have low saving potentials of less than 5%. The developed sensor on the cloud successfully identifies them as having low saving potential and avoids wasting money on the site visit. PMID:24561405

  1. Investigating energy-saving potentials in the cloud.

    PubMed

    Lee, Da-Sheng

    2014-01-01

    Collecting webpage messages can serve as a sensor for investigating the energy-saving potential of buildings. Focusing on stores, a cloud sensor system is developed to collect data and determine their energy-saving potential. The owner of a store under investigation must register online, report the store address, area, and the customer ID number on the electric meter. The cloud sensor system automatically surveys the energy usage records by connecting to the power company website and calculating the energy use index (EUI) of the store. Other data includes the chain store check, company capital, location price, and the influence of weather conditions on the store; even the exposure frequency of store under investigation may impact the energy usage collected online. After collecting data from numerous stores, a multi-dimensional data array is constructed to determine energy-saving potential by identifying stores with similarity conditions. Similarity conditions refer to analyzed results that indicate that two stores have similar capital, business scale, weather conditions, and exposure frequency on web. Calculating the EUI difference or pure technical efficiency of stores, the energy-saving potential is determined. In this study, a real case study is performed. An 8-dimensional (8D) data array is constructed by surveying web data related to 67 stores. Then, this study investigated the savings potential of the 33 stores, using a site visit, and employed the cloud sensor system to determine the saving potential. The case study results show good agreement between the data obtained by the site visit and the cloud investigation, with errors within 4.17%. Among 33 the samples, eight stores have low saving potentials of less than 5%. The developed sensor on the cloud successfully identifies them as having low saving potential and avoids wasting money on the site visit. PMID:24561405

  2. Potential Energy Calculations for Water Adsorption on Poly (methyl methacrylate)

    NASA Astrophysics Data System (ADS)

    Zuba, Mateusz J.; Howard, Patrick; Familo, Brian; Kane, Thorin; Netusil, Ross L.; Ilie, Carolina C.

    2015-03-01

    The generosity of the NOYCE Research Grant enabled me to focus on the study of various polymers. The main goal was to study the molecular orbitals of poly (methyl methacrylate) (PMMA) and calculate the energy band gap. We also performed the potential energy calculations for our system: two polymer chains and water molecules. We obtained the activation energy from thermal desorption spectra of water on poly (methyl methacrylate) by employing Arrhenius analysis. NSF - Noyce Scholarship Program.

  3. Saint Paul Energy Park: the potential for district heating

    SciTech Connect

    Lee, C.; Kron, R.; Davis, H.

    1980-03-01

    The results of ANL's study of the energy and economic aspects of using district heating in the St. Paul Energy Park are summarized. The Energy Park is a 6 million ft/sup 2/ residential, commercial office, and light industrial complex to be built in the midway area of St. Paul, Minnesota. Space heating and cooling design loads for the park were calculated assuming that the ASHRAE's 90-75 energy-conserving construction standards would be used in constructing the park's buildings. Based in part on this assumption, ANL estimated the costs and energy use characteristics of six possible energy system options for supplying Energy Park's space heating, space cooling, and domestic hot water heating needs. The results indicate that in today's economy, a central heating and cooling plant with natural gas boilers and electrically driven centrifugal chillers with thermal storage has good potential for energy and economic savings and clearly merits further consideration.

  4. Kappa distribution in the presence of a potential energy

    NASA Astrophysics Data System (ADS)

    Livadiotis, George

    2015-02-01

    The present paper develops the theory and formulations of the kappa distributions that describe particle systems characterized by a nonzero potential energy. As yet, kappa distributions were used for the statistical description of the velocity or kinetic energy of particles but not of the potential energy. With the results provided here, it is straightforward to use the developed kappa distributions to describe any particle population of space plasmas subject to a nonnegligible potential energy. Starting from the kappa distribution of the Hamiltonian function, we develop the distributions that describe either the complete phase space or the marginal spaces of positions and velocities. The study shows, among others: (a) The kappa distributions of velocities that describe space plasmas can be vastly different from the standard formulation of the kappa distribution, because of the presence of a potential energy; the correct formulation should be given by the marginal kappa distribution of velocities by integrating the distribution of the Hamiltonian over the potential energy. (b) The long-standing problem of the divergence of the Boltzmannian exponential distribution for bounded radial potentials is solved using kappa distributions of negative kappa index. (c) Anisotropic distributions of velocities can exist in the presence of a velocity-dependent potential. (d) A variety of applications, including derivations/verifications of the following: (i) the Jeans', the most frequent, and the maximum radii in spherical/linear gravitational potentials; (ii) the Virial theorem for power law potentials; (iii) the generalized barometric formula, (iv) the plasma density profiles in Saturnian magnetosphere, and (v) the average electron magnetic moment in Earth's magnetotail.

  5. Oxygen ordering and mobility in ReBa 2Cu 3O 6+x by elastic energy loss and modulus measurements

    NASA Astrophysics Data System (ADS)

    Canali, M.; Cannelli, G.; Cantelli, R.; Cordero, F.; Ferretti, M.; Trequattrini, F.

    1991-12-01

    It is reported on new anelastic relaxation measurements in ReBa 2Cu 3O 6+x for 0elastic energy dissipation observed above room temperature are interpreted in that framework. A new structural phase transition around 480 K is observed.

  6. Framework for State-Level Renewable Energy Market Potential Studies

    SciTech Connect

    Kreycik, C.; Vimmerstedt, L.; Doris, E.

    2010-01-01

    State-level policymakers are relying on estimates of the market potential for renewable energy resources as they set goals and develop policies to accelerate the development of these resources. Therefore, accuracy of such estimates should be understood and possibly improved to appropriately support these decisions. This document provides a framework and next steps for state officials who require estimates of renewable energy market potential. The report gives insight into how to conduct a market potential study, including what supporting data are needed and what types of assumptions need to be made. The report distinguishes between goal-oriented studies and other types of studies, and explains the benefits of each.

  7. Communication: Separable potential energy surfaces from multiplicative artificial neural networks

    SciTech Connect

    Koch, Werner Zhang, Dong H.

    2014-07-14

    We present a potential energy surface fitting scheme based on multiplicative artificial neural networks. It has the sum of products form required for efficient computation of the dynamics of multidimensional quantum systems with the multi configuration time dependent Hartree method. Moreover, it results in analytic potential energy matrix elements when combined with quantum dynamics methods using Gaussian basis functions, eliminating the need for a local harmonic approximation. Scaling behavior with respect to the complexity of the potential as well as the requested accuracy is discussed.

  8. Communication: Separable potential energy surfaces from multiplicative artificial neural networks

    NASA Astrophysics Data System (ADS)

    Koch, Werner; Zhang, Dong H.

    2014-07-01

    We present a potential energy surface fitting scheme based on multiplicative artificial neural networks. It has the sum of products form required for efficient computation of the dynamics of multidimensional quantum systems with the multi configuration time dependent Hartree method. Moreover, it results in analytic potential energy matrix elements when combined with quantum dynamics methods using Gaussian basis functions, eliminating the need for a local harmonic approximation. Scaling behavior with respect to the complexity of the potential as well as the requested accuracy is discussed.

  9. Separable representation of energy-dependent optical potentials

    NASA Astrophysics Data System (ADS)

    Hlophe, L.; Elster, Ch.

    2016-03-01

    Background: One important ingredient for many applications of nuclear physics to astrophysics, nuclear energy, and stockpile stewardship are cross sections for reactions of neutrons with rare isotopes. Since direct measurements are often not feasible, indirect methods, e.g., (d ,p ) reactions, should be used. Those (d ,p ) reactions may be viewed as three-body reactions and described with Faddeev techniques. Purpose: Faddeev equations in momentum space have a long tradition of utilizing separable interactions in order to arrive at sets of coupled integral equations in one variable. Optical potentials representing the effective interactions in the neutron (proton) nucleus subsystem are usually non-Hermitian as well as energy dependent. Potential matrix elements as well as transition matrix elements calculated with them must fulfill the reciprocity theorem. The purpose of this paper is to introduce a separable, energy-dependent representation of complex, energy-dependent optical potentials that fulfill reciprocity exactly. Methods: Momentum space Lippmann-Schwinger integral equations are solved with standard techniques to obtain the form factors for the separable representation. Results: Starting from a separable, energy-independent representation of global optical potentials based on a generalization of the Ernst-Shakin-Thaler (EST) scheme, a further generalization is needed to take into account the energy dependence. Applications to n +48Ca ,n +208Pb , and p +208Pb are investigated for energies from 0 to 50 MeV with special emphasis on fulfilling reciprocity. Conclusions: We find that the energy-dependent separable representation of complex, energy-dependent phenomenological optical potentials fulfills reciprocity exactly. In addition, taking into account the explicit energy dependence slightly improves the description of the S matrix elements.

  10. A triangular element based on generalized potential energy concepts

    NASA Technical Reports Server (NTRS)

    Thomas, G. R.; Gallagher, R. H.

    1976-01-01

    Stiffness equations are formulated for a doubly-curved triangular thin shell finite element. The strain energy component of the potential energy is first expressed in terms of displacements and displacement gradients with the aid of consistent deep shell strain-displacement equations. The element in-plane and normal displacement fields are approximated by complete cubic polynomials. These functions do not satisfy the interelement displacement admissibility conditions. Satisfaction is forced by the imposition of constraint conditions on the interelement boundaries; the constraints represent the modification of the potential energy. Some numerical results for a pinched cylinder, a cylindrical sphere, and a pinched sphere are examined.

  11. Renewable energy potential in Bulgaria - Some computer simulations results

    NASA Astrophysics Data System (ADS)

    Ganev, K.; Jordanov, G.; Gadzhev, G.; Miloshev, N.; Syrakov, D.; Prodanova, M.

    2014-11-01

    The paper presents a work, which aims at numerical study of the wind and solar energy potential of the country. The wind/solar energy fields simulations were performed applying the 5th generation PSU/NCAR Meso-Meteorological Model MM5 for years 2000-2007 with a spatial resolution of 3 km over Bulgaria. The computer simulated data base is large and rather comprehensive. In this sense it can be considered as statistically significant ensemble. This allows statistical treatment in order various wind and solar energy potential evaluations to be retrieved from the data base. Some evaluations of the country wind and solar energy potential, based on the simulation output are demonstrated in the paper.

  12. Electron-Hydrogen Elastic Scattering

    NASA Technical Reports Server (NTRS)

    Bhatia, A. K.

    2004-01-01

    Scattering by single-electron systems is always of interest because the wave function of the target is known exactly. Various approximations have been employed to take into account distortion produced in the target. Among them are the method of polarized orbitals and the close coupling approximation. Recently, e-H and e-He+ S-wave scattering in the elastic region has been studied using the Feshbach projection operator formalism. In this approach, the usual Hartree-Fock and exchange potentials are augmented by an optical potential and the resulting phase shifts have rigorous lower bounds. Now this method is being applied to the e-H P-wave scattering in the elastic region. The number of terms in the Hylleraas-type wave function for the 1,3 P phase shifts is 84 and the resulting phase shifts (preliminary) are given. The results have been given up to five digits because to that accuracy they are rigorous lower bounds. They are in general agreement with the variational (VAR) results of Armstead, and those obtained from the intermediate energy R-matrix method (RM) of Scholz et al., and the finite element method (FEM) of Botero and Shertzer. The later two methods do not provide any bounds on phase shifts.

  13. Testing excited-state energy-density functionals and potentials with the ionization potential theorem

    NASA Astrophysics Data System (ADS)

    Harbola, Manoj; Myneni, Hemanadhan; Shamim, Md.

    2014-03-01

    The modified local spin density functional and the related local potential for excited-states are tested by employing the ionization potential theorem. The functional is constructed by splitting k-space. Since its functional derivative cannot be obtained easily, the corresponding potential is given by analogy to its ground-state counterpart. Further, to calculate the highest occupied orbital energy ɛmax accurately, the potential is corrected for its asymptotic behavior by employing the van Leeuwen-Barends correction to it. The highest occupied orbital energy ɛmax thus obtained is then compared with the ΔSCF ionization energy calculated using the excited-state functional. It is shown that the two match quite accurately, demonstrating thereby that our approach of constructing excited-state functional is on sound footing.

  14. A hierarchy of potential energy surfaces constructed from energies and energy derivatives calculated on grids

    NASA Astrophysics Data System (ADS)

    Matito, Eduard; Toffoli, Daniele; Christiansen, Ove

    2009-04-01

    In this work we develop and test a methodology for the generation of Born-Oppenheimer potential energy surfaces (PES) for use in vibrational structure calculations. The method relies on the widely used restricted-mode-coupling expansion of the fully coupled potential surface where only up to n or less vibrational coordinates are coupled in the potential. Low-order derivatives of the energy are then used to extrapolate the higher mode-coupling potential terms; derivative information is thus used in a convenient way for the evaluation of higher mode couplings avoiding their explicit calculation on multidimensional grids. The formulation, which is a variant of the popular modified Shepard interpolation, is general for any extrapolation of (n +p)-mode-coupling terms from n-mode couplings and can be applied to the energy or any other molecular property surface for which derivative information is available. The method depends only on analytical parameter-free weight functions that satisfy important limiting conditions and control the contribution from each direction of extrapolation. The procedure has been applied on a representative set of 13 molecules, and its accuracy has been tested using only gradients and using both gradients and Hessians. The results provide evidence for the importance of higher mode couplings and illustrate the cost efficiency of the proposed approach.

  15. The energy of naturally curved elastic rods with an application to the stretching and contraction of a free helical spring as a model for DNA

    SciTech Connect

    Manning, Gerald S.

    2015-09-14

    We give a contemporary and direct derivation of a classical, but insufficiently familiar, result in the theory of linear elasticity—a representation for the energy of a stressed elastic rod with central axis that intrinsically takes the shape of a general space curve. We show that the geometric torsion of the space curve, while playing a crucial role in the bending energy, is physically unrelated to the elastic twist. We prove that the twist energy vanishes in the lowest-energy states of a rod subject to constraints that do not restrict the twist. The stretching and contraction energies of a free helical spring are computed. There are local high-energy minima. We show the possibility of using the spring to model the chirality of DNA. We then compare our results with an available atomic level energy simulation that was performed on DNA unconstrained in the same sense as the free spring. We find some possible reflections of springlike behavior in the mechanics of DNA, but, unsurprisingly, the base pairs lend a material substance to the core of DNA that a spring does not capture.

  16. The energy of naturally curved elastic rods with an application to the stretching and contraction of a free helical spring as a model for DNA

    NASA Astrophysics Data System (ADS)

    Manning, Gerald S.

    2015-09-01

    We give a contemporary and direct derivation of a classical, but insufficiently familiar, result in the theory of linear elasticity—a representation for the energy of a stressed elastic rod with central axis that intrinsically takes the shape of a general space curve. We show that the geometric torsion of the space curve, while playing a crucial role in the bending energy, is physically unrelated to the elastic twist. We prove that the twist energy vanishes in the lowest-energy states of a rod subject to constraints that do not restrict the twist. The stretching and contraction energies of a free helical spring are computed. There are local high-energy minima. We show the possibility of using the spring to model the chirality of DNA. We then compare our results with an available atomic level energy simulation that was performed on DNA unconstrained in the same sense as the free spring. We find some possible reflections of springlike behavior in the mechanics of DNA, but, unsurprisingly, the base pairs lend a material substance to the core of DNA that a spring does not capture.

  17. Potential for energy conservation in the glass industry

    SciTech Connect

    Garrett-Price, B.A.; Fassbender, A.G.; Bruno, G.A.

    1986-06-01

    While the glass industry (flat glass, container glass, pressed and blown glass, and insulation fiber glass) has reduced its specific energy use (Btu/ton) by almost 30% since 1972, significant potential for further reduction still remains. State-of-the-art technologies are available which could lead to incremental improvements in glass industry energy productivity; however, these technologies must compete for capital with projects undertaken for other reasons (e.g., capacity expansion, equipment rebuild, labor cost reduction, product quality improvement, or compliance with environmental, health or safety regulations). Narrowing profit margins in the large tonnage segments of the glass industry in recent years and the fact that energy costs represent less than 25% of the value added in glass manufacture have combined to impede the widespread adoption of many state-of-the-art conservation technologies. Savings in energy costs alone have not provided the incentive to justify the capital expenditures required to realize the energy savings. Beyond implementation of state-of-the-art technologies, significant potential energy savings could accrue from advanced technologies which represent a radical departure from current glass making technology. Long-term research and development (R and D) programs, which address the technical and economic barriers associated with advanced, energy-conserving technologies, offer the opportunity to realize this energy-saving potential.

  18. Calculation of molecular free energies in classical potentials

    NASA Astrophysics Data System (ADS)

    Farhi, Asaf; Singh, Bipin

    2016-02-01

    Free energies of molecules can be calculated by quantum chemistry computations or by normal mode classical calculations. However, the first can be computationally impractical for large molecules and the second is based on the assumption of harmonic dynamics. We present a novel, accurate and complete calculation of molecular free energies in standard classical potentials. In this method we transform the molecule by relaxing potential terms which depend on the coordinates of a group of atoms in that molecule and calculate the free energy difference associated with the transformation. Then, since the transformed molecule can be treated as non-interacting systems, the free energy associated with these atoms is analytically or numerically calculated. This two-step calculation can be applied to calculate free energies of molecules or free energy difference between (possibly large) molecules in a general environment. We demonstrate the method in free energy calculations for methanethiol and butane molecules in vacuum and solvent. We suggest the potential application of free energy calculation of chemical reactions in classical molecular simulations.

  19. Solar energy in California industry - Applications, characteristics and potential

    NASA Technical Reports Server (NTRS)

    Barbieri, R. H.; Pivirotto, D. S.

    1978-01-01

    Results of a survey to determine the potential applicability of solar thermal energy to industrial processes in California are presented. It is found that if the heat for all industrial processes at temperatures below 212 F were supplied by solar energy, total state energy consumption could be reduced by 100 trillion Btus (2%), while the use of solar energy in processes between 212 and 350 F could displace 500 trillion Btus. The issues and problems with which solar energy must contend are illustrated by a description of fluid milk processing operations. Solar energy application is found to be technically feasible for processes with thermal energy requirements below 212 F, with design, and degree of technical, economic and management feasibility being site specific. It is recommended that the state provide support for federal and industrial research, development and demonstration programs in order to stimulate acceptance of solar process heat application by industry.

  20. The potential energy surface of H2 16O

    NASA Astrophysics Data System (ADS)

    Polyansky, Oleg L.; Jensen, Per; Tennyson, Jonathan

    1996-10-01

    We report here a new determination of the H216O potential energy surface from experimental data. The calculations have been carried out by means of the very accurate and highly efficient method proposed and applied to H216O in a previous paper [Polyansky, Jensen, and Tennyson, J. Chem. Phys. 101, 7651 (1994)]. This previous work has been significantly improved by inclusion of additional terms in the analytical expression used to represent the potential energy surface. Previously, 1600 rotation-vibration term values for H216O were fitted with a standard deviation of 0.36 cm-1. With the extended model of the present work, this standard deviation could be improved to 0.25 cm-1. With the extended model and the new fitted potential function we have calculated a data set comprising 3200 term values, all of which can be compared with experimentally derived values. The standard deviation for this data set is 0.6 cm-1. The data set contains rotationally excited energy levels for all the 63 vibrational states which have been characterized by high resolution spectroscopy. The potential energy function obtained in the present work improves drastically the agreement with experiment for the highly excited local mode stretching states above 20 000 cm-1. For the vibrational band origins of these states, the highest of which is measured at 25 118 cm-1, our previous fitted potential produced discrepancies of more than 100 cm-1. These deviations are reduced to less than 1 cm-1 by the potential energy function of the present work. We show that no significant improvement of the fit can be obtained by extending the analytical expression for the potential energy by further high-order terms. An analysis of the residuals shows that at the level of accuracy achieved, the major contribution to the error originates in the neglect of nonadiabatic correction terms in the Born-Oppenheimer kinetic energy operator. We conclude that any further improvement of the potential energy surface requires that such correction terms be included in the Hamiltonian. With the present potential, reliable extrapolations towards higher rotational and vibrational energies can be carried out, and we expect that such calculations can be very helpful in the assignment of experimental spectra involving highly excited states.

  1. The HCO{sup +}–H{sub 2} van der Waals interaction: Potential energy and scattering

    SciTech Connect

    Massó, H.; Wiesenfeld, L.

    2014-11-14

    We compute the rigid-body, four-dimensional interaction potential between HCO{sup +} and H{sub 2}. The ab initio energies are obtained at the coupled-cluster single double triple level of theory, corrected for Basis Set Superposition Errors. The ab initio points are fit onto the spherical basis relevant for quantum scattering. We present elastic and rotationally inelastic coupled channels scattering between low lying rotational levels of HCO{sup +} and para-/ortho-H{sub 2}. Results are compared with similar earlier computations with He or isotropic para-H{sub 2} as the projectile. Computations agree with earlier pressure broadening measurements.

  2. Split kinetic energy method for quantum systems with competing potentials

    SciTech Connect

    Mineo, H.; Chao, Sheng D.

    2012-09-15

    For quantum systems with competing potentials, the conventional perturbation theory often yields an asymptotic series and the subsequent numerical outcome becomes uncertain. To tackle such a kind of problems, we develop a general solution scheme based on a new energy dissection idea. Instead of dividing the potential energy into 'unperturbed' and 'perturbed' terms, a partition of the kinetic energy is performed. By distributing the kinetic energy term in part into each individual potential, the Hamiltonian can be expressed as the sum of the subsystem Hamiltonians with respective competing potentials. The total wavefunction is expanded by using a linear combination of the basis sets of respective subsystem Hamiltonians. We first illustrate the solution procedure using a simple system consisting of a particle under the action of double {delta}-function potentials. Next, this method is applied to the prototype systems of a charged harmonic oscillator in strong magnetic field and the hydrogen molecule ion. Compared with the usual perturbation approach, this new scheme converges much faster to the exact solutions for both eigenvalues and eigenfunctions. When properly extended, this new solution scheme can be very useful for dealing with strongly coupling quantum systems. - Highlights: Black-Right-Pointing-Pointer A new basis set expansion method is proposed. Black-Right-Pointing-Pointer Split kinetic energy method is proposed to solve quantum eigenvalue problems. Black-Right-Pointing-Pointer Significant improvement has been obtained in converging to exact results. Black-Right-Pointing-Pointer Extension of such methods is promising and discussed.

  3. Global Onshore Wind Energy Potential and Its Uncertainties

    NASA Astrophysics Data System (ADS)

    Zhou, Y.; Clarke, L.; Luckow, P.; Smith, S.

    2011-12-01

    Wind power, a clean and renewable energy resource, can play an important role in providing energy and reducing greenhouse gas emissions. Yet there are substantial and important uncertainties about the potential costs and supplies of wind that influence our ability to understand today the strategic role of wind power in the future. A detailed global assessment of onshore wind energy potential and its uncertainties will help decision-makers develop policies and strategies to meet energy and environmental goals. In this study, we assess the technical and economic potential of onshore wind energy and its spatial distribution using reanalysis wind speed data from the National Centers for Environmental Modeling (Figure 1). The study focuses in particular in exploring a range of uncertainties that impact the economic potential of wind power by constructing quantitative scenarios for eight key physical and economic parameters. We present quantification of the impact of uncertainties in these parameters, focusing on areas relevant to geoscience research (Figure 2). The amount of economic potential of wind energy depends strongly on several uncertain parameters such as wind speed, turbine cost, and land-suitability. The distribution of wind speed at fine temporal and spatial scales is a key parameter, but is not well quantified in many regions of the world. Reanalysis datasets with more accurate wind fields are a first step, along with computationally tractable downscaling methodologies. Another key assumption is land-suitability, which is the fraction of a particular land-cover type assumed to be available for wind farm development. There is currently little scientific basis for land-suitability assumptions. While some of the data needed for progress in these areas is readily available, such as high-resolution land-cover and terrain data, further advances are likely to require new methodologies and inter-disciplinary collaboration. We outline a number of areas where further research is needed to construct improved estimates of global wind energy potential.

  4. Optimizing potential energy functions for maximal intrinsic hyperpolarizability

    SciTech Connect

    Zhou Juefei; Szafruga, Urszula B.; Kuzyk, Mark G.; Watkins, David S.

    2007-11-15

    We use numerical optimization to study the properties of (1) the class of one-dimensional potential energy functions and (2) systems of point nuclei in two dimensions that yield the largest intrinsic hyperpolarizabilities, which we find to be within 30% of the fundamental limit. In all cases, we use a one-electron model. It is found that a broad range of optimized potentials, each of very different character, yield the same intrinsic hyperpolarizability ceiling of 0.709. Furthermore, all optimized potential energy functions share common features such as (1) the value of the normalized transition dipole moment to the dominant state, which forces the hyperpolarizability to be dominated by only two excited states and (2) the energy ratio between the two dominant states. All optimized potentials are found to obey the three-level ansatz to within about 1%. Many of these potential energy functions may be implementable in multiple quantum well structures. The subset of potentials with undulations reaffirm that modulation of conjugation may be an approach for making better organic molecules, though there appear to be many others. Additionally, our results suggest that one-dimensional molecules may have larger diagonal intrinsic hyperpolarizability {beta}{sub xxx}{sup int} than higher-dimensional systems.

  5. Comparison of elastic scattering spectroscopy with histology in ex vivo prostate glands: potential application for optically guided biopsy and directed treatment.

    PubMed

    A'Amar, O M; Liou, L; Rodriguez-Diaz, E; De las Morenas, A; Bigio, I J

    2013-09-01

    The false-negative rate of ultrasound-guided sextant prostate biopsy has been estimated to be as high as 35 %. A significant percentage (10-35 %) of these prostate cancers diagnosed at a second or later attempt are high grade and, therefore, potentially lethal. We discuss the feasibility for performing optically guided biopsy using elastic scattering spectroscopy (ESS) to reduce sampling errors and improve sensitivity. ESS measurements were performed on 42 prostate glands ex vivo and correlated with standard histopathological assessment. Sliced glands were examined with wavelength ranges of 330-760 nm. The ESS portable system used a new fiber-optic probe with integrated cutting tool, designed specifically for ex vivo pathology applications. ESS spectra were grouped by diagnosis from standard histopathological procedure and then classified using linear support vector machine. Preliminary data are encouraging. ESS data showed strong spectral trends correlating with the histopathological assignments. The classification results showed a sensitivity of 0.83 and specificity of 0.87 for distinguishing dysplastic prostatic tissue from benign prostatic tissue. Similar results were obtained for distinguishing dysplastic prostatic tissue from prostatitis with a sensitivity and specificity of 0.80 and 0.88, respectively. The negative predictive values obtained with ESS are better than those obtained with transrectal ultrasound (TRUS)-guided core-needle biopsy. PMID:23247663

  6. Polarization effects in low-energy electron-CH sub 4 elastic collisions in an exact exchange treatment

    SciTech Connect

    Jain, A.; Weatherford, C.A. ); Thompson, D.G.; McNaughten, P. )

    1989-12-01

    We have investigated the polarization effects in very-low-energy (below 1 eV) electron- CH{sub 4} collisions in an exact-exchange treatment. The two models of the parameter-free polarization potential are employed; one, the {ital V}{sub pol}{sup JT} potential, introduced by Jain and Thompson (J. Phys. B 15, L631 (1982)), is based on an approximate polarized-orbital method, and two, the correlation-polarization potential {ital V}{sub pol}{sup CP}, first proposed by O'Connel and Lane (Phys. Rev. A 27, 1893 (1983)), is given as a simple analytic form in terms of the charge density of the target. In this rather very low-energy region, the polarization effects play a decisive role, particularly in creating structure in the differential cross section (DCS) and producing the Ramsauer-Townsend minimum in the total cross section. Our DCS at 0.2, 0.4, and 0.6 eV are compared with recent measurements. We found that a local parameter-free approximation for the polarization potential is quite successful if it is determined under the polarized-orbital-type technique rather than based on the correlation-polarization approach.

  7. Wind energy potential analysis in Al-Fattaih-Darnah

    NASA Astrophysics Data System (ADS)

    Tjahjana, Dominicus Danardono Dwi Prija; Salem, Abdelkarim Ali; Himawanto, Dwi Aries

    2016-03-01

    In this paper the wind energy potential in Al-Fattaih-Darnah, Libya, had been studied. Wind energy is very attractive because it can provide a clean and renewable energy. Due mostly to the uncertainty caused by the chaotic characteristics of wind near the earth's surface, wind energy characteristic need to be investigated carefully in order to get consistent power generation. This investigation was based on one year wind data measured in 2003. As a result of the analysis, wind speed profile and wind energy potential have been developed. The wind energy potential of the location is looked very promising to generate electricity. The annual wind speed of the site is 8.21 m/s and the wind speed carrying maximum energy is 7.97 m/s. The annual power density of the site is classified into class 3. The Polaris P50-500 wind turbine can produce 768.39 M Wh/year and has capacity factor of 17.54%.

  8. Differential, total, and transport cross sections for elastic scattering of low energy positrons by neutral atoms (Z = 1--92, E = 500--4000 eV)

    SciTech Connect

    Dapor, M.; Miotello, A.

    1998-05-01

    The authors present tables of the differential, total, and transport cross sections for the elastic scattering of 500--4000 eV positrons by neutral atoms in the atomic number range Z = 1--92. The cross sections were computed by numerically solving the Dirac equation for a central electrostatic field up to a large radius where the atomic potential becomes negligible. The atomic potential used was Hartree-Fock for Z = 1--18 and Dirac-Hartree-Fock-Slater for Z = 19--92.

  9. Saturation wind power potential and its implications for wind energy.

    PubMed

    Jacobson, Mark Z; Archer, Cristina L

    2012-09-25

    Wind turbines convert kinetic to electrical energy, which returns to the atmosphere as heat to regenerate some potential and kinetic energy. As the number of wind turbines increases over large geographic regions, power extraction first increases linearly, but then converges to a saturation potential not identified previously from physical principles or turbine properties. These saturation potentials are >250 terawatts (TW) at 100 m globally, approximately 80 TW at 100 m over land plus coastal ocean outside Antarctica, and approximately 380 TW at 10 km in the jet streams. Thus, there is no fundamental barrier to obtaining half (approximately 5.75 TW) or several times the world's all-purpose power from wind in a 2030 clean-energy economy. PMID:23019353

  10. Saturation wind power potential and its implications for wind energy

    PubMed Central

    Jacobson, Mark Z.; Archer, Cristina L.

    2012-01-01

    Wind turbines convert kinetic to electrical energy, which returns to the atmosphere as heat to regenerate some potential and kinetic energy. As the number of wind turbines increases over large geographic regions, power extraction first increases linearly, but then converges to a saturation potential not identified previously from physical principles or turbine properties. These saturation potentials are >250 terawatts (TW) at 100 m globally, approximately 80 TW at 100 m over land plus coastal ocean outside Antarctica, and approximately 380 TW at 10 km in the jet streams. Thus, there is no fundamental barrier to obtaining half (approximately 5.75 TW) or several times the world’s all-purpose power from wind in a 2030 clean-energy economy. PMID:23019353

  11. Collisionless Plasma Modeling in an Arbitrary Potential Energy Distribution

    NASA Technical Reports Server (NTRS)

    Liemohn, M. W.; Khazanov, G. V.

    1997-01-01

    A new technique for calculating a collisionless plasma along a field line is presented. The primary feature of the new model is that it can handle an arbitrary (including nonmonotonic) potential energy distribution. This was one of the limiting constraints on the existing models in this class, and these constraints are generalized for an arbitrary potential energy composition. The formulation for relating current density to the field-aligned potential as well as formulas for density, temperature and energy flux calculations are presented for several distribution functions, ranging from a bi-Lorentzian with a loss cone to an isotropic Maxwellian. A comparison of these results with previous models shows that the formulation reduces.to the earlier models under similar assumptions.

  12. Potential function and dissociation energy of alkali halide

    NASA Astrophysics Data System (ADS)

    Srivastava, Abhay P.; Pandey, Anjani K.; Pandey, Brijesh K.

    2016-05-01

    Dissociation energy of some alkali halides have been calculated by using different interaction potential function such as Born-Mayer, Varshani-Shukla and L5 potential model. The theoretical calculation is compared with experimental values. The Result shows that the values of dissociation energy as calculated by using different potential models have an equal amount of deviation with experimental values. The above said deviation with experimental values can be explained by consideration of rotational-vibrational coupling between the constituents of molecules in the limelight of molecular spectroscopy. Findings of present work suggest that the existing potential model need to be reviewed in view of the correction factors solely depending on the rotational, vibrational and electronic coupling between the constituents of molecules.

  13. Calculating vibrational spectra using modified Shepard interpolated potential energy surfaces

    NASA Astrophysics Data System (ADS)

    Evenhuis, Christian R.; Manthe, Uwe

    2008-07-01

    A potential energy interpolation approach based on modified Shepard interpolation and specifically designed for calculation of vibrational states is presented. The importance of the choice of coordinates for the rate of convergence is demonstrated. Studying the vibrational states of the water molecule as a test case, a coordinate system comprised of inverse bond distances and trigonometric functions of the bond angle is found to be particularly efficient. Different sampling schemes used to locate the reference points in the modified Shepard interpolation are investigated. A final scheme is recommended, which allows the construction of potential energy surfaces to sub-wave-number accuracy.

  14. Potential structural material problems in a hydrogen energy system

    NASA Technical Reports Server (NTRS)

    Gray, H. R.; Nelson, H. G.; Johnson, R. E.; Mcpherson, B.; Howard, F. S.; Swisher, J. H.

    1975-01-01

    Potential structural material problems that may be encountered in the three components of a hydrogen energy system - production, transmission/storage, and utilization - were identified. Hydrogen embrittlement, corrosion, oxidation, and erosion may occur during the production of hydrogen. Hydrogen embrittlement is of major concern during both transmission and utilization of hydrogen. Specific materials research and development programs necessary to support a hydrogen energy system are described.

  15. Potential structural material problems in a hydrogen energy system

    NASA Technical Reports Server (NTRS)

    Gray, H. R.; Nelson, H. G.; Johnson, R. E.; Mcpherson, W. B.; Howard, F. S.; Swisher, J. H.

    1976-01-01

    Potential structural material problems that may be encountered in the three components of a hydrogen energy system - production, transmission/storage, and utilization - have been identified. Hydrogen embrittlement, corrosion, oxidation, and erosion may occur during the production of hydrogen. Hydrogen embrittlement is of major concern during both transmission and utilization of hydrogen. Specific materials research and development programs necessary to support a hydrogen energy system are described. An awareness of probable shortages of strategic materials has been maintained in these suggested programs.

  16. Reaction Path Optimization with Holonomic Constraints and Kinetic Energy Potentials

    SciTech Connect

    Brokaw, Jason B.; Haas, Kevin R.; Chu, Jhih-wei

    2009-08-11

    Two methods are developed to enhance the stability, efficiency, and robustness of reaction path optimization using a chain of replicas. First, distances between replicas are kept equal during path optimization via holonomic constraints. Finding a reaction path is, thus, transformed into a constrained optimization problem. This approach avoids force projections for finding minimum energy paths (MEPs), and fast-converging schemes such as quasi-Newton methods can be readily applied. Second, we define a new objective function - the total Hamiltonian - for reaction path optimization, by combining the kinetic energy potential of each replica with its potential energy function. Minimizing the total Hamiltonian of a chain determines a minimum Hamiltonian path (MHP). If the distances between replicas are kept equal and a consistent force constant is used, then the kinetic energy potentials of all replicas have the same value. The MHP in this case is the most probable isokinetic path. Our results indicate that low-temperature kinetic energy potentials (<5 K) can be used to prevent the development of kinks during path optimization and can significantly reduce the required steps of minimization by 2-3 times without causing noticeable differences between a MHP and MEP. These methods are applied to three test cases, the C₇eq-to-Cax isomerization of an alanine dipeptide, the ⁴C₁- to-¹C₄ transition of an α-D-glucopyranose, and the helix-to-sheet transition of a GNNQQNY heptapeptide. By applying the methods developed in this work, convergence of reaction path optimization can be achieved for these complex transitions, involving full atomic details and a large number of replicas (>100). For the case of helix-to-sheet transition, we identify pathways whose energy barriers are consistent with experimental measurements. Further, we develop a method based on the work energy theorem to quantify the accuracy of reaction paths and to determine whether the atoms used to define a path are enough to provide quantitative estimation of energy barriers.

  17. Reference pressure changes and available potential energy in isobaric coordinates

    NASA Technical Reports Server (NTRS)

    Robertson, F. R.

    1985-01-01

    A formulation of the available potential energy (APE) equation in isobaric coordinates which alleviates the need for computing temporal derivatives of reference pressure and describes how work done relates to changes in the APE of a limited region is presented. The APE budget equation possesses terms analogous to those in Johnson's (1970) isentropic version. It is shown that APE changes result from either mechanical work inside the domain or an exchange of energy via boundary processes with the surrounding environment.

  18. Pseudo-Casimir stresses and elasticity of a confined elastomer film.

    PubMed

    Lu, Bing-Sui; Naji, Ali; Podgornik, Rudolf

    2016-05-11

    Investigations of the elastic behavior of bulk elastomers have traditionally proceeded on the basis of classical rubber elasticity, which regards chains as thermally fluctuating but disregards the thermal fluctuations of the cross-links. Herein, we consider an incompressible and flat elastomer film of an axisymmetric shape confined between two large hard co-planar substrates, with the axis of the film perpendicular to the substrates. We address the impact that thermal fluctuations of the cross-links have on the free energy of elastic deformation of the system, subject to the requirement that the fluctuating elastomer cannot detach from the substrates. We examine the behavior of the deformation free energy for one case where a rigid pinning boundary condition is applied to a class of elastic fluctuations at the confining surfaces, and another case where the same elastic fluctuations are subjected to soft "gluing" potentials. We find that there can be significant departures (both quantitative and qualitative) from the prediction of classical rubber elasticity theory when elastic fluctuations are included. Finally, we compare the character of the attractive part of the elastic fluctuation-induced, or pseudo-Casimir, stress with the standard thermal Casimir stress in confined but non-elastomeric systems, finding the same power law decay behavior when a rigid pinning boundary condition is applied; for the case of the gluing potential, we find that the leading order correction to the attractive part of the fluctuation stress decays inversely with the inter-substrate separation. PMID:27079513

  19. Renewable energy technologies adoption in Kazakhstan: potentials, barriers and solutions

    NASA Astrophysics Data System (ADS)

    Karatayev, Marat; Marazza, Diego; Contin, Andrea

    2015-04-01

    The growth in environmental pollution alongside an increasing demand for electricity in Kazakhstan calls for a higher level of renewable energy penetration into national power systems. Kazakhstan has great potential for renewable energies from wind, solar, hydro and biomass resources that can be exploited for electricity production. In 2013, the Kazakhstani Ministry of Energy initiated a new power development plan, which aims to bring the share of renewable energy to 3% by 2020 rising to 30% by 2030 and 50% by 2050. The current contribution of renewable energy resources in the national electricity mix, however, is less than 1%. As a developing country, Kazakhstan has faced a number of barriers to increase renewable energy use, which have to be analysed and translated into a comprehensive renewable energy policy framework. This study presents an overview of the current conditions of renewable energy development in Kazakhstan. Secondly, it identifies and describes the main barriers that prevent diffusion of renewable energy technologies in Kazakhstan. Finally, the paper provides solutions to overcome specific barriers in order to successfully develop a renewable energy technology sector in Kazakhstan.

  20. Hydroelastic response and energy harvesting potential of flexible piezoelectric beams in viscous flow

    NASA Astrophysics Data System (ADS)

    Akcabay, Deniz Tolga; Young, Yin Lu

    2012-05-01

    Electroactive polymers such as piezoelectric elements are able to generate electric potential differences from induced mechanical deformations. They can be used to build devices to harvest ambient energy from natural flow-induced deformations, e.g., as flapping flags subject to flowing wind or artificial seaweed subject to waves or underwater currents. The objectives of this study are to (1) investigate the transient hydroelastic response and energy harvesting potential of flexible piezoelectric beams fluttering in incompressible, viscous flow, and (2) identify critical non-dimensional parameters that govern the response of piezoelectric beams fluttering in viscous flow. The fluid-structure interaction response is simulated using an immersed boundary approach coupled with a finite volume solver for incompressible, viscous flow. The effects of large beam deformation, membrane tension, and coupled electromechanical responses are all considered. Validation studies are shown for the motion of a flexible filament in uniform flow, and for a piezoelectric beam subject to base vibration. The predicted flutter velocities and frequencies also compared well with published experimental and numerical data over a range of Reynolds numbers for varying fluid and solid combinations. The results showed that for a heavy beam in a light fluid (i.e., high βρ regime), flutter incepts at a lower critical speed with a lower reduced frequency than for a light beam in a heavy fluid (i.e., low βρ regime). In the high βρ regime, flutter develops at the second mode and is only realized when the fluid inertial forces are in balance with the solid elastic restoring forces, which leads to large amplitude oscillations and complex wake patterns; the flutter speed is practically independent of the Reynolds number (Re) and solid to fluid mass ratio (βρ), because the response is dominated by the solid inertial forces. In the low βρ regime, fluid inertial forces dominate, flutter develops at higher modes and is only realized when the solid inertial forces are proportioned to the solid elastic restoring forces; the flutter speed depends on both Re and βρ, and viscous force and beam tension effects tend to delay flutter and reduce vibration amplitudes, leading to thinner, more simplified wake patterns. The results demonstrate that energy extraction via fluttering piezoelectric beams is possible. The overall efficiency was observed to be influenced by the piezoelectric circuit resistance, which is known to be directly related to the square of the piezoelectric coupling factor. The results show that the maximum strain limit of piezoelectrics may be exceeded, and hence careful optimization of the material and geometry is recommended to maximize the energy capture for a given range of expected flow conditions while satisfying safety and reliability requirements.

  1. LHC Physics Potential vs. Energy: Considerations for the 2011 Run

    SciTech Connect

    Quigg, Chris; /Fermilab /CERN

    2011-02-01

    Parton luminosities are convenient for estimating how the physics potential of Large Hadron Collider experiments depends on the energy of the proton beams. I quantify the advantage of increasing the beam energy from 3.5 TeV to 4 TeV. I present parton luminosities, ratios of parton luminosities, and contours of fixed parton luminosity for gg, u {bar d}, qq, and gq interactions over the energy range relevant to the Large Hadron Collider, along with example analyses for specific processes. This note extends the analysis presented in Ref. [1]. Full-size figures are available as pdf files at lutece.fnal.gov/PartonLum11/.

  2. Pseudospectral Gaussian quantum dynamics: Efficient sampling of potential energy surfaces.

    PubMed

    Heaps, Charles W; Mazziotti, David A

    2016-04-28

    Trajectory-based Gaussian basis sets have been tremendously successful in describing high-dimensional quantum molecular dynamics. In this paper, we introduce a pseudospectral Gaussian-based method that achieves accurate quantum dynamics using efficient, real-space sampling of the time-dependent basis set. As in other Gaussian basis methods, we begin with a basis set expansion using time-dependent Gaussian basis functions guided by classical mechanics. Unlike other Gaussian methods but characteristic of the pseudospectral and collocation methods, the basis set is tested with N Dirac delta functions, where N is the number of basis functions, rather than using the basis function as test functions. As a result, the integration for matrix elements is reduced to function evaluation. Pseudospectral Gaussian dynamics only requires O(N) potential energy calculations, in contrast to O(N(2)) evaluations in a variational calculation. The classical trajectories allow small basis sets to sample high-dimensional potentials. Applications are made to diatomic oscillations in a Morse potential and a generalized version of the Henon-Heiles potential in two, four, and six dimensions. Comparisons are drawn to full analytical evaluation of potential energy integrals (variational) and the bra-ket averaged Taylor (BAT) expansion, an O(N) approximation used in Gaussian-based dynamics. In all cases, the pseudospectral Gaussian method is competitive with full variational calculations that require a global, analytical, and integrable potential energy surface. Additionally, the BAT breaks down when quantum mechanical coherence is particularly strong (i.e., barrier reflection in the Morse oscillator). The ability to obtain variational accuracy using only the potential energy at discrete points makes the pseudospectral Gaussian method a promising avenue for on-the-fly dynamics, where electronic structure calculations become computationally significant. PMID:27131532

  3. Unified Technical Concepts. Module 7: Potential and Kinetic Energy.

    ERIC Educational Resources Information Center

    Technical Education Research Center, Waco, TX.

    This concept module on potential and kinetic energy is one of thirteen modules that provide a flexible, laboratory-based physics instructional package designed to meet the specialized needs of students in two-year, postsecondary technical schools. Each of the thirteen concept modules discusses a single physics concept and how it is applied to each…

  4. Teaching Field Concept and Potential Energy at A-Level.

    ERIC Educational Resources Information Center

    Poon, C. H.

    1986-01-01

    Argues for a greater emphasis on the reality of fields in electronics and gravitation instruction. Advocates that the potential energy in a system be regarded as stored in the field rather than in the material bodies of the system. Provides a rationale and examples for this position. (ML)

  5. Unified Technical Concepts. Module 7: Potential and Kinetic Energy.

    ERIC Educational Resources Information Center

    Technical Education Research Center, Waco, TX.

    This concept module on potential and kinetic energy is one of thirteen modules that provide a flexible, laboratory-based physics instructional package designed to meet the specialized needs of students in two-year, postsecondary technical schools. Each of the thirteen concept modules discusses a single physics concept and how it is applied to each

  6. Potentials and policy implications of energy and material efficiency improvement

    SciTech Connect

    Worrell, Ernst; Levine, Mark; Price, Lynn; Martin, Nathan; van den Broek, Richard; Block, Kornelis

    1997-01-01

    There is a growing awareness of the serious problems associated with the provision of sufficient energy to meet human needs and to fuel economic growth world-wide. This has pointed to the need for energy and material efficiency, which would reduce air, water and thermal pollution, as well as waste production. Increasing energy and material efficiency also have the benefits of increased employment, improved balance of imports and exports, increased security of energy supply, and adopting environmentally advantageous energy supply. A large potential exists for energy savings through energy and material efficiency improvements. Technologies are not now, nor will they be, in the foreseeable future, the limiting factors with regard to continuing energy efficiency improvements. There are serious barriers to energy efficiency improvement, including unwillingness to invest, lack of available and accessible information, economic disincentives and organizational barriers. A wide range of policy instruments, as well as innovative approaches have been tried in some countries in order to achieve the desired energy efficiency approaches. These include: regulation and guidelines; economic instruments and incentives; voluntary agreements and actions, information, education and training; and research, development and demonstration. An area that requires particular attention is that of improved international co-operation to develop policy instruments and technologies to meet the needs of developing countries. Material efficiency has not received the attention that it deserves. Consequently, there is a dearth of data on the qualities and quantities for final consumption, thus, making it difficult to formulate policies. Available data, however, suggest that there is a large potential for improved use of many materials in industrialized countries.

  7. Global Potential of Energy Efficiency Standards and Labeling Programs

    SciTech Connect

    McNeil, Michael A; McNeil, Michael A.; Letschert, Virginie; de la Rue du Can, Stephane

    2008-06-15

    This report estimates the global potential reductions in greenhouse gas emissions by 2030 for energy efficiency improvements associated with equipment (appliances, lighting, and HVAC) in buildings by means of energy efficiency standards and labels (EES&L). A consensus has emerged among the world's scientists and many corporate and political leaders regarding the need to address the threat of climate change through emissions mitigation and adaptation. A further consensus has emerged that a central component of these strategies must be focused around energy, which is the primary generator of greenhouse gas emissions. Two important questions result from this consensus: 'what kinds of policies encourage the appropriate transformation to energy efficiency' and 'how much impact can these policies have'? This report aims to contribute to the dialogue surrounding these issues by considering the potential impacts of a single policy type, applied on a global scale. The policy addressed in this report is Energy Efficient Standards and Labeling (EES&L) for energy-consuming equipment, which has now been implemented in over 60 countries. Mandatory energy performance standards are important because they contribute positively to a nation's economy and provide relative certainty about the outcome (both timing and magnitudes). Labels also contribute positively to a nation's economy and importantly increase the awareness of the energy-consuming public. Other policies not analyzed here (utility incentives, tax credits) are complimentary to standards and labels and also contribute in significant ways to reducing greenhouse gas emissions. We believe the analysis reported here to be the first systematic attempt to evaluate the potential of savings from EES&L for all countries and for such a large set of products. The goal of the analysis is to provide an assessment that is sufficiently well-quantified and accurate to allow comparison and integration with other strategies under consideration.

  8. High elastic modulus polymer electrolytes

    DOEpatents

    Balsara, Nitash Pervez; Singh, Mohit; Eitouni, Hany Basam; Gomez, Enrique Daniel

    2013-10-22

    A polymer that combines high ionic conductivity with the structural properties required for Li electrode stability is useful as a solid phase electrolyte for high energy density, high cycle life batteries that do not suffer from failures due to side reactions and dendrite growth on the Li electrodes, and other potential applications. The polymer electrolyte includes a linear block copolymer having a conductive linear polymer block with a molecular weight of at least 5000 Daltons, a structural linear polymer block with an elastic modulus in excess of 1.times.10.sup.7 Pa and an ionic conductivity of at least 1.times.10.sup.-5 Scm.sup.-1. The electrolyte is made under dry conditions to achieve the noted characteristics.

  9. Elastic and hierarchical porous carbon nanofibrous membranes incorporated with NiFe2O4 nanocrystals for highly efficient capacitive energy storage.

    PubMed

    Ge, Jianlong; Fan, Gang; Si, Yang; He, Jianxin; Kim, Hak-Yong; Ding, Bin; Al-Deyab, Salem S; El-Newehy, Mohamed; Yu, Jianyong

    2016-01-21

    Flexible membranes created from porous carbon nanofibers (CNFs) hold great promise in the next generation wearable energy storage devices, but challenges still remain due to the poor mechanical properties of porous carbon nanofibers. Here, we report a facile strategy to fabricate elastic and hierarchical porous CNF membranes with NiFe2O4 nanocrystals embedded via multicomponent electrospinning and nano-doping methods. Benefiting from the scattering effect of NiFe2O4 nanocrystals and graphitized carbon layers for the condensed stress, the resultant CNF membranes exhibit an enhanced elasticity with a bending radius <12 μm, rapid recovery from the deformations, and a superior softness. Quantitative pore size distribution and fractal analysis reveal that the CNFs possessed tunable porous structures with a high surface area of 493 m(2) g(-1) and a pore volume of 0.31 cm(3) g(-1). Benefiting from the robust mechanical stability, hierarchical porous structures and good electrochemical properties, the NiFe2O4 doped CNF membranes demonstrate a high electrical capacitance of 343 F g(-1), and good reversibility with a cycling efficiency of 97.4% even after 10 000 cycles. The successful synthesis of elastic porous CNF membranes also provided a versatile platform for the design and development of functional CNF based materials for various applications. PMID:26731700

  10. Combined experimental and theoretical study on the differential elastic scattering cross sections for acetone by electron impact energy of 7.0-50 eV

    NASA Astrophysics Data System (ADS)

    Pastega, D. F.; Lange, E.; Ameixa, J.; Barbosa, A. S.; Blanco, F.; García, G.; Bettega, M. H. F.; Limão-Vieira, P.; Ferreira da Silva, F.

    2016-03-01

    We report elastic differential cross sections (DCSs) for electron interactions with acetone, C3H6O . The incident electron energy range was 7.0-50 eV, and the scattered electron angular range for the differential measurements varied from 10° to 120°. The calculated cross sections were obtained with two different methodologies, the Schwinger multichannel method with pseudopotentials (SMCPP), and the independent-atom method with screening-corrected additivity rule (IAM-SCAR). The present elastic DCSs have been found to agree well with the results of IAM-SCAR calculations above 20 eV, and also with the SMC calculations below 30 eV. Although some discrepancies were found for lower energies, the agreement between the SMCPP data and the DCSs obtained with the IAM-SCAR method improves, as expected, as the impact energy increases. Comparison with previous DCSs shows good agreement albeit the present data is extended down to lower electron impact energies. We find a low-lying π* shape resonance located at 2.6 eV, in agreement with recent results on electron collisions with acetone [M. G. P. Homem et al., Phys. Rev. A 92, 032711 (2015), 10.1103/PhysRevA.92.032711]. The presence of a σ* resonance is also discussed.

  11. Understanding Potential Climate Variability Impacts on the Offshore Energy Industry

    NASA Astrophysics Data System (ADS)

    Stear, J.

    2014-12-01

    Climate variability may have important implications for the offshore energy industry. Scenarios of increased storm activity and changes in sea level could require the retrofit of existing offshore platforms and coastal infrastructure, the decommissioning of facilities for which upgrade or relocation is not economically viable, and the development of new methods and equipment which are removed from or less sensitive to environmental loads. Over the past years the energy industry has been actively involved in collaborative research efforts with government and academia to identify the potential changes in the offshore operating environment, and corresponding risk implications. This presentation will review several of these efforts, and for several of the hypothetical climate variation scenarios, review the potential impacts on and possible mitigations for offshore and coastal energy infrastructure and operations.

  12. Contrastive studies of potential energy functions of some diatomic molecules

    NASA Astrophysics Data System (ADS)

    Abdallah, Hassan H.; Abdullah, Hewa Y.

    2016-03-01

    It was proposed that iron hydride, FeH, would be formed only on grains at the clouds through the reaction of the adsorbed H atoms or H2 molecules with the adsorbed Fe atoms on the grains. The importance of FeH in Astrophysics presents an additional motivation to study its energetic, spectroscopic constants and Potential Energy Curves. The structural optimization for ground state of FeH was calculated by different theoretical methods, namely, Hartree-Fock (HF), the density functional theory (DFT), B3LYP, MP2 method and QCISD(T) methods and compared with available data from the literature. The single ionized forms, cation and anion, were also obtained at the same level of calculations. Charges, dipole moment, geometrical parameters, molecular orbital energies and spectroscopic parameters were calculated and reported. In addition, the molecular ionization potential, electron affinity and dissociation energy were investigated.

  13. Three-dimensional potential energy surface of Ar–CO

    SciTech Connect

    Sumiyoshi, Yoshihiro; Endo, Yasuki

    2015-01-14

    A three-dimensional intermolecular potential energy surface of the Ar–CO complex has been determined by fitting most of the previously reported spectroscopic data, where observed transition frequencies by microwave, millimeter-wave, submillimeter-wave, and infrared spectroscopy were reproduced simultaneously within their experimental accuracies. A free rotor model Hamiltonian considering all the freedom of motions for an atom-diatom system was applied to calculate vibration-rotation energies. A three-dimensional potential energy surface obtained by ab initio calculations at the CCSD(T)-F12b/aug-cc-pV5Z level of theory was parameterized by a model function consisting of 46 parameters. They were used as initial values for the least-squares analysis of the experimental data. A total of 20 parameters were optimized to reproduce all the spectroscopic data.

  14. Heterobarrier for converting hot-phonon energy to electric potential

    NASA Astrophysics Data System (ADS)

    Shin, Seungha; Melnick, Corey; Kaviany, Massoud

    2013-02-01

    We show that hot phonons emitted in energy conversion or resistive processes can be converted to electric potential in heterobarrier structures. Using phonon and electron interaction kinetics and self-consistent ensemble Monte Carlo, we find the favorable conditions for unassisted absorption of hot phonons and design graded heterobarriers for their direct conversion into electric energy. Tandem barriers with nearly optical-phonon height allow for substantial potential gain without current loss. We find that 19% of hot phonons can be harvested with an optimized GaAs/AlxGa1-xAs barrier structure over a range of current and electron densities, thus enhancing the overall energy conversion efficiency and reducing waste heat.

  15. Turkey's High Temperature Geothermal Energy Resources and Electricity Production Potential

    NASA Astrophysics Data System (ADS)

    Bilgin, .

    2012-04-01

    Turkey is in the first 7 countries in the world in terms of potential and applications. Geothermal energy which is an alternative energy resource has advantages such as low-cost, clean, safe and natural resource. Geothermal energy is defined as hot water and steam which is formed by heat that accumulated in various depths of the Earth's crust; with more than 20oC temperature and which contain more than fused minerals, various salts and gases than normal underground and ground water. It is divided into three groups as low, medium and high temperature. High-temperature fluid is used in electricity generation, low and medium temperature fluids are used in greenhouses, houses, airport runways, animal farms and places such as swimming pools heating. In this study high temperature geothermal fields in Turkey which is suitable for electricity production, properties and electricity production potential was investigated.

  16. N2(+) bound quartet and sextet state potential energy curves

    NASA Technical Reports Server (NTRS)

    Partridge, H.; Bauschlicher, C. W., Jr.; Stallcop, J. R.

    1985-01-01

    The N2(+) potential energies have been determined from a complete active space self-consistent field calculation with active 2s and 2p electrons. A (6s 4p 3d 1f) Gaussian basis set was used together with additional higher angular momentum and diffuse functions. The calculated potential energy curves for the states 4Sigma(mu)(+), 4Pi(g), and 6Sigma(g)(+), for which there are no spectroscopic observations, are presented. The corresponding spectroscopic constants have been determined from a polynomial curve fit to the computed energies near the well minima and are shown. The 6Sigma(g)(+) state is found to be significantly bound, with a minimum at 1.72 A.

  17. Role of the clean energy potential for energy savings and air pollution control in Turkey

    SciTech Connect

    Kaygusuz, K.; Kargi, H.; Kaygusuz, A.

    1996-12-01

    This article begins with a brief review of the technical potential, the regional distribution, and the air pollution effects of all fossil energy sources as well as of all clean and renewable energy sources that could be used in Turkey. Air pollution levels due to fossil fuel consumption are examined. In this context, the role of clean energy sources is indicated.

  18. Technical Potential of Solar Energy to Address Energy Poverty and Avoid GHG Emissions in Africa

    SciTech Connect

    Cowlin, S. C.; Heimiller, D.; Bilello, D.; Renne, D.

    2008-01-01

    This analysis explores the technical potential of photovoltaics (PV) or concentrating solar power (CSP) to address energy poverty in Africa through a geographic information system (GIS) screening of solar resource data developed by the U.S. Department of Energy's National Renewable Energy Laboratory (NREL).

  19. U.S. Building-Sector Energy Efficiency Potential

    SciTech Connect

    Brown, Rich; Borgeson, Sam; Koomey, Jon; Biermayer, Peter

    2008-09-30

    This paper presents an estimate of the potential for energy efficiency improvements in the U.S. building sector by 2030. The analysis uses the Energy Information Administration's AEO 2007 Reference Case as a business-as-usual (BAU) scenario, and applies percentage savings estimates by end use drawn from several prior efficiency potential studies. These prior studies include the U.S. Department of Energy's Scenarios for a Clean Energy Future (CEF) study and a recent study of natural gas savings potential in New York state. For a few end uses for which savings estimates are not readily available, the LBNL study team compiled technical data to estimate savings percentages and costs of conserved energy. The analysis shows that for electricity use in buildings, approximately one-third of the BAU consumption can be saved at a cost of conserved energy of 2.7 cents/kWh (all values in 2007 dollars), while for natural gas approximately the same percentage savings is possible at a cost of between 2.5 and 6.9 $/million Btu. This cost-effective level of savings results in national annual energy bill savings in 2030 of nearly $170 billion. To achieve these savings, the cumulative capital investment needed between 2010 and 2030 is about $440 billion, which translates to a 2-1/2 year simple payback period, or savings over the life of the measures that are nearly 3.5 times larger than the investment required (i.e., a benefit-cost ratio of 3.5).

  20. Temperature mechanisms of the interaction of dislocations with impurities in the processes of transfer of the energy of elastic vibrations

    NASA Astrophysics Data System (ADS)

    Sobol', V. R.; Logvinovich, P. N.; Bel'Skii, S. E.; Blokhin, A. V.

    2007-07-01

    The influence of microplasticity caused by the motion of dislocation segments on the propagation of elastic vibrations in structural materials is considered. It is shown that the character of motion of a dislocation segment exerts its effect on the propagation velocity of an acoustic wave. This fact should be taken into account when nonstationary frequency-phase methods of measuring the physical parameters of a medium are used.

  1. Proton (antiproton) elastic scattering at energies from FNAL to the LHC in the tripole Pomeron-Odderon model

    NASA Astrophysics Data System (ADS)

    Martynov, E.

    2013-06-01

    The model of elastic scattering amplitudes dominated by the triple (at t=0) Pomeron pole suggested earlier is modified to confront to existing experimental data on pp and p¯p total and differential cross sections at s≥19GeV and |t|≤14.2GeV2 including the newest TOTEM data. Predictions for the future TOTEM measurements at 13 and 14 TeV are given.

  2. Contribution of elastic tissues to the mechanics and energetics of muscle function during movement.

    PubMed

    Roberts, Thomas J

    2016-01-01

    Muscle force production occurs within an environment of tissues that exhibit spring-like behavior, and this elasticity is a critical determinant of muscle performance during locomotion. Muscle force and power output both depend on the speed of contraction, as described by the isotonic force-velocity curve. By influencing the speed of contractile elements, elastic structures can have a profound effect on muscle force, power and work. In very rapid movements, elastic mechanisms can amplify muscle power by storing the work of muscle contraction slowly and releasing it rapidly. When energy must be dissipated rapidly, such as in landing from a jump, energy stored rapidly in elastic elements can be released more slowly to stretch muscle contractile elements, reducing the power input to muscle and possibly protecting it from damage. Elastic mechanisms identified so far rely primarily on in-series tendons, but many structures within muscles exhibit spring-like properties. Actomyosin cross-bridges, actin and myosin filaments, titin, and the connective tissue scaffolding of the extracellular matrix all have the potential to store and recover elastic energy during muscle contraction. The potential contribution of these elements can be assessed from their stiffness and estimates of the strain they undergo during muscle function. Such calculations provide boundaries for the possible roles these springs might play in locomotion, and may help to direct future studies of the uses of elastic elements in muscle. PMID:26792339

  3. An exploration of the ozone dimer potential energy surface

    SciTech Connect

    Azofra, Luis Miguel; Alkorta, Ibon; Scheiner, Steve

    2014-06-28

    The (O{sub 3}){sub 2} dimer potential energy surface is thoroughly explored at the ab initio CCSD(T) computational level. Five minima are characterized with binding energies between 0.35 and 2.24 kcal/mol. The most stable may be characterized as slipped parallel, with the two O{sub 3} monomers situated in parallel planes. Partitioning of the interaction energy points to dispersion and exchange as the prime contributors to the stability, with varying contributions from electrostatic energy, which is repulsive in one case. Atoms in Molecules analysis of the wavefunction presents specific O⋯O bonding interactions, whose number is related to the overall stability of each dimer. All internal vibrational frequencies are shifted to the red by dimerization, particularly the antisymmetric stretching mode whose shift is as high as 111 cm{sup −1}. In addition to the five minima, 11 higher-order stationary points are identified.

  4. An exploration of the ozone dimer potential energy surface

    NASA Astrophysics Data System (ADS)

    Azofra, Luis Miguel; Alkorta, Ibon; Scheiner, Steve

    2014-06-01

    The (O3)2 dimer potential energy surface is thoroughly explored at the ab initio CCSD(T) computational level. Five minima are characterized with binding energies between 0.35 and 2.24 kcal/mol. The most stable may be characterized as slipped parallel, with the two O3 monomers situated in parallel planes. Partitioning of the interaction energy points to dispersion and exchange as the prime contributors to the stability, with varying contributions from electrostatic energy, which is repulsive in one case. Atoms in Molecules analysis of the wavefunction presents specific O⋯O bonding interactions, whose number is related to the overall stability of each dimer. All internal vibrational frequencies are shifted to the red by dimerization, particularly the antisymmetric stretching mode whose shift is as high as 111 cm-1. In addition to the five minima, 11 higher-order stationary points are identified.

  5. An exploration of the ozone dimer potential energy surface.

    PubMed

    Azofra, Luis Miguel; Alkorta, Ibon; Scheiner, Steve

    2014-06-28

    The (O3)2 dimer potential energy surface is thoroughly explored at the ab initio CCSD(T) computational level. Five minima are characterized with binding energies between 0.35 and 2.24 kcal/mol. The most stable may be characterized as slipped parallel, with the two O3 monomers situated in parallel planes. Partitioning of the interaction energy points to dispersion and exchange as the prime contributors to the stability, with varying contributions from electrostatic energy, which is repulsive in one case. Atoms in Molecules analysis of the wavefunction presents specific O⋯O bonding interactions, whose number is related to the overall stability of each dimer. All internal vibrational frequencies are shifted to the red by dimerization, particularly the antisymmetric stretching mode whose shift is as high as 111 cm(-1). In addition to the five minima, 11 higher-order stationary points are identified. PMID:24985642

  6. NVU dynamics. III. Simulating molecules at constant potential energy

    NASA Astrophysics Data System (ADS)

    Ingebrigtsen, Trond S.; Dyre, Jeppe C.

    2012-12-01

    This is the final paper in a series that introduces geodesic molecular dynamics at constant potential energy. This dynamics is entitled NVU dynamics in analogy to standard energy-conserving Newtonian NVE dynamics. In the first two papers [T. S. Ingebrigtsen, S. Toxvaerd, O. J. Heilmann, T. B. Schrøder, and J. C. Dyre, J. Chem. Phys. 135, 104101 (2011), 10.1063/1.3623585; T. S. Ingebrigtsen, S. Toxvaerd, T. B. Schrøder, and J. C. Dyre, J. Chem. Phys. 135, 104102 (2011), 10.1063/1.3623586], a numerical algorithm for simulating geodesic motion of atomic systems was developed and tested against standard algorithms. The conclusion was that the NVU algorithm has the same desirable properties as the Verlet algorithm for Newtonian NVE dynamics, i.e., it is time-reversible and symplectic. Additionally, it was concluded that NVU dynamics becomes equivalent to NVE dynamics in the thermodynamic limit. In this paper, the NVU algorithm for atomic systems is extended to be able to simulate the geodesic motion of molecules at constant potential energy. We derive an algorithm for simulating rigid bonds and test this algorithm on three different systems: an asymmetric dumbbell model, Lewis-Wahnström o-terphenyl (OTP) and rigid SPC/E water. The rigid bonds introduce additional constraints beyond that of constant potential energy for atomic systems. The rigid-bond NVU algorithm conserves potential energy, bond lengths, and step length for indefinitely long runs. The quantities probed in simulations give results identical to those of Nosé-Hoover NVT dynamics. Since Nosé-Hoover NVT dynamics is known to give results equivalent to those of NVE dynamics, the latter results show that NVU dynamics becomes equivalent to NVE dynamics in the thermodynamic limit also for molecular systems.

  7. Systematic CDCC calculations for 11Be + p elastic scattering

    NASA Astrophysics Data System (ADS)

    Chen, Jie; Lou, JianLing; Pang, DanYang; Ye, YanLin

    2016-03-01

    Continuum discretised coupled-channels (CDCC) method with a 10Be(0+) + n two-body cluster model is applied to systematically analyze the elastic scattering of the halo nucleus 11Be from the proton target at various incident energies below 100 MeV/nucleon. Using the renormalized 10Be- p potential deduced from the 10Be + p elastic scattering data, the differential cross sections of 11Be + p scattering are well reproduced by the CDCC calculations without any further adjustment parameters, demonstrating the applicability of this approach for describing the scattering of exotic nuclei based on the scattering of the less exotic core nuclei.

  8. Evaluation of global onshore wind energy potential and generation costs.

    PubMed

    Zhou, Yuyu; Luckow, Patrick; Smith, Steven J; Clarke, Leon

    2012-07-17

    In this study, we develop an updated global estimate of onshore wind energy potential using reanalysis wind speed data, along with updated wind turbine technology performance, land suitability factors, cost assumptions, and explicit consideration of transmission distance in the calculation of transmission costs. We find that wind has the potential to supply a significant portion of the world energy needs, although this potential varies substantially by region and with assumptions such as on what types of land can be used to site wind farms. Total global economic wind potential under central assumptions, that is, intermediate between optimistic and pessimistic, is estimated to be approximately 119.5 petawatt hours per year (13.6 TW) at less than 9 cents/kWh. A sensitivity analysis of eight key parameters is presented. Wind potential is sensitive to a number of input parameters, particularly wind speed (varying by -70% to +450% at less than 9 cents/kWh), land suitability (by -55% to +25%), turbine density (by -60% to +80%), and cost and financing options (by -20% to +200%), many of which have important policy implications. As a result of sensitivities studied here we suggest that further research intended to inform wind supply curve development focus not purely on physical science, such as better resolved wind maps, but also on these less well-defined factors, such as land-suitability, that will also have an impact on the long-term role of wind power. PMID:22715929

  9. Potential for luminosity improvement for low-energy RHIC operation

    SciTech Connect

    Fedotov A. V.

    2012-05-20

    At the Brookhaven National Laboratory, a physics program, motivated by the search of the QCD phase transition critical point, requires operation of the Relativistic Heavy Ion Collider (RHIC) with heavy ions at very low beam energies corresponding to 2.5-20 GeV/n. Several physics runs were already successfully performed at these low energies. However, the luminosity is very low at lowest energies of interest (< 10 GeV/n) limited by the intra-beam scattering and space-charge, as well as by machine nonlinearities. At these low energies, electron cooling could be very effective in counteracting luminosity degradation due to the IBS, while it is less effective against other limitations. Overall potential luminosity improvement for low-energy RHIC operation from cooling is summarized for various energies, taking into account all these limitations as well as beam lifetime measured during the low-energy RHIC runs. We also explore a possibility of further luminosity improvement under the space-charge limitation.

  10. A global potential energy surface for ArH2

    NASA Technical Reports Server (NTRS)

    Schwenke, David W.; Walch, Stephen P.; Taylor, Peter R.

    1993-01-01

    We describe a simple analytic representation of the ArH2 potential energy surface which well reproduces the results of extensive ab initio electronic structure calculations. The analytic representation smoothly interpolates between the dissociated H2 and strong bonding limits. In the fitting process, emphasis is made on accurately reproducing regions of the potential expected to be important for high temperature (ca. 3000 K) collision processes. Overall, the anisotropy and H2 bond length dependence of the analytic representation well reproduce the input data.

  11. A global potential energy surface for ArH2

    NASA Technical Reports Server (NTRS)

    Schwenke, David W.; Walch, Stephen P.; Taylor, Peter R.

    1992-01-01

    We describe a simple analytic representation of the ArH2 potential energy surface which well reproduces the results of extensive ab initio electronic structure calculations. The analytic representation smoothly interpolates between the dissociated H2 and strong bonding limits. In the fitting process, emphasis is made on accurately reproducing regions of the potential expected to be important for high temperature (ca. 3000 K) collision processes. Overall, the anisotropy and H2 bond length dependence of the analytic representation well reproduce the input data.

  12. Quintom dark energy models with nearly flat potentials

    SciTech Connect

    Setare, M. R.; Saridakis, E. N.

    2009-02-15

    We examine quintom dark energy models, produced by the combined consideration of a canonical and a phantom field, with nearly flat potentials and dark energy equation-of-state parameter w{sub DE} close to -1. We find that all such models converge to a single expression for w{sub DE}(z), depending only on the initial field values and their derivatives. We show that this quintom paradigm allows for a description of the transition through -1 in the near cosmological past. In addition, we provide the necessary conditions for the determination of the direction of the -1 crossing.

  13. Bifurcations on Potential Energy Surfaces of Organic Reactions

    PubMed Central

    Ess, Daniel H.; Wheeler, Steven E.; Iafe, Robert G.; Xu, Lai; Çelebi-Ölçüm, Nihan; Houk, K. N.

    2009-01-01

    A single transition state may lead to multiple intermediates or products if there is a post-transition state reaction path bifurcation. These bifurcations arise when there are sequential transition states with no intervening energy minimum. For such systems, the shape of the potential energy surface and dynamic effects control selectivity rather than transition state energetics. This minireview covers recent investigations of organic reactions exhibiting reaction pathway bifurcations. Such phenomena are surprisingly general and affect experimental observables such as kinetic isotope effects and product distributions. PMID:18767086

  14. Elastic scattering measurement for the system 17O + 58Ni at Coulomb barrier energies with silicon strip detectors exploiting ASIC electronics

    NASA Astrophysics Data System (ADS)

    Signorini, C.; Mazzocco, M.; Molini, P.; Pierroutsakou, D.; Boiano, C.; Manea, C.; Strano, E.; Torresi, D.; Di Meo, P.; Nicoletto, M.; Boiano, A.; Glodariu, T.; Grebosz, J.; Guglielmetti, A.; La Commara, M.; Parascandolo, C.; Parascandolo, L.; Sandoli, M.; Soramel, F.; Stroe, L.; Toniolo, N.; Veronese, F.

    2013-03-01

    The quasi elastic scattering of a 17O projectile from a 58Ni target has been studied at beam energies ranging from 42.5 to 55.0 MeV in 2.5 MeV steps. The total reaction cross sections were derived from the measured angular distributions by using an optical model fit within the coupled-channel code FRESCO. These cross sections are very similar to those measured for 17F (loosely bound by 0.6 MeV), mirror nucleus of 17O (tightly bound by 4.14 MeV). This outcome points out that, in this energy range, the small binding energy of the 17F valence proton has negligible influence onto the reactivity of such a loosely bound projectile, contrary to simple expectations, and to what observed for other loosely bound nuclei. The reaction dynamics seems to be influenced mainly by the Coulomb interaction which is similar for both mirror projectiles.

  15. The Potential For Energy Efficiency In The State of Iowa

    SciTech Connect

    Hadley, SW

    2001-12-05

    The purpose of this study was to do an initial estimate of the potential for energy savings in the state of Iowa. Several methods for determining savings were examined, including existing programs, surveys, savings calculators, and economic simulation. Each method has advantages and disadvantages, trading off between detail of information, accuracy of results, and scope. This paper concentrated on using economic simulation (the NEMS model (EIA 2000a)) to determine market potential for energy savings for the residential and commercial sectors. The results of surveys were used to calculate the economic potential for savings in the industrial sector. The NEMS model is used by the Energy Information Administration to calculate twenty-year projections of energy use for every region of the country. The results of the Annual Energy Outlook 2000 were used as the Base case (EIA 1999a). Two alternative cases were created to simulate energy savings policies. Voluntary, market-related programs were simulated by lowering the effective discount rates that end-users use when making decisions on equipment purchases. Standards programs in the residential sector were simulated by eliminating the availability of low efficiency equipment in future years. The parameters for these programs were based on the Moderate scenario from the DOE Clean Energy Futures study (Interlaboratory Working Group 2000), which assumed increased concern by society on energy efficiency but not to the point of fiscal policies such as taxes or direct subsidies. The study only considered a subset of the various programs, policies, and technologies that could reduce energy use. The major end-uses in the residential sector affected by the policies were space cooling (20% savings by 2020) and water heating (14% savings by 2020.) Figure S-1 shows the space cooling savings when voluntary programs and minimum efficiency standards were implemented. Refrigerators, freezers, and clothes dryers saw slight improvements. The study did not involve changes to the building shell (e.g., increased insulation) or residential lighting improvements. Nevertheless, the residential sector's market potential for electrical energy savings was calculated to be 5.3% of expected electrical use, representing 850 GWh by 2020. Natural gas savings could be 2.4% of expected gas use, representing 2.1 trillion Btus. Using expected prices for energy in that year, these represent savings of $47 million and $12 million per year. In the commercial sector, the study only considered voluntary market-based policies for some of the technologies. The most notable savings were in ventilation (12% savings by 2020), lighting (12% savings), refrigeration (7% savings), water heating (6% savings), and space heating (5% savings by 2020). The commercial sector's market potential for electrical energy savings based on the programs modeled was calculated to be 5.1% of its total expected electrical use, representing 605 GWh of power by 2020. Natural gas savings were 2.3 trillion Btu, 3.7% of use. Using the same prices as the residential sector (5.5{cents}/kWh and $5.74/MBtu), the savings represent $33 million and $13 million per year, respectively.

  16. The potential impact of hydrogen energy use on the atmosphere

    NASA Astrophysics Data System (ADS)

    van Ruijven, B. J.; Lamarque, J. F.; van Vuuren, D. P.; Kram, T.; Eerens, H.

    2009-04-01

    Energy models show very different trajectories for future energy systems (partly as function of future climate policy). One possible option is a transition towards a hydrogen-based energy system. The potential impact of such hydrogen economy on atmospheric emissions is highly uncertain. On the one hand, application of hydrogen in clean fuel cells reduces emissions of local air pollutants, like SOx and NOx. On the other hand, emissions of hydrogen from system leakages are expected to change the atmospheric concentrations and behaviour (see also Price et al., 2007; Sanderson et al., 2003; Schultz et al., 2003; Tromp et al., 2003). The uncertainty arises from several sources: the expected use of hydrogen, the intensity of leakages and emissions, and the atmospheric chemical behaviour of hydrogen. Existing studies to the potential impacts of a hydrogen economy on the atmosphere mostly use hydrogen emission scenarios that are based on simple assumptions. This research combines two different modelling efforts to explore the range of impacts of hydrogen on atmospheric chemistry. First, the potential role of hydrogen in the global energy system and the related emissions of hydrogen and other air pollutants are derived from the global energy system simulation model TIMER (van Vuuren, 2007). A set of dedicated scenarios on hydrogen technology development explores the most pessimistic and optimistic cases for hydrogen deployment (van Ruijven et al., 2008; van Ruijven et al., 2007). These scenarios are combined with different assumptions on hydrogen emission factors. Second, the emissions from the TIMER model are linked to the NCAR atmospheric model (Lamarque et al., 2005; Lamarque et al., 2008), in order to determine the impacts on atmospheric chemistry. By combining an energy system model and an atmospheric model, we are able to consistently explore the boundaries of both hydrogen use, emissions and impacts on atmospheric chemistry. References: Lamarque, J.-F., Kiehl, J. T., Hess, P. G., Collins, W. D., Emmons, L. K., Ginoux, P., Luo, C. and Tie, X. X. (2005). "Response of a coupled chemistry-climate model to changes in aerosol emissions: Global impact on the hydrological cycle and the tropospheric burdens of OH, ozone and NOx." Geophysical Research Letters 32(16). Lamarque, J.-F., Kinnison, D. E., Hess, P. G. and Vitt, F. (2008). "Simulated lower stratospheric trends between 1970 and 2005: identifying the role of climate and composition changes." Journal of Geophysical Research 113(D12301). Price, H., Jaegle, L., Rice, A., Quay, P., Novelli, P. C. and Gammon, R. (2007). "Global budget of molecular hydrogen and its deuterium content: constraints from ground station, cruise, and aircraft observations." Journal of Geophysical Research 112(D22108). Sanderson, M. G., Collins, W. J., Derwent, R. G. and Johnson, C. E. (2003). "Simulation of Global Hydrogen Levels Using a Lagrangian Three-Dimensional Model." Journal of Atmospheric Chemistry 46(1): 15-28. Schultz, M. G., Diehl, T., Brasseur, G. P. and Zittel, W. (2003). "Air Pollution and Climate-Forcing Impacts of a Global Hydrogen Economy." Science 302(5645): 624-627. Tromp, T. K., Shia, R. L., Allen, M., Eiler, J. M. and Yung, Y. L. (2003). "Potential environmental impact of a hydrogen economy on the stratosphere." Science 300(5626): 1740-1742. van Ruijven, B., Hari, L., van Vuuren, D. P. and de Vries, B. (2008). "The potential role of hydrogen in India and Western Europe." Energy Policy 36(5): 1649-1665. van Ruijven, B., van Vuuren, D. P. and de Vries, B. (2007). "The potential role of hydrogen in energy systems with and without climate policy." International Journal of Hydrogen Energy 32(12): 1655-1672. van Vuuren, D. P. (2007). Energy systems and climate policy. Dept. of Science, Technology and Society, Faculty of Science. Utrecht, Utrecht University: 326.

  17. Electronic structure, molecular bonding and potential energy surfaces

    SciTech Connect

    Ruedenberg, K.

    1993-12-01

    By virtue of the universal validity of the generalized Born-Oppenheimer separation, potential energy surfaces (PES`) represent the central conceptual as well as quantitative entities of chemical physics and provide the basis for the understanding of most physicochemical phenomena in many diverse fields. The research in this group deals with the elucidation of general properties of PES` as well as with the quantitative determination of PES` for concrete systems, in particular pertaining to reactions involving carbon, oxygen, nitrogen and hydrogen molecules.

  18. MCSCF potential energy surface for photodissociation of formaldehyde

    NASA Technical Reports Server (NTRS)

    Jaffe, R. L.; Morokuma, K.

    1976-01-01

    The ground state potential energy surface for the dissociation of formaldehyde (H2CO to H2 and CO) is calculated with the ab initio MCSCF method with an extended (4-31G) basis set. The location, barrier height, and force constants of the transition state are determined, and the normal coordinate analysis is carried out. The calculated barrier height is 4.5 eV. Based on the calculated quantities, the detailed mechanism of the photochemical dissociation is discussed.

  19. Theoretical characterization of the potential energy surface for NH + NO

    NASA Technical Reports Server (NTRS)

    Walch, Stephen P.

    1993-01-01

    The potential energy surface for NH + NO was characterized using complete active space self-consistent field (CASSCF) gradient calculation to determine the stationary point geometries and frequencies followed by CASSCF/internally contracted configuration interaction calculations to refine the energetics. The present results are in qualitative accord with the BAC-MP4 calculations, but there are differences as large as 8 kcal/mol in the detailed energetics.

  20. Electron-impact rotationally elastic total cross sections for H{sub 2}CO and HCOOH over a wide range of incident energy (0.01-2000 eV)

    SciTech Connect

    Vinodkumar, Minaxi; Bhutadia, Harshad; Antony, Bobby; Mason, Nigel

    2011-11-15

    This paper reports computational results of the total cross sections for electron impact on H{sub 2}CO and HCOOH over a wide range of electron impact energies from 0.01 eV to 2 keV. The total cross section is presented as sum of the elastic and electronic excitation cross sections for incident energies. The calculation uses two different methodologies, below the ionization threshold of the target the cross section is calculated using the UK molecular R-matrix code through the Quantemol-N software package while cross sections at higher energies are evaluated using the spherical complex optical potential formalism. The two methods are found to be consistent at the transition energy ({approx}15 eV). The present results are, in general, found to be in good agreement with previous experimental and theoretical results (wherever available) and, thus, the present results can serve as a benchmark for the cross section over a wide range of energy.

  1. Elastic Properties of Graphene Nanomeshes

    NASA Astrophysics Data System (ADS)

    Ramasubramaniam, Ashwin; Carpenter, Corinne; Muniz, Andre; Maroudas, Dimitrios

    2014-03-01

    We report results on the elastic properties of graphene nanomeshes following a systematic analysis based on molecular-statics and molecular-dynamics simulations of uniaxial tensile deformation tests according to reliable bond-order classical interatomic potentials. Elastic properties are determined as a function of the nanomesh architecture, including the regular arrangement of pores in the nanomesh (pore lattice structure), pore morphology, nanomesh density (?), and pore edge passivation. We report scaling laws for the density dependence of the elastic modulus M and find that M scales with the square of the density, consistently with other cellular materials, for circular unpassivated pores over the range of temperature and nanomesh architectural parameters examined. We find that pore edge passivation strengthens the elastic moduli. The effects of passivation and pore morphology, namely, the aspect ratio of elliptical pores, on the M(?) scaling laws are analyzed in detail. Presently at University of California, Santa Barbara.

  2. Derivation of gravity wave potential energy density from NDMC measurements

    NASA Astrophysics Data System (ADS)

    Wüst, Sabine; Wendt, Verena; Schmidt, Carsten; Lichtenstern, Sabrina; Bittner, Michael; Yee, Jeng-Hwa; Mlynczak, Martin G.; Russell, James M., III

    2016-02-01

    Within the Network for the Detection of Mesospheric Change, NDMC, We present an algorithm for the estimation of potential energy density using measurements of five GRIPS instruments from 2011 to 2014 at three stations in central and one in Northern Europe. Nightly temperature variations are retrieved for periods shorter and longer than ca. 60 min applying an iterative approach of sliding means. Based on these results, monthly mean potential energy density is estimated for the short and the long periods. The Brunt-Väisälä frequency, which is necessary for its calculation, is taken from TIMED-SABER and CIRA-86 data. In order to justify the combination of TIMED-SABER and GRIPS data sets, temperature time series at the different stations are compared. Depending on the periods, an annual and/or semi-annual variation of potential energy density can be observed in most cases which agree quite well with other publications addressing the mesopause at mid-latitudes but relying on different techniques. The influence of the vertical extension of the OH*-layer and of the size of the field-of-view on the results is discussed. Finally, we show for the first time that GRIPS measurements, which take place at the same station but which are characterized through differing sizes of the fields of view, can provide additional information about the dominating horizontal wavelengths at mesopause heights.

  3. Assessment of Tidal Stream Energy Potential for the United States

    NASA Astrophysics Data System (ADS)

    Haas, K. A.; Defne, Z.; Jiang, L.; Fritz, H. M.

    2010-12-01

    Tidal streams are high velocity sea currents created by periodic horizontal movement of the tides, often magnified by local topographical features such as headlands, inlets to inland lagoons, and straits. Tidal stream energy extraction is derived from the kinetic energy of the moving flow; analogous to the way a wind turbine operates in air, and as such differs from tidal barrages, which relies on providing a head of water for energy extraction. With the constantly increasing effort in promoting alternative energy, tidal streams have become promising energy sources due to their continuous, predictable and concentrated characteristics. However, the present lack of a full spatial-temporal assessment of tidal currents for the U.S. coastline down to the scale of individual devices is a barrier to the comprehensive development of tidal current energy technology. A methodology for creating a national database of tidal stream energy potential, as well as a GIS tool usable by industry in order to accelerate the market for tidal energy conversion technology has been developed. The tidal flows are simulated using the Regional Ocean Modeling System (ROMS). The model is calibrated and validated using observations and tidal predictions. The calibration includes adjustments to model parameters such as bottom friction coefficient, changed land/water masks, or increased grid resolutions. A systematic validation process has been developed after defining various parameters to quantify the validation results. In order to determine the total tidal stream power resource, a common method frequently proposed is to estimate it as a fraction of the total kinetic energy flux passing through a vertical section; however, this now has been shown to generally underestimate the total available resource. The total tidal energy flux includes not just the kinetic energy but also the energy flux due to the work done by the pressure force associated with the tidal motion on the water column as well, which is frequently an order of magnitude larger. The numerical model provides the time series on a sufficiently high enough spatial resolution to utilize both the currents and mean water level (MWL) to compute the total energy flux entering estuary. The time variation of the available power for a few different estuaries will be evaluated and compared to estimates based on constant flow properties.

  4. Mashreq Arab interconnected power system potential for economic energy trading

    SciTech Connect

    Al-Shehri, A.M.; El-Amin, I.M.; Opoku, G.; Al-Baiyat, S.A.; Zedan, F.M.

    1994-12-01

    The Mashreq Arab countries covered in this study are Bahrain, Egypt, Jordan, Lebanon, Oman, Qatar, Saudi Arabia, Syria, the United Arab Emirates, and Yemen. A feasibility study for the interconnection of the electrical networks of the Mashreq Arab countries, sponsored by the Arab Fund, was completed in June 1992. Each country is served by one utility except Saudi Arabia, which is served by four major utilities and some smaller utilities serving remote towns and small load centers. The major utilities are the Saudi consolidated electric Company in the Eastern Province (SCECO East), SCECO Center, SCECO West, and SCECO South. These are the ones considered in this study. The Mashreq Arab region has a considerable mix of energy resources. Egypt and Syria have some limited amounts of hydropower resources, and the Arabian Gulf region is abundant in fossil fuel reserves. Owing to the differences in energy production costs, a potential exists for substantial energy trading between electric utilities in the region. The major objective of this project is to study the feasibility of electric energy trading between the Mashreq Arab countries. The basis, assumptions, and methodologies on which this energy trading study is based relate to the results and conclusions arising out of the previous study, power plant characteristics and costs, assumptions on economic parameters, rules for economy energy exchange, etc. This paper presents the basis, methodology, and major findings of the study.

  5. Data Network Equipment Energy Use and Savings Potential in Buildings

    SciTech Connect

    Lanzisera, Steven; Nordman, Bruce; Brown, Richard E.

    2010-06-09

    Network connectivity has become nearly ubiquitous, and the energy use of the equipment required for this connectivity is growing. Network equipment consists of devices that primarily switch and route Internet Protocol (IP) packets from a source to a destination, and this category specifically excludes edge devices like PCs, servers and other sources and sinks of IP traffic. This paper presents the results of a study of network equipment energy use and includes case studies of networks in a campus, a medium commercial building, and a typical home. The total energy use of network equipment is the product of the stock of equipment in use, the power of each device, and their usage patterns. This information was gathered from market research reports, broadband market penetration studies, field metering, and interviews with network administrators and service providers. We estimate that network equipment in the USA used 18 TWh, or about 1percent of building electricity, in 2008 and that consumption is expected to grow at roughly 6percent per year to 23 TWh in 2012; world usage in 2008 was 51 TWh. This study shows that office building network switches and residential equipment are the two largest categories of energy use consuming 40percent and 30percent of the total respectively. We estimate potential energy savings for different scenarios using forecasts of equipment stock and energy use, and savings estimates range from 20percent to 50percent based on full market penetration of efficient technologies.

  6. Potential system efficiencies for MEMS vibration energy harvesting

    NASA Astrophysics Data System (ADS)

    Behrens, S.

    2007-01-01

    Reliable power sources are needed for portable micro-electromechanical systems (MEMS) devices such as wireless automobile tire pressure sensors. Vibration is an ubiquitous energy source that maybe 'harvested' as electrical energy at the site of the MEMS device. Existing vibration energy harvesting systems use either a piezoelectric or an electromagnetic transducer to convert vibrations into electrical energy. This electrical energy is then conditioned using a passive rectifier dc-dc converter circuit. Such vibration harvesting techniques have focused on optimising circuit efficiency and, hence, have ignored the system efficiency i.e. mechanical-to-electrical efficiency. Results obtained in the laboratory can be extrapolated to predict potential system efficiencies for MEMS vibration energy harvesting systems. Results to date, using a standard speaker as the electromagnetic transducer, have demonstrated system efficiencies of greater than 14%. Initial estimates suggest a MEMS system efficiency of more than 80% could be achieved with a high performance transducer. Research is continuing to demonstrate these higher system efficiencies with the experimental apparatus.

  7. Potential energy surface of triplet N2O2.

    PubMed

    Varga, Zoltan; Meana-Pañeda, Rubén; Song, Guoliang; Paukku, Yuliya; Truhlar, Donald G

    2016-01-14

    We present a global ground-state triplet potential energy surface for the N2O2 system that is suitable for treating high-energy vibrational-rotational energy transfer and collision-induced dissociation. The surface is based on multi-state complete-active-space second-order perturbation theory/minimally augmented correlation-consistent polarized valence triple-zeta electronic structure calculations plus dynamically scaled external correlation. In the multireference calculations, the active space has 14 electrons in 12 orbitals. The calculations cover nine arrangements corresponding to dissociative diatom-diatom collisions of N2, O2, and nitric oxide (NO), the interaction of a triatomic molecule (N2O and NO2) with the fourth atom, and the interaction of a diatomic molecule with a single atom (i.e., the triatomic subsystems). The global ground-state potential energy surface was obtained by fitting the many-body interaction to 54 889 electronic structure data points with a fitting function that is a permutationally invariant polynomial in terms of bond-order functions of the six interatomic distances. PMID:26772574

  8. Potential energy surface of triplet N2O2

    NASA Astrophysics Data System (ADS)

    Varga, Zoltan; Meana-Pañeda, Rubén; Song, Guoliang; Paukku, Yuliya; Truhlar, Donald G.

    2016-01-01

    We present a global ground-state triplet potential energy surface for the N2O2 system that is suitable for treating high-energy vibrational-rotational energy transfer and collision-induced dissociation. The surface is based on multi-state complete-active-space second-order perturbation theory/minimally augmented correlation-consistent polarized valence triple-zeta electronic structure calculations plus dynamically scaled external correlation. In the multireference calculations, the active space has 14 electrons in 12 orbitals. The calculations cover nine arrangements corresponding to dissociative diatom-diatom collisions of N2, O2, and nitric oxide (NO), the interaction of a triatomic molecule (N2O and NO2) with the fourth atom, and the interaction of a diatomic molecule with a single atom (i.e., the triatomic subsystems). The global ground-state potential energy surface was obtained by fitting the many-body interaction to 54 889 electronic structure data points with a fitting function that is a permutationally invariant polynomial in terms of bond-order functions of the six interatomic distances.

  9. The Potential of Renewable Energy Sources in Latvia

    NASA Astrophysics Data System (ADS)

    Sakipova, S.; Jakovics, A.; Gendelis, S.

    2016-02-01

    The article discusses some aspects of the use of renewable energy sources in the climatic conditions prevailing in most of the territory of Latvia, with relatively low wind speeds and a small number of sunny days a year. The paper gives a brief description of the measurement equipment and technology to determine the parameters of the outer air; the results of the measurements are also analysed. On the basis of the data obtained during the last two years at the meteorological station at the Botanical Garden of the University of Latvia, the energy potential of solar radiation and wind was estimated. The values of the possible and the actual amount of produced energy were determined.

  10. Evaluation of Global Onshore Wind Energy Potential and Generation Costs

    SciTech Connect

    Zhou, Yuyu; Luckow, Patrick; Smith, Steven J.; Clarke, Leon E.

    2012-06-20

    In this study, we develop an updated global estimate of onshore wind energy potential using reanalysis wind speed data, along with updated wind turbine technology performance and cost assumptions as well as explicit consideration of transmission distance in the calculation of transmission costs. We find that wind has the potential to supply a significant portion of world energy needs, although this potential varies substantially by region as well as with assumptions such as on what types of land can be used to site wind farms. Total global wind potential under central assumptions is estimated to be approximately 89 petawatt hours per year at less than 9 cents/kWh with substantial regional variations. One limitation of global wind analyses is that the resolution of current global wind speed reanalysis data can result in an underestimate of high wind areas. A sensitivity analysis of eight key parameters is presented. Wind potential is sensitive to a number of input parameters, particularly those related to land suitability and turbine density as well as cost and financing assumptions which have important policy implications. Transmission cost has a relatively small impact on total wind costs, changing the potential at a given cost by 20-30%. As a result of sensitivities studied here we suggest that further research intended to inform wind supply curve development focus not purely on physical science, such as better resolved wind maps, but also on these less well-defined factors, such as land-suitability, that will also have an impact on the long-term role of wind power.

  11. Characterization of the potential energy landscape of an antiplasticized polymer.

    PubMed

    Riggleman, Robert A; Douglas, Jack F; de Pablo, Juan J

    2007-07-01

    The nature of the individual transitions on the potential energy landscape (PEL) associated with particle motion are directly examined for model fragile glass-forming polymer melts, and the results are compared to those of an antiplasticized polymer system. In previous work, we established that the addition of antiplasticizer reduces the fragility of glass formation so that the antiplasticized material is a stronger glass former. In the present work, we find that the antiplasticizing molecules reduce the energy barriers for relaxation compared to the pure polymer, implying that the antiplasticized system has smaller barriers to overcome in order to explore its configuration space. We examine the cooperativity of segmental motion in these bulk fluids and find that more extensive stringlike collective motion enables the system to overcome larger potential energy barriers, in qualitative agreement with both the Stillinger-Weber and Adam-Gibbs views of glass formation. Notably, the stringlike collective motion identified by our PEL analysis corresponds to incremental displacements that occur within larger-scale stringlike particle displacement processes associated with PEL metabasin transitions that mediate structural relaxation. These "substrings" nonetheless seem to exhibit changes in relative size with antiplasticization similar to those observed in "superstrings" that arise at elevated temperatures. We also study the effects of confinement on the energy barriers in each system. Film confinement makes the energy barriers substantially smaller in the pure polymer, while it has little effect on the energy barriers in the antiplasticized system. This observation is qualitatively consistent with our previous studies of stringlike motion in these fluids at higher temperatures and with recent experimental measurements by Torkelson and co-workers. PMID:17677447

  12. Three-color Förster resonance energy transfer within single F₀F₁-ATP synthases: monitoring elastic deformations of the rotary double motor in real time.

    PubMed

    Ernst, Stefan; Düser, Monika G; Zarrabi, Nawid; Börsch, Michael

    2012-01-01

    Catalytic activities of enzymes are associated with elastic conformational changes of the protein backbone. Förster-type resonance energy transfer, commonly referred to as FRET, is required in order to observe the dynamics of relative movements within the protein. Förster-type resonance energy transfer between two specifically attached fluorophores provides a ruler with subnanometer resolution between 3 and 8 nm, submillisecond time resolution for time trajectories of conformational changes, and single-molecule sensitivity to overcome the need for synchronization of various conformations. F(O)F(1)-ATP synthase is a rotary molecular machine which catalyzes the formation of adenosine triphosphate (ATP). The Escherichia coli enzyme comprises a proton driven 10 stepped rotary F(O) motor connected to a 3-stepped F(1) motor, where ATP is synthesized. This mismatch of step sizes will result in elastic deformations within the rotor parts. We present a new single-molecule FRET approach to observe both rotary motors simultaneously in a single F(O)F(1)-ATP synthase at work. We labeled this enzyme with three fluorophores, specifically at the stator part and at the two rotors. Duty cycle-optimized with alternating laser excitation, referred to as DCO-ALEX, allowed to control enzyme activity and to unravel associated transient twisting within the rotors of a single enzyme during ATP hydrolysis and ATP synthesis. Monte Carlo simulations revealed that the rotor twisting is larger than 36 deg. PMID:22352638

  13. On augmented Kohn–Sham potential for energy as a simple sum of orbital energies

    NASA Astrophysics Data System (ADS)

    Levy, Mel; Zahariev, Federico

    2016-04-01

    It has recently been observed [Phys. Rev. Lett. 113, 113002 (2014)] that the ground-state energy may be obtained directly as a simple sum of augmented Kohn-Sham orbital energies, where it was ascertained that the corresponding one-body shifted Kohn-Sham effective potential has appealing features. With this in mind, eigenvalue and virial constraints are deduced for approximating this potential.

  14. Elastic Stability of Concentric Tube Robots Subject to External Loads.

    PubMed

    Ha, Junhyoung; Park, Frank C; Dupont, Pierre E

    2016-06-01

    Concentric tube robots, which are comprised of precurved elastic tubes that are concentrically arranged, are being developed for many medical interventions. The shape of the robot is determined by the rotation and translation of the tubes relative to each other, and also by any external forces applied by the environment. As the tubes rotate and translate relative to each other, elastic potential energy caused by tube bending and twisting can accumulate; if a configuration is not locally elastically stable, then a dangerous snapping motion may occur as energy is suddenly released. External loads on the robot also influence elastic stability. In this paper, we provide a second-order sufficient condition, and also a separate necessary condition, for elastic stability. Using methods of optimal control theory, we show that these conditions apply to general concentric tube robot designs subject to arbitrary conservative external loads. They can be used to assess the stability of candidate robot configurations. Our results are validated via comparison with other known stability criteria, and their utility is demonstrated by an application to stable path planning. PMID:26441407

  15. Foundations of modeling in cryobiology-I: concentration, Gibbs energy, and chemical potential relationships.

    PubMed

    Anderson, Daniel M; Benson, James D; Kearsley, Anthony J

    2014-12-01

    Mathematical modeling plays an enormously important role in understanding the behavior of cells, tissues, and organs undergoing cryopreservation. Uses of these models range from explanation of phenomena, exploration of potential theories of damage or success, development of equipment, and refinement of optimal cryopreservation/cryoablation strategies. Over the last half century there has been a considerable amount of work in bio-heat and mass-transport, and these models and theories have been readily and repeatedly applied to cryobiology with much success. However, there are significant gaps between experimental and theoretical results that suggest missing links in models. One source for these potential gaps is that cryobiology is at the intersection of several very challenging aspects of transport theory: it couples multi-component, moving boundary, multiphase solutions that interact through a semipermeable elastic membrane with multicomponent solutions in a second time-varying domain, during a two-hundred Kelvin temperature change with multi-molar concentration gradients and multi-atmosphere pressure changes. In order to better identify potential sources of error, and to point to future directions in modeling and experimental research, we present a three part series to build from first principles a theory of coupled heat and mass transport in cryobiological systems accounting for all of these effects. The hope of this series is that by presenting and justifying all steps, conclusions may be made about the importance of key assumptions, perhaps pointing to areas of future research or model development, but importantly, lending weight to standard simplification arguments that are often made in heat and mass transport. In this first part, we review concentration variable relationships, their impact on choices for Gibbs energy models, and their impact on chemical potentials. PMID:25240602

  16. Energy dependence of the optical potential of weakly and tightly bound nuclei as projectiles on a medium-mass target

    SciTech Connect

    Figueira, J. M.; Arazi, A.; Carnelli, P.; Heimann, D. Martinez; Negri, A. E.; Pacheco, A. J.; Niello, J. O. Fernandez; Capurro, O. A.; Fimiani, L.; Marti, G. V.; Lubian, J.; Monteiro, D. S.; Gomes, P. R. S.

    2010-02-15

    Angular distributions for the elastic scattering of the weakly bound {sup 6,7}Li+{sup 144}Sm systems were measured with high accuracy at bombarding energies from 85% up to 170% of the Coulomb barrier. An optical model analysis was performed, and the relevant parameters of the real and imaginary parts of the optical potential were extracted. The results are compared with those previously published for the tightly bound {sup 12}C+{sup 144}Sm and {sup 16}O+{sup 144}Sm systems. The usual threshold anomaly observed in the behavior of the potential of tightly bound systems was not observed for either weakly bound system. This absence is attributed to the repulsion due to breakup coupling which cancels the attraction arising from couplings with bound channels.

  17. GIS Assessment of Wind Energy Potential in California and Florida

    NASA Astrophysics Data System (ADS)

    Snow, R. K.; Snow, M. M.

    2008-05-01

    Energy efficiency coupled with renewable energy technologies can provide most of the U.S. carbon emissions reductions needed to contain atmospheric carbon concentrations at 450-500 parts per million, considered by many to be a tipping point in mitigating climate change. Among the leaders in the alternative energy sector is wind power, which is now one of the largest sources of new power generation in the U.S. creating jobs and revenue for rural communities while powering our economy with an emissions-free source of energy. In 2006, wind turbines capable of generating more than 2,400 megawatts of electricity were installed in the U.S. and by 2007 this number had risen to 3,000 megawatts. The U.S. generated 31 billion kilowatt-hours of wind power in 2007, which is enough electricity to power the equivalent of nearly 3 million average homes. It is estimated that generating the same amount of electricity would require burning 16 million tons of coal or 50 million barrels of oil. This study examines the wind power potential of sites near populated areas in Florida and California to determine the practicability of installing wind turbines at these locations. A GIS was developed in order to conduct a spatial analysis of these sites based on mean annual wind speed measured in meters per second and wind power density ratings measured in watts per square meter. The analysis indicates that coastal areas of Cocoa Beach, Key West, Hollywood, and West Palm Beach, respectively, possess the greatest potential for wind energy in Florida with mean annual wind speeds of 4.9 m/s and average wind power density ratings of 171 w/m2 peaking at Cocoa Beach followed by wind speeds of 4.64 m/s and wind power ratings of 115 w/m2 at Key West. California wind energy potential is even greater than that of Florida with Fairfield exhibiting mean annual wind speeds of 5.9 m/s and average wind power density ratings of 327 w/m2 followed by the Mojave and Palmdale areas with mean annual wind speeds of 5.0 m/s and 4.6 m/s, respectively. Wind power density ratings for Mojave are 240 w/m2 and 153 w/m2 at Palmdale. These results help confirm that wind energy continues to offer a clean, cost-effective, inexhaustible, and readily available means of helping to curb global warming while answering the increasing demand for electricity.

  18. Onshore wind energy potential over Iberia: present and future projections

    NASA Astrophysics Data System (ADS)

    Rochinha, Carlos A.; Santos, João A.; Liberato, Margarida L. R.; Pinto, Joaquim G.

    2014-05-01

    Onshore grid-connected wind power generation has been explored for more than three decades in the Iberian Peninsula. Further, increasing attention has been devoted to renewable energy sources in a climate change context. While advantages of wind energy are widely recognized, its distribution is not spatially homogeneous and not uniform throughout the year. Hence, understanding these spatial-temporal distributions is critical in power system planning. The present study aims at assessing the potential power output estimated from 10 m wind components simulated by a regional climate model (CCLM), driven by ERA40 reanalysis. Datasets are available on a grid with a high spatial resolution (approximately 20 km) and over a 40-yr period (1961-2000). Furthermore, several target sites, located in areas with high installed wind generation capacity, are selected for local-to-regional scale assessments. The results show that potential wind power is higher over northern Iberia, mostly in Cantabria and Galicia, while Andalucía and Cataluña record the lowest values. With respect to the intra-annual variability, summer is by far the season with the lowest potential energy outputs. Furthermore, the inter-annual variability reveals an overall downward long-term trend over the 40-yr period, particularly in the winter time series. A CCLM transient experiment, forced by the SRES A1B emission scenario, is also discussed for a future period (2041-2070), after a model validation/calibration process (bias corrections). Significant changes in the wind power potential are projected for the future throughout Iberia, but their magnitude largely depends on the locations. This work was partially supported by FEDER (Fundo Europeu de Desenvolvimento Regional) funds through the COMPETE (Programa Operacional Factores de Competitividade) and by national funds through FCT (Fundação para a Ciência e a Tecnologia, Portugal) under project STORMEx FCOMP-01-0124-FEDER- 019524 (PTDC/AAC-CLI/121339/2010).

  19. Energy aspects and potential energy savings of the new DASI process for milk sterilization

    SciTech Connect

    Frey, B.C.; Stewart, L.E.; Chandarana, D.; Wolfson, R.P.

    1981-01-01

    An experimental study was conducted to determine the difference in total processing energy required by the DASI ultra-high temperature (UHT) system and a conventional high temperature short time (HTST) fluid milk system. Data available in the literature were used to develop an energy use profile for the current US fluid milk system from processor to consumer. The energy data measured and the profile developed were used to estimate the potential energy savings resulting from the introduction of sterile milk in the US fluid milk market. Savings of energy resulting from the introduction of sterile milk were estimated to be 12 million barrels of oil annually.

  20. Gravitational potential energy of the earth - A spherical harmonic approach

    NASA Technical Reports Server (NTRS)

    Rubincam, D. P.

    1979-01-01

    A spherical harmonic equation for the gravitational potential energy of the earth is derived for an arbitrary density distribution by conceptually bringing in mass-elements from infinity and building up the earth shell upon spherical shell. The zeroth degree term in the spherical harmonic expansion agrees with the usual expression for the energy of a radial density distribution. The second degree terms give a maximum nonhydrostatic energy in the crust and mantle of -2.77 x 10 to the 29th ergs, an order of magnitude below McKenzie's (1966) estimate. McKenzie's result stems from mathematical error. Our figure is almost identical with Kaula's (1963) estimate of the minimum shear strain energy in the mantle, a not unexpected result on the basis of the virial theorem. If the earth is assumed to be a homogeneous viscous oblate spheroid relaxing to an equilibrium shape, then a lower limit to the mantle viscosity of 1.3 x 10 to the 20th P is found by assuming that the total geothermal flux is due to viscous dissipation of energy. This number is almost six orders of magnitude below MacDonald's (1966) estimate of the viscosity and removes his objection to convection. If the nonequilibrium figure is dynamically maintained by the earth acting as a heat engine at 1% efficiency, then the viscosity is 10 to the 22nd P, a number preferred by Cathles (1975) and Peltier and Andrew (1976) as the viscosity of the mantle.

  1. Elastic and hierarchical porous carbon nanofibrous membranes incorporated with NiFe2O4 nanocrystals for highly efficient capacitive energy storage

    NASA Astrophysics Data System (ADS)

    Ge, Jianlong; Fan, Gang; Si, Yang; He, Jianxin; Kim, Hak-Yong; Ding, Bin; Al-Deyab, Salem S.; El-Newehy, Mohamed; Yu, Jianyong

    2016-01-01

    Flexible membranes created from porous carbon nanofibers (CNFs) hold great promise in the next generation wearable energy storage devices, but challenges still remain due to the poor mechanical properties of porous carbon nanofibers. Here, we report a facile strategy to fabricate elastic and hierarchical porous CNF membranes with NiFe2O4 nanocrystals embedded via multicomponent electrospinning and nano-doping methods. Benefiting from the scattering effect of NiFe2O4 nanocrystals and graphitized carbon layers for the condensed stress, the resultant CNF membranes exhibit an enhanced elasticity with a bending radius <12 μm, rapid recovery from the deformations, and a superior softness. Quantitative pore size distribution and fractal analysis reveal that the CNFs possessed tunable porous structures with a high surface area of 493 m2 g-1 and a pore volume of 0.31 cm3 g-1. Benefiting from the robust mechanical stability, hierarchical porous structures and good electrochemical properties, the NiFe2O4 doped CNF membranes demonstrate a high electrical capacitance of 343 F g-1, and good reversibility with a cycling efficiency of 97.4% even after 10 000 cycles. The successful synthesis of elastic porous CNF membranes also provided a versatile platform for the design and development of functional CNF based materials for various applications.Flexible membranes created from porous carbon nanofibers (CNFs) hold great promise in the next generation wearable energy storage devices, but challenges still remain due to the poor mechanical properties of porous carbon nanofibers. Here, we report a facile strategy to fabricate elastic and hierarchical porous CNF membranes with NiFe2O4 nanocrystals embedded via multicomponent electrospinning and nano-doping methods. Benefiting from the scattering effect of NiFe2O4 nanocrystals and graphitized carbon layers for the condensed stress, the resultant CNF membranes exhibit an enhanced elasticity with a bending radius <12 μm, rapid recovery from the deformations, and a superior softness. Quantitative pore size distribution and fractal analysis reveal that the CNFs possessed tunable porous structures with a high surface area of 493 m2 g-1 and a pore volume of 0.31 cm3 g-1. Benefiting from the robust mechanical stability, hierarchical porous structures and good electrochemical properties, the NiFe2O4 doped CNF membranes demonstrate a high electrical capacitance of 343 F g-1, and good reversibility with a cycling efficiency of 97.4% even after 10 000 cycles. The successful synthesis of elastic porous CNF membranes also provided a versatile platform for the design and development of functional CNF based materials for various applications. Electronic supplementary information (ESI) available: Tables of solution properties and porous structures, figures showing mechanical properties and nanostructures, and movie S1. See DOI: 10.1039/c5nr07368e

  2. Simultaneous analysis of the elastic scattering and breakup channel for the reaction 11Li+208Pb at energies near the Coulomb barrier

    NASA Astrophysics Data System (ADS)

    Fernández-García, J. P.; Cubero, M.; Acosta, L.; Alcorta, M.; Alvarez, M. A. G.; Borge, M. J. G.; Buchmann, L.; Diget, C. A.; Falou, H. A.; Fulton, B.; Fynbo, H. O. U.; Galaviz, D.; Gómez-Camacho, J.; Kanungo, R.; Lay, J. A.; Madurga, M.; Martel, I.; Moro, A. M.; Mukha, I.; Nilsson, T.; Rodríguez-Gallardo, M.; Sánchez-Benítez, A. M.; Shotter, A.; Tengblad, O.; Walden, P.

    2015-10-01

    We present a detailed analysis of the elastic scattering and breakup channel for the reaction of 11Li on 208Pb at incident laboratory energies of 24.3 and 29.8 MeV, measured at the radioactive ion beam facility of TRIUMF, in Vancouver, Canada. A large yield of 9Li fragments was detected by four charged particle telescopes in a wide angular range. The experimental angular and energy distributions of these 9Li fragments have been compared to coupled-reaction-channel and continuum-discretized coupled-channel calculations. The large production of 9Li fragments at small angles can be explained by considering a direct breakup mechanism, while at medium-large angles a competition between direct breakup and neutron transfer to the continuum of the 208Pb target was observed.

  3. Landscape of finite-temperature equilibrium behaviour of curvature-inducing proteins on a bilayer membrane explored using a linearized elastic free energy model

    PubMed Central

    Agrawal, Neeraj J.; Weinstein, Joshua; Radhakrishnan, Ravi

    2011-01-01

    Using a recently developed multiscale simulation methodology, we describe the equilibrium behaviour of bilayer membranes under the influence of curvature-inducing proteins using a linearized elastic free energy model. In particular, we describe how the cooperativity associated with a multitude of proteinmembrane interactions and protein diffusion on a membrane-mediated energy landscape elicits emergent behaviour in the membrane phase. Based on our model simulations, we predict that, depending on the density of membrane-bound proteins and the degree to which a single protein molecule can induce intrinsic mean curvature in the membrane, a range of membrane phase behaviour can be observed including two different modes of vesicle-bud nucleation and repressed membrane undulations. A state diagram as a function of experimentally tunable parameters to classify the underlying states is proposed. PMID:21243078

  4. Rotational Energy Transfer of N2 Gas Determined Using a New Ab Initio Potential Energy Surface

    NASA Technical Reports Server (NTRS)

    Huo, Winifred M.; Stallcop, James R.; Partridge, Harry; Langhoff, Stephen R. (Technical Monitor)

    1997-01-01

    Rotational energy transfer between two N2 molecules is a fundamental process of some importance. Exchange is expected to play a role, but its importance is somewhat uncertain. Rotational energy transfer cross sections of N2 also have applications in many other fields including modeling of aerodynamic flows, laser operations, and linewidth analysis in nonintrusive laser diagnostics. A number of N2-N2 rigid rotor potential energy surface (PES) has been reported in the literature.

  5. Theoretical studies of potential energy surfaces and computational methods

    SciTech Connect

    Shepard, R.

    1993-12-01

    This project involves the development, implementation, and application of theoretical methods for the calculation and characterization of potential energy surfaces involving molecular species that occur in hydrocarbon combustion. These potential energy surfaces require an accurate and balanced treatment of reactants, intermediates, and products. This difficult challenge is met with general multiconfiguration self-consistent-field (MCSCF) and multireference single- and double-excitation configuration interaction (MRSDCI) methods. In contrast to the more common single-reference electronic structure methods, this approach is capable of describing accurately molecular systems that are highly distorted away from their equilibrium geometries, including reactant, fragment, and transition-state geometries, and of describing regions of the potential surface that are associated with electronic wave functions of widely varying nature. The MCSCF reference wave functions are designed to be sufficiently flexible to describe qualitatively the changes in the electronic structure over the broad range of geometries of interest. The necessary mixing of ionic, covalent, and Rydberg contributions, along with the appropriate treatment of the different electron-spin components (e.g. closed shell, high-spin open-shell, low-spin open shell, radical, diradical, etc.) of the wave functions, are treated correctly at this level. Further treatment of electron correlation effects is included using large scale multireference CI wave functions, particularly including the single and double excitations relative to the MCSCF reference space. This leads to the most flexible and accurate large-scale MRSDCI wave functions that have been used to date in global PES studies.

  6. Potential impacts of nanotechnology on energy transmission applications and needs.

    SciTech Connect

    Elcock, D.; Environmental Science Division

    2007-11-30

    The application of nanotechnologies to energy transmission has the potential to significantly impact both the deployed transmission technologies and the need for additional development. This could be a factor in assessing environmental impacts of right-of-way (ROW) development and use. For example, some nanotechnology applications may produce materials (e.g., cables) that are much stronger per unit volume than existing materials, enabling reduced footprints for construction and maintenance of electricity transmission lines. Other applications, such as more efficient lighting, lighter-weight materials for vehicle construction, and smaller batteries having greater storage capacities may reduce the need for long-distance transport of energy, and possibly reduce the need for extensive future ROW development and many attendant environmental impacts. This report introduces the field of nanotechnology, describes some of the ways in which processes and products developed with or incorporating nanomaterials differ from traditional processes and products, and identifies some examples of how nanotechnology may be used to reduce potential ROW impacts. Potential environmental, safety, and health impacts are also discussed.

  7. Potential environmental effects of energy conservation measures in northwest industries

    SciTech Connect

    Baechler, M C; Gygi, K F; Hendrickson, P L

    1992-01-01

    The Bonneville Power Administration (Bonneville) has identified 101 plants in the Pacific Northwest that account for 80% of the region's industrial electricity consumption. These plants offer a precise target for a conservation program. PNL determined that most of these 101 plants were represented by 11 major industries. We then reviewed 36 major conservation technologies used in these 11 industrial settings to determine their potential environmental impacts. Energy efficiency technologies designed for industrial use may result in direct or indirect environmental impacts. Effects may result from the production of the conservation measure technology, changes in the working environment due to different energy and material requirements, or changes to waste streams. Industry type, work-place conditions, worker training, and environmental conditions inside and outside the plant are all key variables that may affect environmental outcomes. To address these issues this report has three objectives: Describe potential conservation measures that Bonneville may employ in industrial programs and discuss potential primary impacts. Characterize industrial systems and processes where the measure may be employed and describe general environmental issues associated with each industry type. Review environmental permitting, licensing, and other regulatory actions required for industries and summarize the type of information available from these sources for further analysis.

  8. Potential for energy conservation in the cement industry

    SciTech Connect

    Garrett-Price, B.A.

    1985-02-01

    This report assesses the potential for energy conservation in the cement industry. Energy consumption per ton of cement decreased 20% between 1972 and 1982. During this same period, the cement industry became heavily dependent on coal and coke as its primary fuel source. Although the energy consumed per ton of cement has declined markedly in the past ten years, the industry still uses more than three and a half times the fuel that is theoretically required to produce a ton of clinker. Improving kiln thermal efficiency offers the greatest opportunity for saving fuel. Improving the efficiency of finish grinding offers the greatest potential for reducing electricity use. Technologies are currently available to the cement industry to reduce its average fuel consumption per ton by product by as much as 40% and its electricity consumption per ton by about 10%. The major impediment to adopting these technologies is the cement industry's lack of capital as a result of low or no profits in recent years.

  9. Intermolecular potential energy surface and thermophysical properties of ethylene oxide

    SciTech Connect

    Crusius, Johann-Philipp Hassel, Egon; Hellmann, Robert; Bich, Eckard

    2014-10-28

    A six-dimensional potential energy hypersurface (PES) for two interacting rigid ethylene oxide (C{sub 2}H{sub 4}O) molecules was determined from high-level quantum-chemical ab initio calculations. The counterpoise-corrected supermolecular approach at the MP2 and CCSD(T) levels of theory was utilized to determine interaction energies for 10178 configurations of two molecules. An analytical site-site potential function with 19 sites per ethylene oxide molecule was fitted to the interaction energies and fine tuned to agree with data for the second acoustic virial coefficient from accurate speed of sound measurements. The PES was validated by computing the second virial coefficient, shear viscosity, and thermal conductivity. The values of these properties are substantiated by the best experimental data as they tend to fall within the uncertainty intervals and also obey the experimental temperature functions, except for viscosity, where experimental data are insufficient. Due to the lack of reliable data, especially for the transport properties, our calculated values are currently the most accurate estimates for these properties of ethylene oxide.

  10. Nuclear binding energy and symmetry energy of nuclear matter with modern nucleon-nucleon potentials

    SciTech Connect

    Hassaneen, Kh.S.A.; Abo-Elsebaa, H.M.; Sultan, E.A.; Mansour, H.M.M.

    2011-03-15

    Research Highlights: > The nuclear matter is studied within the Brueckner-Hartree-Fock (BHF) approach employing the most recent accurate nucleon-nucleon potentials. > The results come out by approximating the single particle self-consistent potential with a parabolic form. > We discuss the current status of the Coester line, i.e., density and energy of the various saturation points being strongly linearly correlated. > The nuclear symmetry energy is calculated as the difference between the binding energy of pure neutron matter and that of symmetric nuclear matter. - Abstract: The binding energy of nuclear matter at zero temperature in the Brueckner-Hartree-Fock approximation with modern nucleon-nucleon potentials is studied. Both the standard and continuous choices of single particle energies are used. These modern nucleon-nucleon potentials fit the deuteron properties and are phase shifts equivalent. Comparison with other calculations is made. In addition we present results for the symmetry energy obtained with different potentials, which is of great importance in astrophysical calculation.

  11. Dark Energy:. the Absolute Electric Potential of the Universe

    NASA Astrophysics Data System (ADS)

    Jiménez, Jose Beltrán; Maroto, Antonio L.

    Is there an absolute cosmic electric potential? The recent discovery of the accelerated expansion of the universe could be indicating that this is certainly the case. In this essay we show that the consistency of the covariant and gauge-invariant theory of electromagnetism is truly questionable when considered on cosmological scales. Out of the four components of the electromagnetic field, Maxwell's theory contains only two physical degrees of freedom. However, in the presence of gravity, one of the "unphysical" states cannot be consistently eliminated, thus becoming real. This third polarization state is completely decoupled from charged matter, but can be excited gravitationally, thus breaking gauge invariance. On large scales the new state can be seen as a homogeneous cosmic electric potential, whose energy density behaves as a cosmological constant.

  12. Global Expression for Representing Diatomic Potential-Energy Curves

    NASA Technical Reports Server (NTRS)

    Ferrante, John; Schlosser, Herbert; Smith, John R.

    1991-01-01

    A three-parameter expression that gives an accurate fit to diatomic potential curves over the entire range of separation for charge transfers between 0 and 1. It is based on a generalization of the universal binding-energy relation of Smith et al. (1989) with a modification that describes the crossover from a partially ionic state to the neutral state at large separations. The expression is tested by comparison with first-principles calculations of the potential curves ranging from covalently bonded to ionically bonded. The expression is also used to calculate spectroscopic constants form a curve fit to the first-principles curves. A comparison is made with experimental values of the spectroscopic constants.

  13. Potential energy surfaces and reaction dynamics of polyatomic molecules

    SciTech Connect

    Chang, Yan-Tyng.

    1991-11-01

    A simple empirical valence bond (EVB) model approach is suggested for constructing global potential energy surfaces for reactions of polyatomic molecular systems. This approach produces smooth and continuous potential surfaces which can be directly utilized in a dynamical study. Two types of reactions are of special interest, the unimolecular dissociation and the unimolecular isomerization. For the first type, the molecular dissociation dynamics of formaldehyde on the ground electronic surface is investigated through classical trajectory calculations on EVB surfaces. The product state distributions and vector correlations obtained from this study suggest very similar behaviors seen in the experiments. The intramolecular hydrogen atom transfer in the formic acid dimer is an example of the isomerization reaction. High level ab initio quantum chemistry calculations are performed to obtain optimized equilibrium and transition state dimer geometries and also the harmonic frequencies.

  14. Assessing geothermal energy potential in upstate New York. Final report

    SciTech Connect

    Hodge, D.S.

    1996-08-01

    The potential of geothermal energy for future electric power generation in New York State is evaluated using estimates of temperatures of geothermal reservoir rocks. Bottom hole temperatures from over 2000 oil and gas wells in the region were integrated into subsurface maps of the temperatures for specific geothermal reservoirs. The Theresa/Potsdam formation provides the best potential for extraction of high volumes of geothermal fluids. The evaluation of the Theresa/Potsdam geothermal reservoir in upstate New York suggests that an area 30 miles east of Elmira, New York has the highest temperatures in the reservoir rock. The Theresa/Potsdam reservoir rock should have temperatures about 136 {degrees}C and may have as much as 450 feet of porosity in excess of 8%. Estimates of the volumes of geothermal fluids that can be extracted are provided and environmental considerations for production from a geothermal well is discussed.

  15. Potential energy curves and collision integrals of air components

    NASA Technical Reports Server (NTRS)

    Partridge, Harry; Stallcop, James R.; Levin, Eugene; Langhoff, Stephen R. (Technical Monitor)

    1995-01-01

    Collision integrals are fundamental quantities required to determine the transport properties of the environment surrounding aerospace vehicles in the upper atmosphere. These collision integrals can be determined as a function of temperature from the potential energy curves describing the atomic and molecular collisions. Ab initio calculations provide a practical method of computing the required interaction potentials. In this work we will discuss recent advances with an emphasis on the accuracy that is obtainable. Results for interactions, e.g. N+N, N+O, O+O, and H+N2 will be reviewed and their application to the determination of transport properties, such as diffusion and viscosity coefficients, will be examined.

  16. The potential energy surface of 240Pu around scission

    NASA Astrophysics Data System (ADS)

    Bartel, J.; Nerlo-Pomorska, B.; Pomorski, K.; Schmitt, C.

    2014-05-01

    The potential energy surface of 240Pu is analyzed in the scission region within an elaborate macroscopic-microscopic approach, using the Lublin-Strasbourg-drop model, an improved Strutinsky shell-correction method and the BCS (Bardeen-Cooper-Schrieffer) treatment of pairing. The modified funny-hills nuclear shape parameterization, used in the present study, is further improved by introducing new collective coordinates κ and ψ for the elongation and neck-constriction. These variables are shown to be very well suited for the scission region. Within a limited number of dimensions, the model is able to explain fission modes in the actinide region. More specifically, the present work indicates that the peak of the mass distribution at A\\approx 140 in the low-energy fission of 240Pu is mainly caused by strong neutron shell corrections.

  17. Stabilized quasi-Newton optimization of noisy potential energy surfaces

    NASA Astrophysics Data System (ADS)

    Schaefer, Bastian; Ghasemi, S. Alireza; Roy, Shantanu; Goedecker, Stefan; Goedecker Group Team

    Optimizations of atomic positions belong to the most frequently performed tasks in electronic structure calculations. Many simulations like global minimum searches or the identification of chemical reaction pathways can require the computation of hundreds or thousands of minimizations or saddle points. To automatize these tasks, optimization algorithms must not only be efficient but also very reliable. Unfortunately, computational noise in forces and energies is inherent to electronic structure codes. This computational noise poses a severe problem to the stability of efficient optimization methods like the limited-memory Broyden-Fletcher-Goldfarb-Shanno algorithm. In this talk a recently published technique that allows to obtain significant curvature information of noisy potential energy surfaces is presented. This technique was used to construct both, a stabilized quasi-Newton minimization method and a stabilized quasi-Newton saddle finding approach. With the help of benchmarks both the minimizer and the saddle finding approach were demonstrated to be superior to comparable existing methods.

  18. Domestic refrigeration appliances in Poland: Potential for improving energy efficiency

    SciTech Connect

    Meyers, S.; Schipper, L.; Lebot, B.

    1993-08-01

    This report is based on information collected from the main Polish manufacturer of refrigeration appliances. We describe their production facilities, and show that the energy consumption of their models for domestic sale is substantially higher than the average for similar models made in W. Europe. Lack of data and uncertainty about future production costs in Poland limits our evaluation of the cost-effective potential to increase energy efficiency, but it appears likely that considerable improvement would be economic from a societal perspective. Many design options are likely to have a simple payback of less than five years. We found that the production facilities are in need of substantial modernization in order to produce higher quality and more efficient appliances. We discuss policy options that could help to build a market for more efficient appliances in Poland and thereby encourage investment to produce such equipment.

  19. Potential for energy savings in old and new auto engines

    NASA Astrophysics Data System (ADS)

    Reitz, John R.

    1985-11-01

    This paper disucsses the potential for energy savings in the transportation sector through the use of both improved and entirely new automotive engines. Although spark-ignition and diesel internal combustion engines will remain the dominant choices for passenger-car use throughout the rest of this century, improved versions of these engines (lean-burn, low-friction spark-ignition and adiabatic, low-friction diesel engines) could, in the long term, provide a 20-30 percent improvement in fuel economy over what is currently available. The use of new materials, and modifications to both vehicle structure and vehicle transmissions may yield further improvements. Over a longer time frame, the introduction of the high-temperature gas-turbine engine and the use of new synfuels may provide further opportunities for energy conservation.

  20. Stabilized quasi-Newton optimization of noisy potential energy surfaces

    SciTech Connect

    Schaefer, Bastian; Goedecker, Stefan; Alireza Ghasemi, S.; Roy, Shantanu

    2015-01-21

    Optimizations of atomic positions belong to the most commonly performed tasks in electronic structure calculations. Many simulations like global minimum searches or characterizations of chemical reactions require performing hundreds or thousands of minimizations or saddle computations. To automatize these tasks, optimization algorithms must not only be efficient but also very reliable. Unfortunately, computational noise in forces and energies is inherent to electronic structure codes. This computational noise poses a severe problem to the stability of efficient optimization methods like the limited-memory Broyden–Fletcher–Goldfarb–Shanno algorithm. We here present a technique that allows obtaining significant curvature information of noisy potential energy surfaces. We use this technique to construct both, a stabilized quasi-Newton minimization method and a stabilized quasi-Newton saddle finding approach. We demonstrate with the help of benchmarks that both the minimizer and the saddle finding approach are superior to comparable existing methods.

  1. Stabilized quasi-Newton optimization of noisy potential energy surfaces

    NASA Astrophysics Data System (ADS)

    Schaefer, Bastian; Alireza Ghasemi, S.; Roy, Shantanu; Goedecker, Stefan

    2015-01-01

    Optimizations of atomic positions belong to the most commonly performed tasks in electronic structure calculations. Many simulations like global minimum searches or characterizations of chemical reactions require performing hundreds or thousands of minimizations or saddle computations. To automatize these tasks, optimization algorithms must not only be efficient but also very reliable. Unfortunately, computational noise in forces and energies is inherent to electronic structure codes. This computational noise poses a severe problem to the stability of efficient optimization methods like the limited-memory Broyden-Fletcher-Goldfarb-Shanno algorithm. We here present a technique that allows obtaining significant curvature information of noisy potential energy surfaces. We use this technique to construct both, a stabilized quasi-Newton minimization method and a stabilized quasi-Newton saddle finding approach. We demonstrate with the help of benchmarks that both the minimizer and the saddle finding approach are superior to comparable existing methods.

  2. The Potential for Energy Efficiency and Renewable Energy in North Carolina

    SciTech Connect

    Hadley, SW

    2003-08-06

    As many states have restructured their electric power industry, they have established a ''systems benefit charge'' to help fund those activities that will no longer be funded by utilities in the new structure. Examples include weatherization of low-income housing, efficiency programs, and renewable energy development. Varying amounts have been collected and allocated depending on state needs and abilities. One question that arises is what are the potential results of funding the different types of programs. What is the potential for energy efficiency or for renewable power, and what would be accomplished given the amount of funding that the system benefit charge may provide? The purpose of this project is to provide an initial estimate of the potential for energy efficiency and renewable energy in North Carolina. This potential could be funded by a public benefits fund resulting from a green power program being considered in the state. It concentrates on electric energy savings and production. Savings in buildings can include improvements to space conditioning as well as improvements to lighting or other appliances. Distributed power potential, through use of combined heat and power and renewables such as photovoltaic, wind, and biomass were examined. The goal is to provide information to decision makers who are developing a green power program in North Carolina. It will not be a complete and detailed study of all efficiency potentials but is more of a scoping exercise to determine the relative impacts and begin the process for a more definitive study at a later date. Statewide energy savings potential cannot be directly measured but must be calculated. First, the word ''potential'' means that the savings have not occurred yet. Second, the savings are often only indirectly measured by estimating what energy use there would have been without the changes in technology or behavior. Calculations through sampling and statistical analysis or by simulation are a necessary part of any mechanism to determine energy savings potential. There are currently several methods for calculating savings. Extrapolation of savings achieved from specific programs, surveys of existing building stock or energy-using activities, computer calculations of representative building types, and economic simulations all provide insight into the amount of energy that could be saved.

  3. DNA kinks and bubbles: Temperature dependence of the elastic energy of sharply bent 10-nm-size DNA molecules

    NASA Astrophysics Data System (ADS)

    Sanchez, Daniel S.; Qu, Hao; Bulla, Delenda; Zocchi, Giovanni

    2013-02-01

    A 10-nm-long DNA molecule can bend through large angles reversibly. Past the linear regime, its equilibrium nonlinear bending elasticity is governed by a critical bending torque ?c?30pNnm at which the molecule develops a kink. This nonlinearity has long been attributed to the nucleation of a bubble or melted region in the molecule. Here we measure the temperature dependence of the critical bending torque for nicked DNA, and determine that the entropy associated with the kink in the nonlinear regime is negligible. Thus in the case of nicked DNA the kink is not a bubble, but a compact region deformed beyond a yield strain. We further argue that, with our boundary conditions, the same is likely true for intact DNA. The present measurements confirm that the critical bending torque ?c is a materials parameter of DNA mechanics analogous to the bending modulus B?200pNnm.

  4. Terahertz absorption spectra and potential energy distribution of liquid crystals.

    PubMed

    Chen, Zezhang; Jiang, Yurong; Jiang, Lulu; Ma, Heng

    2016-01-15

    In this work, the terahertz (THz) absorption spectra of a set of nematic liquid crystals were studied using the density functional theories (DFT). An accurate assignment of the vibrational modes corresponding to absorption frequencies were performed using potential energy distribution (PED) in a frequency range of 0-3 THz. The impacts of different core structures on THz absorption spectra were discussed. The results indicate that scope of application must be considered in the LC-based THz device designing. This proposed work may give a useful suggestion on the design of novel liquid crystal material in THz wave. PMID:26476072

  5. Taboo search by successive confinement: Surveying a potential energy surface

    NASA Astrophysics Data System (ADS)

    Chekmarev, Sergei F.

    2001-09-01

    A taboo search for minima on a potential energy surface (PES) is performed by means of confinement molecular dynamics: the molecular dynamics trajectory of the system is successively confined to various basins on the PES that have not been sampled yet. The approach is illustrated for a 13-atom Lennard-Jones cluster. It is shown that the taboo search radically accelerates the process of surveying the PES, with the probability of finding a new minimum defined by a propagating Fermi-like distribution.

  6. Terahertz absorption spectra and potential energy distribution of liquid crystals

    NASA Astrophysics Data System (ADS)

    Chen, Zezhang; Jiang, Yurong; Jiang, Lulu; Ma, Heng

    2016-01-01

    In this work, the terahertz (THz) absorption spectra of a set of nematic liquid crystals were studied using the density functional theories (DFT). An accurate assignment of the vibrational modes corresponding to absorption frequencies were performed using potential energy distribution (PED) in a frequency range of 0-3 THz. The impacts of different core structures on THz absorption spectra were discussed. The results indicate that scope of application must be considered in the LC-based THz device designing. This proposed work may give a useful suggestion on the design of novel liquid crystal material in THz wave.

  7. Freezing of Energy of a Soliton in an External Potential

    NASA Astrophysics Data System (ADS)

    Bambusi, D.; Maspero, A.

    2016-01-01

    In this paper we study the dynamics of a soliton in the generalized NLS with a small external potential ɛV of Schwartz class. We prove that there exists an effective mechanical system describing the dynamics of the soliton and that, for any positive integer r, the energy of such a mechanical system is almost conserved up to times of order ɛ -r . In the rotational invariant case we deduce that the true orbit of the soliton remains close to the mechanical one up to times of order ɛ -r .

  8. Expressions of Energy and Potential due to Orbital Polarization

    NASA Astrophysics Data System (ADS)

    Narita, Akira; Higuchi, Masahiko

    2006-02-01

    The simple and tractable representation for the LS-multiplet energy in l1l2-configuration in an atom is derived in the form of the polynomials being a function of l1\\cdotl2 which obey the recurrence formulae, and is suitable for the vector model. Moreover, it is extended to ln configurations. On a basis of the model, the definition of the orbital polarization energy is given. The more precise expressions of the energies compared to those so far proposed by Eriksson et al. are derived for the maximal spin multiplets in pn, dn, and fn. They are composed of two terms depending on -3L2/2 and n(n-2l-1). They are the exact for pn and dn, but it for fn is correct only for a ground multiplet. Other expressions are also derived as a function of L2 for fn, though more complicated. For the actual atomic and band structure calculations based on local-spin-density-approximation (LSDA), the modified expression for the energy is proposed. The potential is derived from its expression in terms of the density functional theory, and can be applied to their structure calculations.

  9. Proton-proton elastic scattering at the LHC energy of \\chem{\\sqrt{s} = 7\\,TeV}

    NASA Astrophysics Data System (ADS)

    TOTEM Collaboration; Antchev, G.; Aspell, P.; Atanassov, I.; Avati, V.; Baechler, J.; Berardi, V.; Berretti, M.; Bozzo, M.; Brücken, E.; Buzzo, A.; Cafagna, F. S.; Calicchio, M.; Catanesi, M. G.; Covault, C.; Csanád, M.; Csörgö, T.; Deile, M.; Dimovasili, E.; Doubek, M.; Eggert, K.; Eremin, V.; Ferro, F.; Fiergolski, A.; Garcia, F.; Giani, S.; Greco, V.; Grzanka, L.; Heino, J.; Hilden, T.; Janda, M.; Kašpar, J.; Kopal, J.; Kundrát, V.; Kurvinen, K.; Lami, S.; Latino, G.; Lauhakangas, R.; Leszko, T.; Lippmaa, E.; Lokajíček, M.; Lo Vetere, M.; Rodríguez, F. Lucas; Macrí, M.; Magaletti, L.; Magazzù, G.; Mercadante, A.; Minutoli, S.; Nemes, F.; Niewiadomski, H.; Noschis, E.; Novák, T.; Oliveri, E.; Oljemark, F.; Orava, R.; Oriunno, M.; Österberg, K.; Perrot, A.-L.; Palazzi, P.; Pedreschi, E.; Petäjäjärvi, J.; Procházka, J.; Quinto, M.; Radermacher, E.; Radicioni, E.; Ravotti, F.; Robutti, E.; Ropelewski, L.; Ruggiero, G.; Saarikko, H.; Santroni, A.; Scribano, A.; Sette, G.; Snoeys, W.; Spinella, F.; Sziklai, J.; Taylor, C.; Turini, N.; Vacek, V.; Vitek, M.; Welti, J.; Whitmore, J.

    2011-08-01

    Proton-proton elastic scattering has been measured by the TOTEM experiment at the CERN Large Hadron Collider at \\sqrt{s} = 7\\,TeV in dedicated runs with the Roman Pot detectors placed as close as seven times the transverse beam size (σbeam) from the outgoing beams. After careful study of the accelerator optics and the detector alignment, |t|, the square of four-momentum transferred in the elastic scattering process, has been determined with an uncertainty of \\delta t = 0.1\\,\\rm{GeV} \\sqrt{\\vert t\\vert } . In this letter, first results of the differential cross-section are presented covering a |t|-range from 0.36 to 2.5 GeV2. The differential cross-section in the range 0.36 < |t| < 0.47 GeV2 is described by an exponential with a slope parameter B = (23.6 ± 0.5stat ± 0.4syst) GeV-2, followed by a significant diffractive minimum at |t| = (0.53 ± 0.01stat ± 0.01syst) GeV2. For |t|-values larger than ~1.5 GeV2, the cross-section exhibits a power law behaviour with an exponent of -7.8 ± 0.3stat ± 0.1syst. When compared to predictions based on the different available models, the data show a strong discriminative power despite the small t-range covered.

  10. Broadband energy harvesting via adaptive control of bistable potential energy separatrix

    NASA Astrophysics Data System (ADS)

    Ouellette, Scott A.; Todd, Michael D.

    2014-03-01

    As a result of the documented performance limitations of conventional linear piezoelectric energy harvesters, researchers have focused their efforts towards device designs that can better capture broadband energy. The approaches used can be classified into three categories: frequency tuning, multi-modal energy harvesting, and nonlinear energy harvesting1. Of the nonlinear harvesting approaches studied, bistable energy harvesters have been shown to have the most robust performance when subjected to broadband harmonic & stochastic excitation2-4. A conventional method for developing a nonlinear bistable restoring force is through use of magnetic repulsion. In these studies, a common theme of high-energy orbit breakdown occurs during a frequency upsweep. The issue at hand is the inability of the device inertial forces to overcome the potential energy barrier (separatrix) inherent to a bistable potential energy. This paper proposes the use of a high-permeability electromagnet for adaptively controlling the bistable magnetic repulsion force to expand the frequency bandwidth for high-energy harmonic oscillations. Numerical simulations of the nonlinear oscillator are used to study the system response under varying parameters of separation distance and electromagnetic coil current. An analytical model of the magnetic moment of an electromagnet is developed for use in studying the force interaction between repulsing magnets and to determine the parametric space that generates buckling loads in a cantilever bimorph energy harvester.

  11. Energy Conservation Simplified

    ERIC Educational Resources Information Center

    Hecht, Eugene

    2008-01-01

    The standard formulation of energy conservation involves the subsidiary ideas of kinetic energy ("KE"), work ("W"), thermal energy, internal energy, and a half-dozen different kinds of potential energy ("PE"): elastic, chemical, nuclear, gravitational, and so forth. These quantities came to be recognized during the centuries over which the…

  12. Energy Conservation Simplified

    ERIC Educational Resources Information Center

    Hecht, Eugene

    2008-01-01

    The standard formulation of energy conservation involves the subsidiary ideas of kinetic energy ("KE"), work ("W"), thermal energy, internal energy, and a half-dozen different kinds of potential energy ("PE"): elastic, chemical, nuclear, gravitational, and so forth. These quantities came to be recognized during the centuries over which the

  13. Total, inelastic and (quasi-)elastic cross sections of high energy p A and γ ⋆ A reactions with the dipole formalism

    NASA Astrophysics Data System (ADS)

    Gustafson, Gösta; Lönnblad, Leif; Ster, András; Csörgő, Tamás

    2015-10-01

    In order to understand the initial partonic state in proton-nucleus and electron-nucleus collisions, we investigate the total, inelastic, and (quasi-)elastic cross sections in p A and γ ⋆ A collisions, as these observables are insensitive to possible collective effects in the final state interactions. We used as a tool the DIPSY dipole model, which is based on BFKL dynamics including non-leading effects, saturation, and colour interference, which we have extended to describe collisions of protons and virtual photons with nuclei. We present results for collisions with O, Cu, and Pb nuclei, and reproduce preliminary data on the pPb inelastic cross section at LHC by CMS and LHCb. The large NN cross section results in p A scattering that scales approximately with the area. The results are compared with conventional Glauber model calculations, and we note that the more subtle dynamical effects are more easily studied in the ratios between the total, inelastic and (quasi-)elastic cross sections. The smaller photon interaction makes the γ ⋆ A collisions more closely proportional to A, and we see here that future electron-ion colliders would be valuable complements to the p A collisions in studies of dynamical effects from correlations, coherence and fluctuations in the initial state in high energy nuclear collisions.

  14. Out-of-plane electret-based MEMS energy harvester with the combined nonlinear effect from electrostatic force and a mechanical elastic stopper

    NASA Astrophysics Data System (ADS)

    Tao, Kai; Woh Lye, Sun; Miao, Jianmin; Tang, Lihua; Hu, Xiao

    2015-10-01

    This paper presents the fabrication, modeling and characterization of an out-of-plane electret-based vibrational energy harvester (e-VEH) that has both positive and negative charged electret plates integrated into a single seismic mass system. Strong electrostatic spring-softening effect is induced due to the electric field provided by the double-charged electret plates. An elastic stopper is introduced for reliability concern by limiting the motion of seismic mass and meanwhile serves as a functional element to realize spring-hardening effect. The device has an overall volume of about 0.14 cm3 and is fabricated based on MEMS compatible silicon micromachining technology. When subject to weak excitations, the device exhibits an approximately linear frequency response but changes to a significantly larger broadband when strongly excited due to the combined nonlinear effect from electrostatic force and a mechanical elastic stopper. At a high excitation level of 0.48 g, the experimental results show that the device has 3 dB bandwidths of 3.7 Hz for frequency-up sweep and 2.8 Hz for frequency-down sweep, respectively, which demonstrate a large enhancement compared to the linear response (1.3 Hz). An optimal output power of 0.95 μW is also achieved with a low resonance of 95 Hz. This corresponds to a normalized power density of 37.4 μW cm-3 g-2.

  15. A comprehensive and comparative study of elastic electron scattering from OCS and CS2 in the energy region from 1.2 to 200 eV.

    PubMed

    Murai, H; Ishijima, Y; Mitsumura, T; Sakamoto, Y; Kato, H; Hoshino, M; Blanco, F; García, G; Limão-Vieira, P; Brunger, M J; Buckman, S J; Tanaka, H

    2013-02-01

    We report absolute differential cross sections (DCSs) for elastic electron scattering from OCS (carbonyl sulphide) and CS(2) (carbon disulphide) in the impact energy range of 1.2-200 eV and for scattering angles from 10° to 150°. Above 10 eV, the angular distributions are found to agree quite well with our present calculations using two semi-phenomenological theoretical approaches. One employs the independent-atom model with the screening-corrected additivity rule (IAM-SCAR), while the other uses the continuum-multiple-scattering method in conjunction with a parameter-free exchange-polarization approximation. Since OCS is a polar molecule, further dipole-induced rotational excitation cross sections have been calculated in the framework of the first Born approximation and incoherently added to the IAM-SCAR results. In comparison with the calculated DCS for the S atom, atomic-like behavior for the angular distributions in both the OCS and CS(2) scattering systems is observed. Integrated elastic cross sections are obtained by extrapolating the experimental measurements, with the aid of the theoretical calculations, for those scattering angles below 10° and above 150°. These values are then compared with the available total cross sections. PMID:23406114

  16. Threshold anomaly in the elastic scattering of {sup 6}He on {sup 209}Bi

    SciTech Connect

    Garcia, A. R.; Padron, I.; Lubian, J.; Gomes, P. R. S.; Lacerda, T.; Garcia, V. N.

    2007-12-15

    The energy dependence of the optical potential for the elastic scattering of {sup 6}He on {sup 209}Bi at near and subbarrier energies is studied. Elastic angular distributions and the reaction cross section were simultaneously fitted by performing some modifications in the ECIS code. A phenomenological optical model potential with the Woods-Saxon form was used. There are signatures that the so-called breakup threshold anomaly (BTA) is present in this system having a halo projectile {sup 6}He, as it had been found earlier for systems involving stable weakly bound nuclei.

  17. Relationships between available potential energy, kinetic energy, and extratropical cyclone activity within East Coast cyclogenetic regions

    NASA Astrophysics Data System (ADS)

    Zapotocny, John V.

    1987-07-01

    Interrelationships between the available potential energy and kinetic energy associated with extratropical cyclones are examined for portions of the First GARP Global Experiment (FGGE) year. The study is confined to the cyclogenetically active regions encompassing the eastern coasts of Asia and North America. Calculations of vertically integrated available potential energy (APE) and kinetic energy (KE) are done for an active winter storm period (February 14-28, 1979) and a relatively inactive summer period (July 1-15, 1979) using gridded isentropic data produced from the FGGE Level IIIa set of global analyses. During both the winter and summer study periods, good agreement is indicated between cyclone tracks and the spatial distributions of time mean and standard deviations of vertically integrated APE and KE. Energy distributions composited for rapidly strengthening and weakening storms show the patterns of available potential energy and kinetic energy which are associated with cyclones in these stages of development. The rapidly intensifying storms are accompanied by strong gradients in APE equatorward of the surface cyclone with maximum KE to the south and southwest of the storm center. Smaller values of kinetic energy and weaker gradients of available potential energy accompany the rapidly decaying storms. An examination of twice daily distributions of APE and KE for 29 individual cyclones reveals that a similar temporal evolution of vertically integrated energy patterns accompanies storms in these east coast regions. An example of this evolution is presented in conjunction with a case analysis of the February 1979 Presidents' Day cyclone along the east coast of North America.

  18. A model for a constrained, finitely deforming, elastic solid with rotation gradient dependent strain energy, and its specialization to von Kármán plates and beams

    NASA Astrophysics Data System (ADS)

    Srinivasa, A. R.; Reddy, J. N.

    2013-03-01

    The aim of this paper is to develop the governing equations for a fully constrained finitely deforming hyperelastic Cosserat continuum where the directors are constrained to rotate with the body rotation. This is the generalization of small deformation couple stress theories and would be useful for developing mathematical models for an elastic material with embedded stiff short fibers or inclusions (e.g., materials with carbon nanotubes or nematic elastomers, cellular materials with oriented hard phases, open cell foams, and other similar materials), that account for certain longer range interactions. The theory is developed as a limiting case of a regular Cosserat elastic material where the directors are allowed to rotate freely by considering the case of a high "rotational mismatch energy". The theory is developed using the formalism of Lagrangian mechanics, with the static case being based on Castigliano's first theorem. By considering the stretch U and the rotation R as additional independent variables and using the polar decomposition theorem as an additional constraint equation, we obtain the governing and as well as the boundary conditions for finite deformations. The resulting equations are further specialized for plane strain and axisymmetric finite deformations, deformations of beams and plates with small strain and moderate rotation, and for small deformation theories. We also show that the boundary conditions for this theory involve "surface tension" like terms due to the higher gradients in the strain energy function. For beams and plates, the rotational gradient dependent strain energy does not require additional variables (unlike Cosserat theories) and additional differential equations; nor do they raise the order of the differential equations, thus allowing us to include a material length scale dependent response at no extra "computational cost" even for finite deformation beam/plate theories

  19. Steam systems in industry: Energy use and energy efficiency improvement potentials

    SciTech Connect

    Einstein, Dan; Worrell, Ernst; Khrushch, Marta

    2001-07-22

    Steam systems are a part of almost every major industrial process today. Thirty-seven percent of the fossil fuel burned in US industry is burned to produce steam. In this paper we will establish baseline energy consumption for steam systems. Based on a detailed analysis of boiler energy use we estimate current energy use in boilers in U.S. industry at 6.1 Quads (6.4 EJ), emitting almost 66 MtC in CO{sub 2} emissions. We will discuss fuels used and boiler size distribution. We also describe potential savings measures, and estimate the economic energy savings potential in U.S. industry (i.e. having payback period of 3 years or less). We estimate the nationwide economic potential, based on the evaluation of 16 individual measures in steam generation and distribution. The analysis excludes the efficient use of steam and increased heat recovery. Based on the analysis we estimate the economic potential at 18-20% of total boiler energy use, resulting in energy savings approximately 1120-1190 TBtu ( 1180-1260 PJ). This results in a reduction of CO{sub 2} emissions equivalent to 12-13 MtC.

  20. A satellite investigation of energy flux and inferred potential drop in auroral electron energy spectra

    NASA Technical Reports Server (NTRS)

    Menietti, J. D.; Burch, J. L.

    1981-01-01

    The relationship between auroral electron energy flux and the inferred accelerating potential drop for accelerated Maxwellian distributions is investigated on the basis of Atmospheric Explorer D spectral measurements. An analytical approximation for the total downward energy flux carried by an isotropic Maxwellian electron population accelerated by a field-aligned electrostatic potential drop is derived which is valid for values of the electron energy/characteristic accelerated Maxwellian distribution energy which are less than the difference between the ratio of the magnetic field strengths at the altitude of observation and the altitude of potential drop, and unity. Data from the Low Energy Electron Experiment on board AE D obtained on both the dayside and the nightside during periods of significant inverted-V type electron precipitation shows that the 455 energy spectra considered, 160 of them, obtained between 60 and 85 deg invariant latitude, could be fit to accelerated Maxwellian distributions. The 160 Maxwellian spectra are then shown to be in agreement with the predictions of the accelerated Maxwellian model. Finally, analysis of individual spectra suggests that the altitude of the inferred potential drop is at a maximum near the center of the inverted-V structures.

  1. Gravitational potential energy and active deformation in the Apennines

    NASA Astrophysics Data System (ADS)

    D'Agostino, N.; England, P.; Hunstad, I.; Selvaggi, G.

    2014-07-01

    We use velocity measurements from a network of continuous GPS sites spanning the Apennines of peninsular Italy to test the hypothesis that the active deformation of the region is explained by variations in gravitational potential energy of the lithosphere. The simple geometry of the mountain chain allows us to treat the deformation as two-dimensional, neglecting gradients of velocity along the strike of the chain. Under this assumption, the integral of gravitational potential energy per unit area of the lithosphere (GPE) in the direction perpendicular to the chain is related by a simple expression to the velocity in the same direction. We show that the observed velocities match this expression with an RMS misfit of 0.5 mm/yr. This agreement suggests that deformation of the Apennines reflects a balance, within the mountain chain itself, between lateral variations in GPE and the stresses required to deform the lithosphere. Forces arising from processes external to the belt are not required to explain the observations.

  2. Computer simulations of glasses: the potential energy landscape

    NASA Astrophysics Data System (ADS)

    Raza, Zamaan; Alling, Björn; Abrikosov, Igor A.

    2015-07-01

    We review the current state of research on glasses, discussing the theoretical background and computational models employed to describe them. This article focuses on the use of the potential energy landscape (PEL) paradigm to account for the phenomenology of glassy systems, and the way in which it can be applied in simulations and the interpretation of their results. This article provides a broad overview of the rich phenomenology of glasses, followed by a summary of the theoretical frameworks developed to describe this phenomonology. We discuss the background of the PEL in detail, the onerous task of how to generate computer models of glasses, various methods of analysing numerical simulations, and the literature on the most commonly used model systems. Finally, we tackle the problem of how to distinguish a good glass former from a good crystal former from an analysis of the PEL. In summarising the state of the potential energy landscape picture, we develop the foundations for new theoretical methods that allow the ab initio prediction of the glass-forming ability of new materials by analysis of the PEL.

  3. Colloidal particles driven across periodic optical-potential-energy landscapes

    NASA Astrophysics Data System (ADS)

    Juniper, Michael P. N.; Straube, Arthur V.; Aarts, Dirk G. A. L.; Dullens, Roel P. A.

    2016-01-01

    We study the motion of colloidal particles driven by a constant force over a periodic optical potential energy landscape. First, the average particle velocity is found as a function of the driving velocity and the wavelength of the optical potential energy landscape. The relationship between average particle velocity and driving velocity is found to be well described by a theoretical model treating the landscape as sinusoidal, but only at small trap spacings. At larger trap spacings, a nonsinusoidal model for the landscape must be used. Subsequently, the critical velocity required for a particle to move across the landscape is determined as a function of the wavelength of the landscape. Finally, the velocity of a particle driven at a velocity far exceeding the critical driving velocity is examined. Both of these results are again well described by the two theoretical routes for small and large trap spacings, respectively. Brownian motion is found to have a significant effect on the critical driving velocity but a negligible effect when the driving velocity is high.

  4. An Ab Initio Based Potential Energy Surface for Water

    NASA Technical Reports Server (NTRS)

    Partridge, Harry; Schwenke, David W.; Langhoff, Stephen R. (Technical Monitor)

    1996-01-01

    We report a new determination of the water potential energy surface. A high quality ab initio potential energy surface (PES) and dipole moment function of water have been computed. This PES is empirically adjusted to improve the agreement between the computed line positions and those from the HITRAN 92 data base. The adjustment is small, nonetheless including an estimate of core (oxygen 1s) electron correlation greatly improves the agreement with experiment. Of the 27,245 assigned transitions in the HITRAN 92 data base for H2(O-16), the overall root mean square (rms) deviation between the computed and observed line positions is 0.125/cm. However the deviations do not correspond to a normal distribution: 69% of the lines have errors less than 0.05/cm. Overall, the agreement between the line intensities computed in the present work and those contained in the data base is quite good, however there are a significant number of line strengths which differ greatly.

  5. Constrained Broyden Dimer Method with Bias Potential for Exploring Potential Energy Surface of Multistep Reaction Process.

    PubMed

    Shang, Cheng; Liu, Zhi-Pan

    2012-07-10

    To predict the chemical activity of new matter is an ultimate goal in chemistry. The identification of reaction pathways using modern quantum mechanics calculations, however, often requires a high demand in computational power and good chemical intuition on the reaction. Here, a new reaction path searching method is developed by combining our recently developed transition state (TS) location method, namely, the constrained Broyden dimer method, with a basin-filling method via bias potentials, which allows the system to walk out from the energy traps at a given reaction direction. In the new method, the reaction path searching starts from an initial state without the need for preguessing the TS-like or final state structure and can proceed iteratively to the final state by locating all related TSs and intermediates. In each elementary reaction step, a reaction direction, such as a bond breaking, needs to be specified, the information of which is refined and preserved as a normal mode through biased dimer rotation. The method is tested successfully on the Baker reaction system (50 elementary reactions) with good efficiency and stability and is also applied to the potential energy surface exploration of multistep reaction processes in the gas phase and on the surface. The new method can be applied for the computational screening of new catalytic materials with a minimum requirement of chemical intuition. PMID:26588954

  6. The Nonlinear Spring and Energy Conservation.

    ERIC Educational Resources Information Center

    Sherfinski, John

    1989-01-01

    Describes an air track experiment demonstrating the transfer of mechanical energy from elastic potential to kinetic. Discusses four methods for calculating energy stored in the spring. Included are pictures, typical data, and graphs. (YP)

  7. Two-potential approach for electron-molecular collisions at intermediate and high energies - Application to e-N2 scatterings

    NASA Technical Reports Server (NTRS)

    Choi, B. H.; Poe, R. T.; Sun, J. C.; Shan, Y.

    1979-01-01

    A general theoretical approach is proposed for the calculation of elastic, vibrational, and rotational transitions for electron-molecule scattering at intermediate and high-electron-impact energies. In this formulation, contributions to the scattering process come from the incoherent sum of two dominant potentials: a short-range shielded nuclear Coulomb potential from individual atomic centers, and a permanent/induced long-range potential. Application to e-N2 scattering from 50-500 eV incident electron energies has yielded good agreement with absolutely calibrated experiments. Comparisons with other theoretical approaches are made. The physical picture as well as the general features of electron-molecule scattering process are discussed within the framework of the two-potential approach.

  8. Isotopic dependence of fusion enhancement of various heavy ion systems using energy dependent Woods-Saxon potential

    NASA Astrophysics Data System (ADS)

    Gautam, Manjeet Singh

    2015-01-01

    In the present work, the fusion of symmetric and asymmetric projectile-target combinations are deeply analyzed within the framework of energy dependent Woods-Saxon potential model (EDWSP model) in conjunction with one dimensional Wong formula and the coupled channel code CCFULL. The neutron transfer channels and the inelastic surface excitations of collision partners are dominating mode of couplings and the coupling of relative motion of colliding nuclei to such relevant internal degrees of freedom produces a significant fusion enhancement at sub-barrier energies. It is quite interesting that the effects of dominant intrinsic degrees of freedom such as multi-phonon vibrational states, neutron transfer channels and proton transfer channels can be simulated by introducing the energy dependence in the nucleus-nucleus potential (EDWSP model). In the EDWSP model calculations, a wide range of diffuseness parameter ranging from a = 0.85 fm to a = 0.97 fm, which is much larger than a value (a = 0.65 fm) extracted from the elastic scattering data, is needed to reproduce sub-barrier fusion data. However, such diffuseness anomaly, which might be an artifact of some dynamical effects, has been resolved by trajectory fluctuation dissipation (TFD) model wherein the resulting nucleus-nucleus potential possesses normal diffuseness parameter.

  9. The potential for effluent trading in the energy industries.

    SciTech Connect

    Veil, J. A.; Environmental Assessment

    1998-01-01

    In January 1996, the US Environmental Protection Agency (EPA) released a policy statement endorsing wastewater effluent trading in watersheds, hoping to promote additional interest in the subject. The policy describes five types of effluent trades: point source/point source, point source/nonpoint source, pretreatment, intraplant and nonpoint source/nonpoint source. This paper evaluates the feasibility of implementing these types of effluent trading for facilities in the oil and gas, electric power and coal industries. This paper finds that the potential for effluent trading in these industries is limited because trades would generally need to involve toxic pollutants, which can only be traded under a narrow range of circumstances. However, good potential exists for other types of water-related trades that do not directly involve effluents (e.g. wetlands mitigation banking and voluntary environmental projects). The potential for effluent trading in the energy industries and in other sectors would be enhanced if Congress amended the Clean Water Act (CWA) to formally authorize such trading.

  10. Gravitational potential energy of the earth: A spherical harmonic approach

    NASA Technical Reports Server (NTRS)

    Rubincam, D. P.

    1977-01-01

    A spherical harmonic equation for the gravitational potential energy of the earth is derived for an arbitrary density distribution by conceptually bringing in mass-elements from infinity and building up the earth shell upon spherical shell. The zeroth degree term in the spherical harmonic equation agrees with the usual expression for the energy of a radial density distribution. The second degree terms give a maximum nonhydrostatic energy in the mantle and crust of -2.77 x 10 to the twenty-ninth power ergs, an order of magnitude. If the earth is assumed to be a homogeneous viscous oblate spheroid relaxing to an equilibrium shape, then a lower limit to the mantle viscosity of 1.3 x 10 to the twentieth power poises is found by assuming the total geothermal flux is due to viscous dissipation. If the nonequilibrium figure is dynamically maintained by the earth acting as a heat engine at one per cent efficiency, then the viscosity is ten to the twenty second power poises, a number preferred by some as the viscosity of the mantle.

  11. Epicardial Application Of Laser Energy In Vivo: Acute Arrhythmogenic Potential

    NASA Astrophysics Data System (ADS)

    Cohen, Mark H.; Ben-Shachar, Giora; Beder, Stanley D.; Sivakoff, Mark; Riemenschneider, Thomas A.

    1986-01-01

    In order to assess the effect of laser energy on the heart's rhythm, 7 newborn pigs each had 3 two-second applications of laser energy directly to the left ventricular epicardial surface. A quartz fiberoptic delivery system was used. All piglets (in all 21 applications) had ventricular arrhythmia induced. This varied from single premature ventricular contractions to sustained(112 seconds) ventricular tachycardia (6/7 piglets). The sustained ventri-cular tachycardia exhibited electrophysiologic criteria of a "re-entrant" mechanism. Fifteen minutes following lasing, programmed ventricular stimulation, a technique that indicates whether a substrate may be present for spontaneous re-entrant arrhythmias, showed induced arrhythmia in only 2/7 pigs, neither sustained. We conclude that epicardial application of laser energy frequently results in significant ventricular arrhythmia. This arrhythmia appears to be re-entrant in nature. Fowever, shortly following lasing, sustained arrhythmia could not be induced. Therefore, we feel that more knowledge about the arrhythmogenic potential of laser lesions is needed prior to wide-spread clinical application.

  12. Potential contribution of wind energy to climate change mitigation

    NASA Astrophysics Data System (ADS)

    Barthelmie, R. J.; Pryor, S. C.

    2014-08-01

    It is still possible to limit greenhouse gas emissions to avoid the 2 °C warming threshold for dangerous climate change. Here we explore the potential role of expanded wind energy deployment in climate change mitigation efforts. At present, most turbines are located in extra-tropical Asia, Europe and North America, where climate projections indicate continuity of the abundant wind resource during this century. Scenarios from international agencies indicate that this virtually carbon-free source could supply 10-31% of electricity worldwide by 2050 (refs , ). Using these projections within Intergovernmental Panel on Climate Change Representative Concentration Pathway (RCP) climate forcing scenarios, we show that dependent on the precise RCP followed, pursuing a moderate wind energy deployment plan by 2050 delays crossing the 2 °C warming threshold by 1-6 years. Using more aggressive wind turbine deployment strategies delays 2 °C warming by 3-10 years, or in the case of RCP4.5 avoids passing this threshold altogether. To maximize these climate benefits, deployment of non-fossil electricity generation must be coupled with reduced energy use.

  13. Calculating Potential Energy Curves with Quantum Monte Carlo

    NASA Astrophysics Data System (ADS)

    Powell, Andrew D.; Dawes, Richard

    2014-06-01

    Quantum Monte Carlo (QMC) is a computational technique that can be applied to the electronic Schrödinger equation for molecules. QMC methods such as Variational Monte Carlo (VMC) and Diffusion Monte Carlo (DMC) have demonstrated the capability of capturing large fractions of the correlation energy, thus suggesting their possible use for high-accuracy quantum chemistry calculations. QMC methods scale particularly well with respect to parallelization making them an attractive consideration in anticipation of next-generation computing architectures which will involve massive parallelization with millions of cores. Due to the statistical nature of the approach, in contrast to standard quantum chemistry methods, uncertainties (error-bars) are associated with each calculated energy. This study focuses on the cost, feasibility and practical application of calculating potential energy curves for small molecules with QMC methods. Trial wave functions were constructed with the multi-configurational self-consistent field (MCSCF) method from GAMESS-US.[1] The CASINO Monte Carlo quantum chemistry package [2] was used for all of the DMC calculations. An overview of our progress in this direction will be given. References: M. W. Schmidt et al. J. Comput. Chem. 14, 1347 (1993). R. J. Needs et al. J. Phys.: Condensed Matter 22, 023201 (2010).

  14. Transition Metal Oxide Alloys as Potential Solar Energy Conversion Materials

    SciTech Connect

    Toroker, Maytal; Carter, Emily A.

    2013-02-21

    First-row transition metal oxides (TMOs) are inexpensive potentia alternative materials for solar energy conversion devices. However, some TMOs, such as manganese(II) oxide, have band gaps that are too large for efficiently absorbing solar energy. Other TMOs, such as iron(II) oxide, have conduction and valence band edges with the same orbital character that may lead to unfavorably high electron–hole recombination rates. Another limitation of iron(II) oxide is that the calculated valence band edge is not positioned well for oxidizing water. We predict that key properties, including band gaps, band edge positions, and possibly electron–hole recombination rates, may be improved by alloying TMOs that have different band alignments. A new metric, the band gap center offset, is introduced for simple screening of potential parent materials. The concept is illustrated by calculating the electronic structure of binary oxide alloys that contain manganese, nickel, iron, zinc, and/or magnesium, within density functional theory (DFT)+U and hybrid DFT theories. We conclude that alloys of iron(II) oxide are worth evaluating further as solar energy conversion materials.

  15. Energy conservation potential of the US Department of Energy interim commercial building standards

    SciTech Connect

    Hadley, D.L.; Halverson, M.A.

    1993-12-01

    This report describes a project conducted to demonstrate the whole-building energy conservation potential achievable from full implementation of the US Department of Energy (DOE) Interim Energy Conservation Performance Standards for New Commercial and Multi-Family High Rise Residential Buildings. DOE`s development and implementation of energy performance standards for commercial buildings were established by the Energy Conservation Standards for New Buildings Act of 1976, as amended, Public Law (PL) 94-385, 42 USC 6831 et seq., hereinafter referred to as the Act. In accordance with the Act, DOE was to establish performance standards for both federal and private sector buildings ``to achieve the maximum practicable improvements in energy efficiency and use of non-depletable resources for all new buildings``.

  16. Elastic recoil cross section determination of deuterium by helium-4 ions at 30° with the energy range of 2.6-7.4 MeV

    NASA Astrophysics Data System (ADS)

    Han, Zhibin; Hao, Wanli; Wang, Chunjie; Shi, Liqun

    2016-05-01

    The elastic recoil cross section for D(4He, D) 4He was determined at a recoil angle of 30° over an incident helium energy range from 2.6 to 7.4 MeV. A thin solid target Ta/TiDx/Si used for cross section measurement was prepared by direct current magnetron sputtering, and it was so stable to ion beam bombardment that nearly no deuterium loss (less than 0.2%) exists over the whole experiment. A relative determination method is adopted in this measurement. It can avoid the error from the beam dose and the solid angle of the detectors and it is also free to direct measurement of D content in the film. The total uncertainty in the cross section determination is less than 5%.

  17. Advanced Elastic/Inelastic Nuclear Data Development Project

    SciTech Connect

    Harmon, Frank; Chowdhury, Partha; Greife, Uwe; Fisher Hicks, Sally; Tsvetkov, Pavel; Rahn Vanhoy, Jeffrey; Hill, Tony; Kawano, Toshihiko; Slaughter, David

    2015-06-08

    The optical model is used to analyze the elastic and inelastic scattering of nucleons, deuterons, hellions, tritons, and alpha particles by the nuclei. Since this paper covers primarily neutron-nucleus scattering, the focus will be limited to only that interaction. For the sake of this model, the nucleus is described as a blob of nuclear matter with properties based upon its number of nucleons. This infers that a single potential can describe the interaction of particles with different energies with different nuclei.

  18. Elastic scattering of electrons and positrons by atomic magnesium

    NASA Astrophysics Data System (ADS)

    Ismail Hossain, M.; Haque, A. K. F.; Atiqur, M.; Patoary, R.; Uddin, M. A.; Basak, A. K.

    2016-02-01

    The elastic, differential and integrated, and total cross sections for the scattering of electrons and positrons by magnesium atom have been calculated. These calculations are done within the framework of complex electron/positron-atom optical potential and relativistic Dirac partial wave analysis at the impact energies 0.1-1000 eV for both the projectiles. The present results are compared with available experimental data and some other theoretical calculations.

  19. Exploring the local elastic properties of bilayer membranes using molecular dynamics simulations.

    PubMed

    Pieffet, Gilles; Botero, Alonso; Peters, Günther H; Forero-Shelton, Manu; Leidy, Chad

    2014-11-13

    Membrane mechanical elastic properties regulate a variety of cellular processes involving local membrane deformation, such as ion channel function and vesicle fusion. In this work, we used molecular dynamics simulations to estimate the local elastic properties of a membrane. For this, we calculated the energy needed to extract a DOPE lipid molecule, modified with a linker chain, from a POPC bilayer membrane using the umbrella sampling technique. Although the extraction energy entails several contributions related not only to elastic deformation but also to solvation, careful analysis of the potential of mean force (PMF) allowed us to dissect the elastic contribution. With this information, we calculated an effective linear spring constant of 44 ± 4 kJ·nm(-2)·mol(-1) for the DOPC membrane, in agreement with experimental estimates. The membrane deformation profile was determined independently during the stretching process in molecular detail, allowing us to fit this profile to a previously proposed continuum elastic model. Through this approach, we calculated an effective membrane spring constant of 42 kJ·nm(-2)·mol(-1), which is in good agreement with the PMF calculation. Furthermore, the solvation energy we derived from the data is shown to match the solvation energy estimated from critical micelle formation constants. This methodology can be used to determine how changes in lipid composition or the presence of membrane modifiers can affect the elastic properties of a membrane at a local level. PMID:25325715

  20. Energy-momentum conserving higher-order time integration of nonlinear dynamics of finite elastic fiber-reinforced continua

    NASA Astrophysics Data System (ADS)

    Erler, Norbert; Groß, Michael

    2015-05-01

    Since many years the relevance of fibre-reinforced polymers is steadily increasing in fields of engineering, especially in aircraft and automotive industry. Due to the high strength in fibre direction, but the possibility of lightweight construction, these composites replace more and more traditional materials as metals. Fibre-reinforced polymers are often manufactured from glass or carbon fibres as attachment parts or from steel or nylon cord as force transmission parts. Attachment parts are mostly subjected to small strains, but force transmission parts usually suffer large deformations in at least one direction. Here, a geometrically nonlinear formulation is necessary. Typical examples are helicopter rotor blades, where the fibres have the function to stabilize the structure in order to counteract large centrifugal forces. For long-run analyses of rotor blade deformations, we have to apply numerically stable time integrators for anisotropic materials. This paper presents higher-order accurate and numerically stable time stepping schemes for nonlinear elastic fibre-reinforced continua with anisotropic stress behaviour.