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Sample records for calculate elastic moduli

  1. Atomistic Calculation of Elastic Moduli in Strained Silicon

    National Research Council Canada - National Science Library

    Zhu, Richard; Pan, Ernian; Chung, Peter W; Cai, Xinli; Liew, Kim M; Buldum, Alper

    2007-01-01

    .... Using our approach, the bulk modulus, effective elastic stiffnesses C11, C12, and C44 of the strained silicon, including also the effective Young's modulus and Poisson's ratio, are all calculated...

  2. Elastic Moduli of Carbon Nanohorns

    Directory of Open Access Journals (Sweden)

    Dinesh Kumar

    2011-01-01

    Full Text Available Carbon nanotube is a special case of carbon nanohorns or carbon nanocones with zero apex angle. Research into carbon nanohorns started almost at the same time as the discovery of nanotubes in 1991. Most researchers focused on the investigation of nanotubes, and the exploration of nanohorns attracted little attention. To model the carbon nanohorns, we make use of a more reliable second-generation reactive empirical bond-order potential by Brenner and coworkers. We investigate the elastic moduli and conclude that these nanohorns are equally strong and require in-depth investigation. The values of Young's and Shear moduli decrease with apex angle.

  3. Monte Carlo calculations of the elastic moduli and pressure-volume-temperature equation of state for hexahydro-1,3,5-trinitro-1,3,5-triazine

    International Nuclear Information System (INIS)

    Sewell, Thomas D.; Bennett, Carl M.

    2000-01-01

    Isothermal-isobaric Monte Carlo calculations were used to obtain predictions of the elastic coefficients and derived engineering moduli and Poisson ratios for crystalline hexahydro-1,3,5-trinitro-1,3,5-triazine (RDX). The elastic coefficients were computed using the strain fluctuation formula due to Rahman and Parrinello [J. Chem. Phys. 76, 2662 (1982)]. Calculations were performed as a function of temperature (218 K≤T≤333 K) and hydrostatic pressure (0 GPa≤p≤4 GPa). The predicted values of the moduli and Poisson ratios under ambient conditions are in accord with general expectations for molecular crystals and with a very recent, unpublished determination for RDX. The moduli exhibit a sensitive pressure dependence whereas the Poisson ratios are relatively independent of pressure. The temperature dependence of the moduli is comparable to the precision of the results. However, the crystal does exhibit thermal softening for most pressures. An additional product of the calculations is information about the pressure-volume-temperature (pVT) equation of state. We obtain near-quantitative agreement with experiment for the case of hydrostatic compression and reasonable, but not quantitative, correspondence for thermal expansion. The results indicate a significant dependence of the thermal expansion coefficients on hydrostatic pressure. (c) 2000 American Institute of Physics

  4. Dynamic elastic moduli of rocks under pressure

    Energy Technology Data Exchange (ETDEWEB)

    Schock, R N [Lawrence Radiation Laboratory, University of California, Livermore, CA (United States)

    1970-05-01

    Elastic moduli are determined as a function of confining pressure to 10 kb on rocks in which Plowshare shots are to be fired. Numerical simulation codes require accurate information on the mechanical response of the rock medium to various stress levels in order to predict cavity dimensions. The theoretical treatment of small strains in an elastic medium relates the propagation velocity of compressional and shear waves to the elastic moduli. Velocity measurements can provide, as unique code input data, the rigidity modulus, Poisson' ratio and the shear wave velocity, as well as providing checks on independent determinations of the other moduli. Velocities are determined using pulsed electro-mechanical transducers and measuring the time-of-flight in the rock specimen. A resonant frequency of 1 MHz is used to insure that the wavelength exceeds the average grain dimension and is subject to bulk rock properties. Data obtained on a variety of rock types are presented and analyzed. These data are discussed in terms of their relationship to moduli measured by static methods as well as the effect of anisotropy, porosity, and fractures. In general, fractured rocks with incipient cracks show large increases in velocity and moduli in the first 1 to 2 kb of compression as a result of the closing of these voids. After this, the velocities increase much more slowly. Dynamic moduli for these rocks are often 10% higher than corresponding static moduli at low pressure, but this difference decreases as the voids are closed until the moduli agree within experimental error. The discrepancy at low pressure is a result of the elastic energy in the wave pulse being propagated around cracks, with little effect on propagation velocity averaged over the entire specimen. (author)

  5. Dynamic elastic moduli of rocks under pressure

    International Nuclear Information System (INIS)

    Schock, R.N.

    1970-01-01

    Elastic moduli are determined as a function of confining pressure to 10 kb on rocks in which Plowshare shots are to be fired. Numerical simulation codes require accurate information on the mechanical response of the rock medium to various stress levels in order to predict cavity dimensions. The theoretical treatment of small strains in an elastic medium relates the propagation velocity of compressional and shear waves to the elastic moduli. Velocity measurements can provide, as unique code input data, the rigidity modulus, Poisson' ratio and the shear wave velocity, as well as providing checks on independent determinations of the other moduli. Velocities are determined using pulsed electro-mechanical transducers and measuring the time-of-flight in the rock specimen. A resonant frequency of 1 MHz is used to insure that the wavelength exceeds the average grain dimension and is subject to bulk rock properties. Data obtained on a variety of rock types are presented and analyzed. These data are discussed in terms of their relationship to moduli measured by static methods as well as the effect of anisotropy, porosity, and fractures. In general, fractured rocks with incipient cracks show large increases in velocity and moduli in the first 1 to 2 kb of compression as a result of the closing of these voids. After this, the velocities increase much more slowly. Dynamic moduli for these rocks are often 10% higher than corresponding static moduli at low pressure, but this difference decreases as the voids are closed until the moduli agree within experimental error. The discrepancy at low pressure is a result of the elastic energy in the wave pulse being propagated around cracks, with little effect on propagation velocity averaged over the entire specimen. (author)

  6. In Silico Measurement of Elastic Moduli of Nematic Liquid Crystals

    Science.gov (United States)

    Sidky, Hythem; de Pablo, Juan J.; Whitmer, Jonathan K.

    2018-03-01

    Experiments on confined droplets of the nematic liquid crystal 5CB have questioned long-established bounds imposed on the elastic free energy of nematic systems. This elasticity, which derives from molecular alignment within nematic systems, is quantified through a set of moduli which can be difficult to measure experimentally and, in some cases, can only be probed indirectly. This is particularly true of the surfacelike saddle-splay elastic term, for which the available experimental data indicate values on the cusp of stability, often with large uncertainties. Here, we demonstrate that all nematic elastic moduli, including the saddle-splay elastic constant k24, may be calculated directly from atomistic molecular simulations. Importantly, results obtained through in silico measurements of the 5CB elastic properties demonstrate unambiguously that saddle-splay elasticity alone is unable to describe the observed confined morphologies.

  7. Plutonium Elastic Moduli, Electron Localization, and Temperature

    International Nuclear Information System (INIS)

    Migliori, Albert; Mihut-Stroe, Izabella; Betts, Jon B.

    2008-01-01

    In almost all materials, compression is accompanied naturally by stiffening. Even in materials with zero or negative thermal expansion, where warming is accompanied by volume contraction it is the volume change that primarily controls elastic stiffness. Not so in the metal plutonium. In plutonium, alloying with gallium can change the sign of thermal expansion, but for the positive thermal- expansion monoclinic phase as well as the face-centered-cubic phase with either sign of thermal expansion, and the orthorhombic phase, recent measurements of elastic moduli show soften on warming by an order of magnitude more than expected, the shear and compressional moduli track, and volume seems irrelevant. These effects point toward a novel mechanism for electron localization, and have important implication for the pressure dependence of the bulk compressibility. (authors)

  8. Elastic Moduli of Permanently Densified Silica Glasses

    Science.gov (United States)

    Deschamps, T.; Margueritat, J.; Martinet, C.; Mermet, A.; Champagnon, B.

    2014-01-01

    Modelling the mechanical response of silica glass is still challenging, due to the lack of knowledge concerning the elastic properties of intermediate states of densification. An extensive Brillouin Light Scattering study on permanently densified silica glasses after cold compression in diamond anvil cell has been carried out, in order to deduce the elastic properties of such glasses and to provide new insights concerning the densification process. From sound velocity measurements, we derive phenomenological laws linking the elastic moduli of silica glass as a function of its densification ratio. The found elastic moduli are in excellent agreement with the sparse data extracted from literature, and we show that they do not depend on the thermodynamic path taken during densification (room temperature or heating). We also demonstrate that the longitudinal sound velocity exhibits an anomalous behavior, displaying a minimum for a densification ratio of 5%, and highlight the fact that this anomaly has to be distinguished from the compressibility anomaly of a-SiO2 in the elastic domain. PMID:25431218

  9. Correlation between temperature dependence of elastic moduli and Debye temperature of paramagnetic metal

    International Nuclear Information System (INIS)

    Bodryakov, V.Yu.; Povzner, A.A.

    2000-01-01

    The correlation between the temperature dependence of elastic moduli and the Debye temperature of paramagnetic metal is analyzed in neglect of the temperature dependence of the Poison coefficient σ within the frames of the Debye-Grueneisen presentations. It is shown, that namely the temperature dependence of the elastic moduli determines primarily the temperature dependence of the Debye temperature Θ(T). On the other hand, the temperature dependence Θ(T) very weakly effects the temperature dependence of the elastic moduli. The later made it possible to formulate the self-consistent approach to calculation of the elastic moduli temperature dependence. The numerical estimates of this dependence parameters are conducted by the example of the all around compression modulus of the paramagnetic lutetium [ru

  10. Extrapolation of bulk rock elastic moduli of different rock types to high pressure conditions and comparison with texture-derived elastic moduli

    Science.gov (United States)

    Ullemeyer, Klaus; Lokajíček, Tomás; Vasin, Roman N.; Keppler, Ruth; Behrmann, Jan H.

    2018-02-01

    In this study elastic moduli of three different rock types of simple (calcite marble) and more complex (amphibolite, micaschist) mineralogical compositions were determined by modeling of elastic moduli using texture (crystallographic preferred orientation; CPO) data, experimental investigation and extrapolation. 3D models were calculated using single crystal elastic moduli, and CPO measured using time-of-flight neutron diffraction at the SKAT diffractometer in Dubna (Russia) and subsequently analyzed using Rietveld Texture Analysis. To define extrinsic factors influencing elastic behaviour, P-wave and S-wave velocity anisotropies were experimentally determined at 200, 400 and 600 MPa confining pressure. Functions describing variations of the elastic moduli with confining pressure were then used to predict elastic properties at 1000 MPa, revealing anisotropies in a supposedly crack-free medium. In the calcite marble elastic anisotropy is dominated by the CPO. Velocities continuously increase, while anisotropies decrease from measured, over extrapolated to CPO derived data. Differences in velocity patterns with sample orientation suggest that the foliation forms an important mechanical anisotropy. The amphibolite sample shows similar magnitudes of extrapolated and CPO derived velocities, however the pattern of CPO derived velocity is closer to that measured at 200 MPa. Anisotropy decreases from the extrapolated to the CPO derived data. In the micaschist, velocities are higher and anisotropies are lower in the extrapolated data, in comparison to the data from measurements at lower pressures. Generally our results show that predictions for the elastic behavior of rocks at great depths are possible based on experimental data and those computed from CPO. The elastic properties of the lower crust can, thus, be characterized with an improved degree of confidence using extrapolations. Anisotropically distributed spherical micro-pores are likely to be preserved, affecting

  11. Stress relaxation and creep on living cells with the atomic force microscope: a means to calculate elastic moduli and viscosities of cell components

    International Nuclear Information System (INIS)

    Moreno-Flores, Susana; Toca-Herrera, Jose Luis; Benitez, Rafael; Vivanco, Maria dM

    2010-01-01

    In this work we present a unified method to study the mechanical properties of cells using the atomic force microscope. Stress relaxation and creep compliance measurements permitted us to determine, the relaxation times, the Young moduli and the viscosity of breast cancer cells (MCF-7). The results show that the mechanical behaviour of MCF-7 cells responds to a two-layered model of similar elasticity but differing viscosity. Treatment of MCF-7 cells with an actin-depolymerising agent results in an overall decrease in both cell elasticity and viscosity, however to a different extent for each layer. The layer that undergoes the smaller decrease (36-38%) is assigned to the cell membrane/cortex while the layer that experiences the larger decrease (70-80%) is attributed to the cell cytoplasm. The combination of the method presented in this work, together with the approach based on stress relaxation microscopy (Moreno-Flores et al 2010 J. Biomech. 43 349-54), constitutes a unique AFM-based experimental framework to study cell mechanics. This methodology can also be extended to study the mechanical properties of biomaterials in general.

  12. Structures and Elastic Moduli of Polymer Nanocomposite Thin Films

    Science.gov (United States)

    Yuan, Hongyi; Karim, Alamgir; University of Akron Team

    2014-03-01

    Polymeric thin films generally possess unique mechanical and thermal properties due to confinement. In this study we investigated structures and elastic moduli of polymer nanocomposite thin films, which can potentially find wide applications in diverse areas such as in coating, permeation and separation. Conventional thermoplastics (PS, PMMA) and biopolymers (PLA, PCL) were chosen as polymer matrices. Various types of nanoparticles were used including nanoclay, fullerene and functionalized inorganic particles. Samples were prepared by solvent-mixing followed by spin-coating or flow-coating. Film structures were characterized using X-ray scattering and transmission electron microscopy. Elastic moduli were measured by strain-induced elastic buckling instability for mechanical measurements (SIEBIMM), and a strengthening effect was found in certain systems due to strong interaction between polymers and nanoparticles. The effects of polymer structure, nanoparticle addition and film thickness on elastic modulus will be discussed and compared with bulk materials.

  13. Morphology and linear-elastic moduli of random network solids.

    Science.gov (United States)

    Nachtrab, Susan; Kapfer, Sebastian C; Arns, Christoph H; Madadi, Mahyar; Mecke, Klaus; Schröder-Turk, Gerd E

    2011-06-17

    The effective linear-elastic moduli of disordered network solids are analyzed by voxel-based finite element calculations. We analyze network solids given by Poisson-Voronoi processes and by the structure of collagen fiber networks imaged by confocal microscopy. The solid volume fraction ϕ is varied by adjusting the fiber radius, while keeping the structural mesh or pore size of the underlying network fixed. For intermediate ϕ, the bulk and shear modulus are approximated by empirical power-laws K(phi)proptophin and G(phi)proptophim with n≈1.4 and m≈1.7. The exponents for the collagen and the Poisson-Voronoi network solids are similar, and are close to the values n=1.22 and m=2.11 found in a previous voxel-based finite element study of Poisson-Voronoi systems with different boundary conditions. However, the exponents of these empirical power-laws are at odds with the analytic values of n=1 and m=2, valid for low-density cellular structures in the limit of thin beams. We propose a functional form for K(ϕ) that models the cross-over from a power-law at low densities to a porous solid at high densities; a fit of the data to this functional form yields the asymptotic exponent n≈1.00, as expected. Further, both the intensity of the Poisson-Voronoi process and the collagen concentration in the samples, both of which alter the typical pore or mesh size, affect the effective moduli only by the resulting change of the solid volume fraction. These findings suggest that a network solid with the structure of the collagen networks can be modeled in quantitative agreement by a Poisson-Voronoi process. Copyright © 2011 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  14. Correlations between elastic moduli and properties in bulk metallic glasses

    International Nuclear Information System (INIS)

    Wang Weihua

    2006-01-01

    A survey of the elastic, mechanical, fragility, and thermodynamic properties of bulk metallic glasses (BMGs) and glass-forming liquids is presented. It is found that the elastic moduli of BMGs have correlations with the glass transition temperature, melting temperature, mechanical properties, and even liquid fragility. On the other hand, the elastic constants of available BMGs show a rough correlation with a weighted average of the elastic constants for the constituent elements. Although the theoretical and physical reasons for the correlations are to be clarified, these correlations could assist in understanding the long-standing issues of glass formation and the nature of glass and simulate the work of theorists. Based on the correlation, we show that the elastic moduli can assist in selecting alloying components for controlling the elastic properties and glass-forming ability of the BMGs and thus can guide BMG design. As case study, we report the formation of the families of rare-earth-based BMGs with controllable properties

  15. REDUCED ISOTROPIC CRYSTAL MODEL WITH RESPECT TO THE FOURTH-ORDER ELASTIC MODULI

    Directory of Open Access Journals (Sweden)

    O. Burlayenko

    2018-04-01

    Full Text Available Using a reduced isotropic crystal model the relationship between the fourth-order elastic moduli of an isotropic medium and the independent components of the fourth-order elastic moduli tensor of real crystals of various crystal systems is found. To calculate the coefficients of these relations, computer algebra systems Redberry and Mathematica for working with high order tensors in the symbolic and explicit form were used, in light of the overly complex computation. In an isotropic medium, there are four independent fourth order elastic moduli. This is due to the presence of four invariants for an eighth-rank tensor in the three-dimensional space, that has symmetries over the pairs of indices. As an example, the moduli of elasticity of an isotropic medium corresponding to certain crystals of cubic system are given (LiF, NaCl, MgO, CaF2. From the obtained results it can be seen that the reduced isotropic crystal model can be most effectively applied to high-symmetry crystal systems.

  16. Third-order elastic moduli for alkali-halide crystals possessing the sodium chloride structure

    International Nuclear Information System (INIS)

    Ray, U.

    2010-01-01

    The values of third-order elastic moduli for alkali halides, having NaCl-type crystal structure are calculated according to the Born-Mayer potential model, considering the repulsive interactions up to the second nearest neighbours and calculating the values of the potential parameters for each crystal, independently, from the compressibility data. This work presents the first published account of the calculation of the third-order elastic moduli taking the actual value of the potential parameter unlike the earlier works. Third-order elastic constants have been computed for alkali halides at 0 and 300 K. The results of the third-order elastic constants are compared with the available experimental and theoretical data. Very good agreement between experimental and theoretical third-order elastic constant data (except C 123 ) is found. We have also computed the values of the pressure derivatives of second-order elastic constants and Anderson-Grueneisen parameter for alkali halides, which agree reasonably well with the experimental values, indicating the satisfactory nature of our computed data for third-order elastic constants.

  17. Elastic moduli of a Brownian colloidal glass former

    Science.gov (United States)

    Fritschi, S.; Fuchs, M.

    2018-01-01

    The static, dynamic and flow-dependent shear moduli of a binary mixture of Brownian hard disks are studied by an event-driven molecular dynamics simulation. Thereby, the emergence of rigidity close to the glass transition encoded in the static shear modulus G_∞ is accessed by three methods. Results from shear stress auto-correlation functions, elastic dispersion relations, and the elastic response to strain deformations upon the start-up of shear flow are compared. This enables one to sample the time-dependent shear modulus G(t) consistently over several decades in time. By that a very precise specification of the glass transition point and of G_∞ is feasible. Predictions by mode coupling theory of a finite shear modulus at the glass transition, of α-scaling in fluid states close to the transition, and of shear induced decay in yielding glass states are tested and broadly verified.

  18. Thermodynamics and elastic moduli of fluids with steeply repulsive potentials

    Science.gov (United States)

    Heyes, D. M.

    1997-08-01

    Analytic expressions for the thermodynamic properties and elastic moduli of molecular fluids interacting with steeply repulsive potentials are derived using Rowlinson's hard-sphere perturbation treatment which employs a softness parameter, λ specifying the deviation from the hard-sphere potential. Generic potentials of this form might be used to represent the interactions between near-hard-sphere stabilized colloids. Analytic expressions for the equivalent hard-sphere diameter of inverse power [ɛ(σ/r)n where ɛ sets the energy scale and σ the distance scale] exponential and logarithmic potential forms are derived using the Barker-Henderson formula. The internal energies in the hard-sphere limit are predicted essentially exactly by the perturbation approach when compared against molecular dynamics simulation data using the same potentials. The elastic moduli are similarly accurately predicted in the hard-sphere limit, as they are trivially related to the internal energy. The compressibility factors from the perturbation expansion do not compare as favorably with simulation data, and in this case the Carnahan-Starling equation of state prediction using the analytic effective hard-sphere diameter would appear to be a preferable route for this thermodynamic property. A more refined state point dependent definition for the effective hard-sphere diameter is probably required for this property.

  19. Elastic moduli and elastic anisotropy of cold sprayed metallic coatings

    Czech Academy of Sciences Publication Activity Database

    Seiner, Hanuš; Cizek, J.; Sedlák, Petr; Huang, R.; Cupera, J.; Dlouhý, I.; Landa, Michal

    2016-01-01

    Roč. 291, April (2016), s. 342-347 ISSN 0257-8972 R&D Projects: GA ČR GA13-13616S; GA ČR(CZ) GA13-35890S Grant - others:NETME Centre Plus - národní program udržitelnosti(CZ) LO1202 Institutional support: RVO:61388998 Keywords : kinetic spray * CGDS * elastic properties * metals and alloys * deposition * resonant ultrasound spectroscopy Subject RIV: JG - Metallurgy Impact factor: 2.589, year: 2016 http://ac.els-cdn.com/S0257897216301165/1-s2.0-S0257897216301165-main.pdf?_tid=1083617a-017f-11e6-92e7-00000aacb361&acdnat=1460555773_2e80d3df20843f3af649bf3ac71c8844

  20. Interface effects on effective elastic moduli of nanocrystalline materials

    International Nuclear Information System (INIS)

    Wang Gangfeng; Feng Xiqiao; Yu Shouwen; Nan Cewen

    2003-01-01

    Interfaces often play a significant role in many physical properties and phenomena of nanocrystalline materials (NcMs). In the present paper, the interface effects on the effective elastic property of NcMs are investigated. First, an atomic potential method is suggested for estimating the effective elastic modulus of an interface phase. Then, the Mori-Tanaka effective field method is employed to determine the overall effective elastic moduli of a nanocrystalline material, which is regarded as a binary composite consisting of a crystal or inclusion phase with regular lattice connected by an amorphous-like interface or matrix phase. Finally, the stiffening effects of strain gradients are examined on the effective elastic property by using the strain gradient theory to analyze a representative unit cell. Our analysis shows two physical mechanisms of interfaces that influence the effective stiffness and other mechanical properties of materials. One is the softening effect due to the distorted atomic structures and the increased atomic spacings in interface regions, and another is the baffling effect due to the existence of boundary layers between the interface phase and the crystalline phase

  1. Elastic Moduli of Nanoparticle-Polymer Composite Thin Films via Buckling on Elastomeric Substrates

    Science.gov (United States)

    Yuan, Hongyi; Karim, Alamgir; University of Akron Team

    2011-03-01

    Polymeric thin films find applications in diverse areas such as coatings, barriers and packaging. The dispersion of nanoparticles into the films was proven to be an effective method to generate tunable properties, particularly mechanical strength. However, there are very few methods for mechanical characterization of the composite thin films with high accuracy. In this study, nanometric polystyrene and polyvinyl alcohol films with uniformly dispersed cobalt and Cloisite nanoparticles at varying concentrations were synthesized via flow-coating and then transferred to crosslinked polydimethylsiloxane (PDMS) flexible substrates. The technique of Strain-Induced Elastic Buckling Instability for Mechanical Measurements (SIEBIMM) was employed to determine the elastic moduli of the films, which were calculated from the buckling patterns generated by applying compressive stresses. Results on moduli of films as a function of the concentrations of nanoparticles and the thicknesses of the composite films will be presented. *Corresponding author: alamgir@uakron.edu

  2. Equivalent elastic moduli of a zigzag single-walled carbon nanotube given by uniform radial deformation

    International Nuclear Information System (INIS)

    Li Ying; Qiu Xinming; Yin Yajun; Yang Fan; Fan Qinshan

    2009-01-01

    Under hydrostatic pressure, the equivalent elastic moduli of a zigzag single-walled carbon nanotube (SWNT) are analytically determined by energy conservation, with the consideration of the covalent bond deformation. The theoretical predictions on the transverse mechanical properties of a zigzag SWNT agree reasonably well with those given by the molecular structures mechanics simulations and also the ab initio calculations. From the simple geometry calculation, the circumferential strain is about 2-3 times of the axial strain of a zigzag SWNT under hydrostatic pressure. The bulk modulus of a zigzag SWNT is found to be 3/7 times of its radial Young's modulus.

  3. The relationship between 3D bone architectural parameters and elastic moduli of three orthogonal directions predicted from finite elements analysis

    International Nuclear Information System (INIS)

    Park, Kwan Soo; Lee, Sam Sun; Huh, Kyung Hoe; Yi, Wan Jin; Heo, Min Suk; Choi, Soon Chul

    2008-01-01

    To investigate the relationship between 3D bone architectural parameters and direction-related elastic moduli of cancellous bone of mandibular condyle. Two micro-pigs (Micro-pigR, PWG Genetics Korea) were used. Each pig was about 12 months old and weighing around 44 kg. 31 cylindrical bone specimen were obtained from cancellous bone of condyles for 3D analysis and measured by micro-computed tomography. Six parameters were trabecular thickness (Tb.Th), bone specific surface (BS/BV), percent bone volume (BV/TV), structure model index (SMI), degree of anisotropy (DA) and 3-dimensional fractal dimension (3DFD). Elastic moduli of three orthogonal directions (superiorinferior (SI), medial-lateral (ML), andterior-posterior (AP) direction) were calculated through finite element analysis. Elastic modulus of superior-inferior direction was higher than those of other directions. Elastic moduli of 3 orthogonal directions showed different correlation with 3D architectural parameters. Elastic moduli of SI and ML directions showed significant strong to moderate correlation with BV/TV, SMI and 3DFD. Elastic modulus of cancellous bone of pig mandibular condyle was highest in the SI direction and it was supposed that the change into plate-like structure of trabeculae was mainly affected by increase of trabeculae of SI and ML directions.

  4. Experimental and theoretical investigation of the elastic moduli of silicate glasses and crystals

    Science.gov (United States)

    Philipps, Katharina; Stoffel, Ralf Peter; Dronskowski, Richard; Conradt, Reinhard

    2017-02-01

    A combined quantum-mechanical and thermodynamic approach to the mechanical properties of multicomponent silicate glasses is presented. Quantum chemical calculations based on density-functional theory (DFT) on various silicate systems were performed to explore the crystalline polymorphs existing for a given chemical composition. These calculations reproduced the properties of known polymorphs even in systems with extensive polymorphism, like MgSiO3. Properties resting on the atomic and electronic structure, i.e., molar volumes (densities) and bulk moduli were predicted correctly. The theoretical data (molar equilibrium volumes, bulk moduli) were then used to complement the available experimental data. In a phenomenological evaluation, experimental data of bulk moduli, a macroscopic property resting on phononic structure, were found to linearly scale with the ratios of atomic space demand to actual molar volume in a universal way. Silicates ranging from high-pressure polymorphs to glasses were represented by a single master line. This suggests that above the Debye limit (in practice: above room temperature), the elastic waves probe the short range order coordination polyhedra and their next-neighbor linkage only, while the presence or absence of an extended translational symmetry is irrelevant. As a result, glasses can be treated - with respect to the properties investigated - as commensurable members of polymorphic series. Binary glasses fit the very same line as their one-component end-members, again both in the crystalline and glassy state. Finally, it is shown that the macroscopic properties of multicomponent glasses also are linear superpositions of the properties of their constitutional phases (as determined from phase diagrams or by thermochemical calculations) taken in their respective glassy states. This is verified experimentally for heat capacities and Young’s moduli of industrial glass compositions. It can be concluded, that the combined quantum

  5. On elastic moduli and elastic anisotropy in polycrystalline martensitic NiTi

    International Nuclear Information System (INIS)

    Qiu, S.; Clausen, B.; Padula, S.A.; Noebe, R.D.; Vaidyanathan, R.

    2011-01-01

    A combined experimental and computational effort was undertaken to provide insight into the elastic response of B19' martensitic NiTi variants as they exist in bulk, polycrystalline aggregate form during monotonic tensile and compressive loading. The experimental effort centered on using in situ neutron diffraction during loading to measure elastic moduli in several directions along with an average Young's modulus and a Poisson's ratio. The measurements were compared with predictions from a 30,000 variant, self-consistent polycrystalline deformation model that accounted for the elastic intergranular constraint, and also with predictions of single crystal behavior from previously published ab initio studies. Variant conversion and detwinning processes that influenced the intergranular constraint occurred even at stresses where the macroscopic stress-strain response appeared linear. Direct evidence of these processes was revealed in changes in texture, which were captured in inverse pole figures constructed from the neutron diffraction measurements.

  6. On elastic moduli and elastic anisotropy in polycrystalline martensitic NiTi

    Energy Technology Data Exchange (ETDEWEB)

    Qiu, S. [Advanced Materials Processing and Analysis Center (AMPAC), Mechanical, Materials and Aerospace Engineering Department, University of Central Florida, Orlando, FL 32816 (United States); Clausen, B. [Los Alamos National Laboratory, Los Alamos, NM 87545 (United States); Padula, S.A.; Noebe, R.D. [NASA Glenn Research Center, Cleveland, OH 44135 (United States); Vaidyanathan, R., E-mail: raj@mail.ucf.edu [Advanced Materials Processing and Analysis Center (AMPAC), Mechanical, Materials and Aerospace Engineering Department, University of Central Florida, Orlando, FL 32816 (United States)

    2011-08-15

    A combined experimental and computational effort was undertaken to provide insight into the elastic response of B19' martensitic NiTi variants as they exist in bulk, polycrystalline aggregate form during monotonic tensile and compressive loading. The experimental effort centered on using in situ neutron diffraction during loading to measure elastic moduli in several directions along with an average Young's modulus and a Poisson's ratio. The measurements were compared with predictions from a 30,000 variant, self-consistent polycrystalline deformation model that accounted for the elastic intergranular constraint, and also with predictions of single crystal behavior from previously published ab initio studies. Variant conversion and detwinning processes that influenced the intergranular constraint occurred even at stresses where the macroscopic stress-strain response appeared linear. Direct evidence of these processes was revealed in changes in texture, which were captured in inverse pole figures constructed from the neutron diffraction measurements.

  7. A first-principles study of cementite (Fe{sub 3}C) and its alloyed counterparts: Elastic constants, elastic anisotropies, and isotropic elastic moduli

    Energy Technology Data Exchange (ETDEWEB)

    Ghosh, G., E-mail: g-ghosh@northwestern.edu [Department of Materials Science and Engineering, Robert R. McCormick School of Engineering and Applied Science, Northwestern University, 2220 Campus Drive, Evanston, IL 60208-3108 (United States)

    2015-08-15

    A comprehensive computational study of elastic properties of cementite (Fe{sub 3}C) and its alloyed counterparts (M{sub 3}C (M = Al, Co, Cr, Cu, Fe, Hf, Mn, Mo, Nb, Ni, Si, Ta, Ti, V, W, Zr, Cr{sub 2}FeC and CrFe{sub 2}C) having the crystal structure of Fe{sub 3}C is carried out employing electronic density-functional theory (DFT), all-electron PAW pseudopotentials and the generalized gradient approximation for the exchange-correlation energy (GGA). Specifically, as a part of our systematic study of cohesive properties of solids and in the spirit of materials genome, following properties are calculated: (i) single-crystal elastic constants, C{sub ij}, of above M{sub 3}Cs; (ii) anisotropies of bulk, Young’s and shear moduli, and Poisson’s ratio based on calculated C{sub ij}s, demonstrating their extreme anisotropies; (iii) isotropic (polycrystalline) elastic moduli (bulk, shear, Young’s moduli and Poisson’s ratio) of M{sub 3}Cs by homogenization of calculated C{sub ij}s; and (iv) acoustic Debye temperature, θ{sub D}, of M{sub 3}Cs based on calculated C{sub ij}s. We provide a critical appraisal of available data of polycrystalline elastic properties of alloyed cementite. Calculated single crystal properties may be incorporated in anisotropic constitutive models to develop and test microstructure-processing-property-performance links in multi-phase materials where cementite is a constituent phase.

  8. Size-dependent elastic moduli and vibrational properties of fivefold twinned copper nanowires

    Science.gov (United States)

    Zheng, Y. G.; Zhao, Y. T.; Ye, H. F.; Zhang, H. W.

    2014-08-01

    Based on atomistic simulations, the elastic moduli and vibration behaviors of fivefold twinned copper nanowires are investigated in this paper. Simulation results show that the elastic (i.e., Young’s and shear) moduli exhibit size dependence due to the surface effect. The effective Young’s modulus is found to decrease slightly whereas the effective shear modulus increases slightly with the increase in the wire radius. Both moduli tend to approach certain values at a larger radius and can be suitably described by core-shell composite structure models. Furthermore, we show by comparing simulation results and continuum predictions that, provided the effective Young’s and shear moduli are used, classic elastic theory can be applied to describe the small-amplitude vibration of fivefold twinned copper nanowires. Moreover, for the transverse vibration, the Timoshenko beam model is more suitable because shear deformation becomes apparent.

  9. Size-dependent elastic moduli and vibrational properties of fivefold twinned copper nanowires

    International Nuclear Information System (INIS)

    Zheng, Y G; Zhao, Y T; Ye, H F; Zhang, H W

    2014-01-01

    Based on atomistic simulations, the elastic moduli and vibration behaviors of fivefold twinned copper nanowires are investigated in this paper. Simulation results show that the elastic (i.e., Young’s and shear) moduli exhibit size dependence due to the surface effect. The effective Young’s modulus is found to decrease slightly whereas the effective shear modulus increases slightly with the increase in the wire radius. Both moduli tend to approach certain values at a larger radius and can be suitably described by core-shell composite structure models. Furthermore, we show by comparing simulation results and continuum predictions that, provided the effective Young’s and shear moduli are used, classic elastic theory can be applied to describe the small-amplitude vibration of fivefold twinned copper nanowires. Moreover, for the transverse vibration, the Timoshenko beam model is more suitable because shear deformation becomes apparent. (paper)

  10. QUANTITATIVE NON-DESTRUCTIVE EVALUATION (QNDE) OF THE ELASTIC MODULI OF POROUS TIAL ALLOYS

    International Nuclear Information System (INIS)

    Yeheskel, O.

    2008-01-01

    The elastic moduli of γ-TiA1 were studied in porous samples consolidated by various techniques e.g. cold isostatic pressing (CIP), pressure-less sintering, or hot isostatic pressing (HIP). Porosity linearly affects the dynamic elastic moduli of samples. The results indicate that the sound wave velocities and the elastic moduli affected by the processing route and depend not only on the attained density but also on the consolidation temperature. In this paper we show that there is linear correlation between the shear and the longitudinal sound velocities in porous TiA1. This opens the way to use a single sound velocity as a tool for quantitative non-destructive evaluation (QNDE) of porous TiA1 alloys. Here we demonstrate the applicability of an equation derived from the elastic theory and used previously for porous cubic metals

  11. Experimentally-based multiscale model of the elastic moduli of bovine trabecular bone and its constituents

    Energy Technology Data Exchange (ETDEWEB)

    Hamed, Elham [University of Illinois at Urbana-Champaign, Department of Mechanical Science and Engineering, 1206 West Green Street, Urbana, IL 61801 (United States); Novitskaya, Ekaterina, E-mail: eevdokim@ucsd.edu [University of California, San Diego, Department of Mechanical and Aerospace Engineering, Materials Science and Engineering Program, 9500 Gilman Dr., La Jolla, CA 92093 (United States); Li, Jun; Jasiuk, Iwona [University of Illinois at Urbana-Champaign, Department of Mechanical Science and Engineering, 1206 West Green Street, Urbana, IL 61801 (United States); McKittrick, Joanna [University of California, San Diego, Department of Mechanical and Aerospace Engineering, Materials Science and Engineering Program, 9500 Gilman Dr., La Jolla, CA 92093 (United States)

    2015-09-01

    The elastic moduli of trabecular bone were modeled using an analytical multiscale approach. Trabecular bone was represented as a porous nanocomposite material with a hierarchical structure spanning from the collagen–mineral level to the trabecular architecture level. In parallel, compression testing was done on bovine femoral trabecular bone samples in two anatomical directions, parallel to the femoral neck axis and perpendicular to it, and the measured elastic moduli were compared with the corresponding theoretical results. To gain insights on the interaction of collagen and minerals at the nanoscale, bone samples were deproteinized or demineralized. After such processing, the treated samples remained as self-standing structures and were tested in compression. Micro-computed tomography was used to characterize the hierarchical structure of these three bone types and to quantify the amount of bone porosity. The obtained experimental data served as inputs to the multiscale model and guided us to represent bone as an interpenetrating composite material. Good agreement was found between the theory and experiments for the elastic moduli of the untreated, deproteinized, and demineralized trabecular bone. - Highlights: • A multiscale model was used to predict the elastic moduli of trabecular bone. • Samples included demineralized, deproteinized and untreated bone. • The model portrays bone as a porous, interpenetrating two phase composite. • The experimental elastic moduli for trabecular bone fell between theoretical bounds.

  12. Experimentally-based multiscale model of the elastic moduli of bovine trabecular bone and its constituents

    International Nuclear Information System (INIS)

    Hamed, Elham; Novitskaya, Ekaterina; Li, Jun; Jasiuk, Iwona; McKittrick, Joanna

    2015-01-01

    The elastic moduli of trabecular bone were modeled using an analytical multiscale approach. Trabecular bone was represented as a porous nanocomposite material with a hierarchical structure spanning from the collagen–mineral level to the trabecular architecture level. In parallel, compression testing was done on bovine femoral trabecular bone samples in two anatomical directions, parallel to the femoral neck axis and perpendicular to it, and the measured elastic moduli were compared with the corresponding theoretical results. To gain insights on the interaction of collagen and minerals at the nanoscale, bone samples were deproteinized or demineralized. After such processing, the treated samples remained as self-standing structures and were tested in compression. Micro-computed tomography was used to characterize the hierarchical structure of these three bone types and to quantify the amount of bone porosity. The obtained experimental data served as inputs to the multiscale model and guided us to represent bone as an interpenetrating composite material. Good agreement was found between the theory and experiments for the elastic moduli of the untreated, deproteinized, and demineralized trabecular bone. - Highlights: • A multiscale model was used to predict the elastic moduli of trabecular bone. • Samples included demineralized, deproteinized and untreated bone. • The model portrays bone as a porous, interpenetrating two phase composite. • The experimental elastic moduli for trabecular bone fell between theoretical bounds

  13. Digitally controlled measurement of sonic elastic moduli and internal friction by phase analysis

    International Nuclear Information System (INIS)

    O'Brien, M.H.; Hunter, O. Jr.; Rasmussen, M.D.; Skank, H.D.

    1983-01-01

    An automated system is described for measuring internal friction and elastic moduli using sonic resonance techniques. This mirocomputer-controlled device does phase angle analysis in addition to traditional decay and peak-width internal friction measurement. The apparatus may be programmed to make measurements at any sequence of temperatures between room temperature and 1600 0 C

  14. Pressure derivatives of elastic moduli of fused quartz to 10 kb

    Science.gov (United States)

    Peselnick, L.; Meister, R.; Wilson, W.H.

    1967-01-01

    Measurements of the longitudinal and shear moduli were made on fused quartz to 10 kb at 24??5??C. The anomalous behavior of the bulk modulus K at low pressure, ???K ???P 0, at higher pressures. The pressure derivative of the rigidity modulus ???G ???P remains constant and negative for the pressure range covered. A 15-kb hydrostatic pressure vessel is described for use with ultrasonic pulse instrumentation for precise measurements of elastic moduli and density changes with pressure. The placing of the transducer outside the pressure medium, and the use of C-ring pressure seals result in ease of operation and simplicity of design. ?? 1967.

  15. Modal Damping Ratio and Optimal Elastic Moduli of Human Body Segments for Anthropometric Vibratory Model of Standing Subjects.

    Science.gov (United States)

    Gupta, Manoj; Gupta, T C

    2017-10-01

    The present study aims to accurately estimate inertial, physical, and dynamic parameters of human body vibratory model consistent with physical structure of the human body that also replicates its dynamic response. A 13 degree-of-freedom (DOF) lumped parameter model for standing person subjected to support excitation is established. Model parameters are determined from anthropometric measurements, uniform mass density, elastic modulus of individual body segments, and modal damping ratios. Elastic moduli of ellipsoidal body segments are initially estimated by comparing stiffness of spring elements, calculated from a detailed scheme, and values available in literature for same. These values are further optimized by minimizing difference between theoretically calculated platform-to-head transmissibility ratio (TR) and experimental measurements. Modal damping ratios are estimated from experimental transmissibility response using two dominant peaks in the frequency range of 0-25 Hz. From comparison between dynamic response determined form modal analysis and experimental results, a set of elastic moduli for different segments of human body and a novel scheme to determine modal damping ratios from TR plots, are established. Acceptable match between transmissibility values calculated from the vibratory model and experimental measurements for 50th percentile U.S. male, except at very low frequencies, establishes the human body model developed. Also, reasonable agreement obtained between theoretical response curve and experimental response envelop for average Indian male, affirms the technique used for constructing vibratory model of a standing person. Present work attempts to develop effective technique for constructing subject specific damped vibratory model based on its physical measurements.

  16. A Statistical Learning Framework for Materials Science: Application to Elastic Moduli of k-nary Inorganic Polycrystalline Compounds.

    Science.gov (United States)

    de Jong, Maarten; Chen, Wei; Notestine, Randy; Persson, Kristin; Ceder, Gerbrand; Jain, Anubhav; Asta, Mark; Gamst, Anthony

    2016-10-03

    Materials scientists increasingly employ machine or statistical learning (SL) techniques to accelerate materials discovery and design. Such pursuits benefit from pooling training data across, and thus being able to generalize predictions over, k-nary compounds of diverse chemistries and structures. This work presents a SL framework that addresses challenges in materials science applications, where datasets are diverse but of modest size, and extreme values are often of interest. Our advances include the application of power or Hölder means to construct descriptors that generalize over chemistry and crystal structure, and the incorporation of multivariate local regression within a gradient boosting framework. The approach is demonstrated by developing SL models to predict bulk and shear moduli (K and G, respectively) for polycrystalline inorganic compounds, using 1,940 compounds from a growing database of calculated elastic moduli for metals, semiconductors and insulators. The usefulness of the models is illustrated by screening for superhard materials.

  17. Simultaneous measurement of field dependence of elastic moduli by laser interferometry

    CERN Document Server

    Bayon, A; Salazar, F

    2000-01-01

    A methodology is applied which allows the simultaneous determination of Young's modulus and the shear modulus to evaluate elastic moduli variations with the magnetic field (DELTA E and DELTA G). The method employed is based on the simultaneous detection of the transverse and torsional natural frequencies of a slender magnetic bar located within a solenoid. The resultant vibration is detected via a heterodyne interferometric optical system with a broad bandwidth. The vibration detection and excitation systems do not interact with the sample. The applicability of the method is demonstrated by characterizing 10-mm-diameter nickel bars. The results are compared with those obtained from longitudinal vibrations.

  18. Effect of rotation on the elastic moduli of solid 4He

    Science.gov (United States)

    Tsuiki, T.; Takahashi, D.; Murakawa, S.; Okuda, Y.; Kono, K.; Shirahama, K.

    2018-02-01

    We report measurements of elastic moduli of hcp solid 4He down to 15 mK when the samples are rotated unidirectionally. Recent investigations have revealed that the elastic behavior of solid 4He is dominated by gliding of dislocations and pinning of them by 3He impurities, which move in the solidlike Bloch waves (impuritons). Motivated by the recent controversy of torsional oscillator studies, we have performed direct measurements of shear and Young's moduli of annular solid 4He using pairs of quarter-circle-shape piezoelectric transducers (PZTs) while the whole apparatus is rotated with angular velocity Ω up to 4 rad/s. We have found that shear modulus μ is suppressed by rotation below 80 mK, when shear strain applied by PZT exceeds a critical value, above which μ decreases because the shear strain unbinds dislocations from 3He impurities. The rotation-induced decrement of μ at Ω =4 rad/s is about 14.7(12.3)% of the total change of temperature dependent μ for solid samples of pressure 3.6(5.4) MPa. The decrements indicate that the probability of pinning of 3He on dislocation segment G decreases by several orders of magnitude. We propose that the motion of 3He impuritons under rotation becomes strongly anisotropic by the Coriolis force, resulting a decrease in G for dislocation lines aligning parallel to the rotation axis.

  19. Ridge regression for predicting elastic moduli and hardness of calcium aluminosilicate glasses

    Science.gov (United States)

    Deng, Yifan; Zeng, Huidan; Jiang, Yejia; Chen, Guorong; Chen, Jianding; Sun, Luyi

    2018-03-01

    It is of great significance to design glasses with satisfactory mechanical properties predictively through modeling. Among various modeling methods, data-driven modeling is such a reliable approach that can dramatically shorten research duration, cut research cost and accelerate the development of glass materials. In this work, the ridge regression (RR) analysis was used to construct regression models for predicting the compositional dependence of CaO-Al2O3-SiO2 glass elastic moduli (Shear, Bulk, and Young’s moduli) and hardness based on the ternary diagram of the compositions. The property prediction over a large glass composition space was accomplished with known experimental data of various compositions in the literature, and the simulated results are in good agreement with the measured ones. This regression model can serve as a facile and effective tool for studying the relationship between the compositions and the property, enabling high-efficient design of glasses to meet the requirements for specific elasticity and hardness.

  20. Effect of TeO2 on the elastic moduli of sodium borate glasses

    International Nuclear Information System (INIS)

    Saddeek, Y.B.; Abd El Latif, Lamia

    2004-01-01

    Sodium borate glass containing tellurite as Te x Na 2-2x B 4-4x O 7-5x with x=0, 0.05, 0.15, 0.25 and 0.35 have been prepared by rapid quenching. Ultrasonic velocity (both longitudinal and shear) measurements have been made using a transducer operated at the fundamental frequency of 4 MHz at room temperature. The density was measured by the conventional Archimedes method. The elastic moduli, the Debye temperature, Poisson's ratio, and the parameters derived from the Makishima-Mackenzie model and the bond compression model have been obtained as a function of TeO 2 content. The monotonic decrease in the velocities and the elastic moduli, and the increase in the ring diameter and the ratio K bc /K e as a function of TeO 2 modifier content reveals the loose packing structure, which is attributed to the increase in the molar volume and the reduction in the vibrations of the borate lattice. The observed results confirm that the addition of TeO 2 changes the rigid character of Na 2 B 4 O 7 to a matrix of ionic behaviour bonds (NBOs). This is due to the creation of more and more discontinuities and defects in the glasses, thus breaking down the borax structure

  1. The Determination of ’In Situ’ Anisotropic Elastic Moduli from Laboratory Ultrasonic and Field Seismic Measurements.

    Science.gov (United States)

    feet of the uppermost Kayenta sandstone unit at the Mixed Company site, for which the in situ elastic moduli are determined to be as follows: C11...and plastic anisotropic properties of Kayenta sandstone from the Mixed Company site are in poor agreement with newly generated data. (Author)

  2. Structural control of elastic moduli in ferrogels and the importance of non-affine deformations

    Science.gov (United States)

    Pessot, Giorgio; Cremer, Peet; Borin, Dmitry Y.; Odenbach, Stefan; Löwen, Hartmut; Menzel, Andreas M.

    2014-09-01

    One of the central appealing properties of magnetic gels and elastomers is that their elastic moduli can reversibly be adjusted from outside by applying magnetic fields. The impact of the internal magnetic particle distribution on this effect has been outlined and analyzed theoretically. In most cases, however, affine sample deformations are studied and often regular particle arrangements are considered. Here we challenge these two major simplifications by a systematic approach using a minimal dipole-spring model. Starting from different regular lattices, we take into account increasingly randomized structures, until we finally investigate an irregular texture taken from a real experimental sample. On the one hand, we find that the elastic tunability qualitatively depends on the structural properties, here in two spatial dimensions. On the other hand, we demonstrate that the assumption of affine deformations leads to increasingly erroneous results the more realistic the particle distribution becomes. Understanding the consequences of the assumptions made in the modeling process is important on our way to support an improved design of these fascinating materials.

  3. Temperature- and thickness-dependent elastic moduli of polymer thin films

    Directory of Open Access Journals (Sweden)

    Ao Zhimin

    2011-01-01

    Full Text Available Abstract The mechanical properties of polymer ultrathin films are usually different from those of their counterparts in bulk. Understanding the effect of thickness on the mechanical properties of these films is crucial for their applications. However, it is a great challenge to measure their elastic modulus experimentally with in situ heating. In this study, a thermodynamic model for temperature- (T and thickness (h-dependent elastic moduli of polymer thin films Ef(T,h is developed with verification by the reported experimental data on polystyrene (PS thin films. For the PS thin films on a passivated substrate, Ef(T,h decreases with the decreasing film thickness, when h is less than 60 nm at ambient temperature. However, the onset thickness (h*, at which thickness Ef(T,h deviates from the bulk value, can be modulated by T. h* becomes larger at higher T because of the depression of the quenching depth, which determines the thickness of the surface layer δ.

  4. Preparation and Elastic Moduli of Germanate Glass Containing Lead and Bismuth

    Directory of Open Access Journals (Sweden)

    Wan M. M. Yunus

    2012-04-01

    Full Text Available This paper reports the rapid melt quenching technique preparation for the new family of bismuth-lead germanate glass (BPG systems in the form of (GeO260–(PbO40−x–(½Bi2O3x where x = 0 to 40 mol%. Their densities with respect of Bi2O3 concentration were determined using Archimedes’ method with acetone as a floatation medium. The current experimental data are compared with those of bismuth lead borate (B2O320–(PbO80−x–(Bi2O3x. The elastic properties of BPG were studied using the ultrasonic pulse-echo technique where both longitudinal and transverse sound wave velocities have been measured in each glass samples at a frequency of 15 MHz and at room temperature. Experimental data shows that all the physical parameters of BPG including density and molar volume, both longitudinal and transverse velocities increase linearly with increasing of Bi2O3 content in the germanate glass network. Their elastic moduli such as longitudinal, shear and Young’s also increase linearly with addition of Bi2O3 but the bulk modulus did not. The Poisson’s ratio and fractal dimensionality are also found to vary linearly with the Bi2O3 concentration.

  5. Preparation and elastic moduli of germanate glass containing lead and bismuth.

    Science.gov (United States)

    Sidek, Hj A A; Bahari, Hamid R; Halimah, Mohamed K; Yunus, Wan M M

    2012-01-01

    This paper reports the rapid melt quenching technique preparation for the new family of bismuth-lead germanate glass (BPG) systems in the form of (GeO(2))(60)-(PbO)(40-) (x)-(½Bi(2)O(3))(x) where x = 0 to 40 mol%. Their densities with respect of Bi(2)O(3) concentration were determined using Archimedes' method with acetone as a floatation medium. The current experimental data are compared with those of bismuth lead borate (B(2)O(3))(20)-(PbO)(80-) (x)-(Bi(2)O(3))(x). The elastic properties of BPG were studied using the ultrasonic pulse-echo technique where both longitudinal and transverse sound wave velocities have been measured in each glass samples at a frequency of 15 MHz and at room temperature. Experimental data shows that all the physical parameters of BPG including density and molar volume, both longitudinal and transverse velocities increase linearly with increasing of Bi(2)O(3) content in the germanate glass network. Their elastic moduli such as longitudinal, shear and Young's also increase linearly with addition of Bi(2)O(3) but the bulk modulus did not. The Poisson's ratio and fractal dimensionality are also found to vary linearly with the Bi(2)O(3) concentration.

  6. Complete volumetric decomposition of individual trabecular plates and rods and its morphological correlations with anisotropic elastic moduli in human trabecular bone.

    Science.gov (United States)

    Liu, X Sherry; Sajda, Paul; Saha, Punam K; Wehrli, Felix W; Bevill, Grant; Keaveny, Tony M; Guo, X Edward

    2008-02-01

    Trabecular plates and rods are important microarchitectural features in determining mechanical properties of trabecular bone. A complete volumetric decomposition of individual trabecular plates and rods was used to assess the orientation and morphology of 71 human trabecular bone samples. The ITS-based morphological analyses better characterize microarchitecture and help predict anisotropic mechanical properties of trabecular bone. Standard morphological analyses of trabecular architecture lack explicit segmentations of individual trabecular plates and rods. In this study, a complete volumetric decomposition technique was developed to segment trabecular bone microstructure into individual plates and rods. Contributions of trabecular type-associated morphological parameters to the anisotropic elastic moduli of trabecular bone were studied. Seventy-one human trabecular bone samples from the femoral neck (FN), tibia, and vertebral body (VB) were imaged using muCT or serial milling. Complete volumetric decomposition was applied to segment trabecular bone microstructure into individual plates and rods. The orientation of each individual trabecula was determined, and the axial bone volume fractions (aBV/TV), axially aligned bone volume fraction along each orthotropic axis, were correlated with the elastic moduli. The microstructural type-associated morphological parameters were derived and compared with standard morphological parameters. Their contributions to the anisotropic elastic moduli, calculated by finite element analysis (FEA), were evaluated and compared. The distribution of trabecular orientation suggested that longitudinal plates and transverse rods dominate at all three anatomic sites. aBV/TV along each axis, in general, showed a better correlation with the axial elastic modulus (r(2) = 0.95 approximately 0.99) compared with BV/TV (r(2) = 0.93 approximately 0.94). The plate-associated morphological parameters generally showed higher correlations with the

  7. Comparison of slowness profiles of lamb wave with elastic moduli and crystal structure in single crystalline silicon wafers

    Energy Technology Data Exchange (ETDEWEB)

    Min, Young Jae; Yun, Gyeong Won; Kim, Kyung Min; Roh, Yuji; Kim, Young H. [Applied Acoustics Lab, Korea Science Academy of KAIST, Busan (Korea, Republic of)

    2016-02-15

    Single crystalline silicon wafers having (100), (110), and (111) directions are employed as specimens for obtaining slowness profiles. Leaky Lamb waves (LLW) from immersed wafers were detected by varying the incident angles of the specimens and rotating the specimens. From an analysis of LLW signals for different propagation directions and phase velocities of each specimen, slowness profiles were obtained, which showed a unique symmetry with different symmetric axes. Slowness profiles were compared with elastic moduli of each wafer. They showed the same symmetries as crystal structures. In addition, slowness profiles showed expected patterns and values that can be inferred from elastic moduli. This implies that slowness profiles can be used to examine crystal structures of anisotropic solids.

  8. Elasticity, electronic properties and hardness of MoC investigated by first principles calculations

    International Nuclear Information System (INIS)

    Liu, YangZhen; Jiang, YeHua; Feng, Jing; Zhou, Rong

    2013-01-01

    The crystal structure, cohesive energy, formation enthalpy, mechanical anisotropy, electronic properties and hardness of α−MoC, β−MoC and γ−MoC are investigated by the first-principles calculations. The elastic constants and the bulk moduli, shear moduli, Young's moduli are calculated. The Young's modulus values of α−MoC, β−MoC and γ−MoC are 395.6 GPa, 551.2 GPa and 399.5 GPa, respectively. The surface constructions of Young's moduli identify the mechanical anisotropy of molybdenum carbide, and the results show that anisotropy of α−MoC is stronger than others. The electronic structure indicates that the bonding behaviors of MoC are the combinations of covalent and metallic bonds. The hardness of β−MoC is obviously higher than those of α−MoC and γ−MoC

  9. Determination of hoop direction effective elastic moduli of non-circular profile, fiber reinforced polymer composite sewer liner pipes from lateral ring compression tests

    International Nuclear Information System (INIS)

    Czél, Gergely; Takács, Dénes

    2015-01-01

    A new material property determination method is presented for the calculation of effective elastic moduli of non-circular ring specimens cut from filament wound oval profile polymer composite sewer liner pipes. The hoop direction elastic moduli was determined using the test results obtained from ring compression tests, which is a very basic setup, and requires no special equipment. Calculations were executed for many different oval profiles, and diagrams were constructed, from which the cross section dependent C_e_f_f constants can be taken. The new method was validated by the comparison of tests and finite element analysis results. The calculation method and the diagrams are essential design tools for engineers, and a big step forward in sizing non-circular profile liner pipes. - Highlights: • A simple modulus measurement method is presented for non-circular ring specimens. • The evaluation method is validated against a finite element model. • Profile shape dependent constants are presented for a wide range of cross-sections. • A set of charts with the constants are provided to aid design engineers.

  10. Ceramic strengthening by tuning the elastic moduli of resin-based luting agents.

    Science.gov (United States)

    Spazzin, Aloísio O; Bacchi, Ataís; Alessandretti, Rodrigo; Santos, Mateus B; Basso, Gabriela R; Griggs, Jason; Moraes, Rafael R

    2017-03-01

    Resin-based luting agents (RBLAs) with tuned elastic moduli (E) were prepared and their influence on the strengthening, reliability, and mode of failure of luted feldspar ceramic was investigated. RBLAs with low E (2.6GPa), intermediate E (6.6GPa), and high E (13.3GPa) were prepared and used to coat acid-etched ceramic disks. Positive (untreated ceramic) and negative (acid-etched ceramic) control groups were tested. The response variables (n=30) were biaxial flexural strength (σ bf , MPa), characteristic strength (σ 0 , MPa), and Weibull modulus at the ceramic surface (z=0) and luting agent surface (z=-t 2 ). A 3D finite element analysis simulated the biaxial flexural test. Fractographic analysis and morphology of the bonded interfaces were analyzed using scanning electron microscopy. The RBLAs improved σ bf and σ 0 at z=0, particularly those with intermediate and high E, whereas the mechanical reliability was only affected in the negative control. At z=-t 2 , differences between all RBLAs were observed but the structural reliability was independent of the RBLA tested. Increasing E of the RBLA was associated with increased stress concentration at the RBLA and reduced stresses reaching the ceramic. Failures originated on the ceramic surface at the ceramic-cement interface. In the high E group, failure sometimes originated from the RBLA free surface. All RBLAs completely filled the ceramic irregularities. Increased E of the RBLA reduced the variability of strength, the stress reaching the ceramic structure, and sometimes altered the origin of failure. The use of high E RBLAs seems beneficial for luting feldspar ceramics. Copyright © 2017 The Academy of Dental Materials. Published by Elsevier Ltd. All rights reserved.

  11. Elastic moduli of biological fibers in a coarse-grained model: crystalline cellulose and β-amyloids.

    Science.gov (United States)

    Poma, Adolfo B; Chwastyk, Mateusz; Cieplak, Marek

    2017-10-25

    We study the mechanical response of cellulose and β-amyloid microfibrils to three types of deformation: tensile, indentational, and shear. The cellulose microfibrils correspond to the allomorphs Iα or Iβ whereas the β-amyloid microfibrils correspond to the polymorphs of either two- or three-fold symmetry. This response can be characterized by three elastic moduli, namely, Y L , Y T , and S. We use a structure-based coarse-grained model to analyze the deformations in a unified manner. We find that each of the moduli is almost the same for the two allomorphs of cellulose but Y L is about 20 times larger than Y T (140 GPa vs. 7 GPa), indicating the existence of significant anisotropy. For cellulose we note that the anisotropy results from the involvement of covalent bonds in stretching. For β-amyloid, the sense of anisotropy is opposite to that of cellulose. In the three-fold symmetry case, Y L is about half of Y T (3 vs. 7) whereas for two-fold symmetry the anisotropy is much larger (1.6 vs. 21 GPa). The S modulus is derived to be 1.2 GPa for three-fold symmetry and one half of it for the other symmetry and 3.0 GPa for cellulose. The values of the moduli reflect deformations in the hydrogen-bond network. Unlike in our theoretical approach, no experiment can measure all three elastic moduli with the same apparatus. However, our theoretical results are consistent with various measured values: typical Y L for cellulose Iβ ranges from 133 to 155 GPa, Y T from 2 to 25 GPa, and S from 1.8 to 3.8 GPa. For β-amyloid, the experimental values of S and Y T are about 0.3 GPa and 3.3 GPa respectively, while the value of Y L has not been reported.

  12. Analytic approximations for the elastic moduli of two-phase materials

    DEFF Research Database (Denmark)

    Zhang, Z. J.; Zhu, Y. K.; Zhang, P.

    2017-01-01

    Based on the models of series and parallel connections of the two phases in a composite, analytic approximations are derived for the elastic constants (Young's modulus, shear modulus, and Poisson's ratio) of elastically isotropic two-phase composites containing second phases of various volume...

  13. Non-invasive determination of the complete elastic moduli of spider silks

    Science.gov (United States)

    Koski, Kristie J.; Akhenblit, Paul; McKiernan, Keri; Yarger, Jeffery L.

    2013-03-01

    Spider silks possess nature’s most exceptional mechanical properties, with unrivalled extensibility and high tensile strength. Unfortunately, our understanding of silks is limited because the complete elastic response has never been measured—leaving a stark lack of essential fundamental information. Using non-invasive, non-destructive Brillouin light scattering, we obtain the entire stiffness tensors (revealing negative Poisson’s ratios), refractive indices, and longitudinal and transverse sound velocities for major and minor ampullate spider silks: Argiope aurantia, Latrodectus hesperus, Nephila clavipes, Peucetia viridans. These results completely quantify the linear elastic response for all possible deformation modes, information unobtainable with traditional stress-strain tests. For completeness, we apply the principles of Brillouin imaging to spatially map the elastic stiffnesses on a spider web without deforming or disrupting the web in a non-invasive, non-contact measurement, finding variation among discrete fibres, junctions and glue spots. Finally, we provide the stiffness changes that occur with supercontraction.

  14. An in situ estimation of anisotropic elastic moduli for a submarine shale

    Science.gov (United States)

    Miller, Douglas E.; Leaney, Scott; Borland, William H.

    1994-11-01

    Direct arrival times and slownesses from wide-aperture walkaway vertical seismic profile data acquired in a layered anisotropic medium can be processed to give direct estimate of the phase slowness surface associated with the medium at the depth of the receivers. This slowness surface can, in turn, be fit by an estimated transversely isotropic medium with a vertical symmetry axis (a 'TIV' medium). While the method requires that the medium between the receivers and the surface be horizontally stratified, no further measurement or knowledge of that medium is required. When applied to data acquired in a compacting shale sequence (here termed the 'Petronas shale') encountered by a well in the South China Sea, the method yields an estimated TIV medium that fits the data extremely well over 180 deg of propagation angles sampled by 201 source positions. The medium is strongly anisotropic. The anisotropy is significantly anelliptic and implies that the quasi-shear mode should be triplicated for off-axis propagation. Estimated density-normalized moduli (in units of sq km/sq s) for the Petronas shale are A(sub 11) = 6.99 +/- 0.21, A(sub 33) = 5.53 +/- 0.17, A(sub 55) = 0.91 +/- 0.05, and A(sub 13) = 2.64 +/- 0.26. Densities in the logged zone just below the survey lie in the range between 2200 and 2400 kg/cu m with an average value close to 2300 kg/cu m.

  15. Effects of porosity on seismic velocities, elastic moduli and Poisson's ratios of solid materials and rocks

    Directory of Open Access Journals (Sweden)

    Chengbo Yu

    2016-02-01

    Full Text Available The generalized mixture rule (GMR is used to provide a unified framework for describing Young's (E, shear (G and bulk (K moduli, Lame parameter (λ, and P- and S-wave velocities (Vp and Vs as a function of porosity in various isotropic materials such as metals, ceramics and rocks. The characteristic J values of the GMR for E, G, K and λ of each material are systematically different and display consistent correlations with the Poisson's ratio of the nonporous material (ν0. For the materials dominated by corner-shaped pores, the fixed point at which the effective Poisson's ratio (ν remains constant is at ν0 = 0.2, and J(G > J(E > J(K > J(λ and J(G  0.2 and ν0  J(Vp and J(Vs  0.2 and ν0  0.2 and ν0 = 0.2, respectively. For natural rocks containing thin-disk-shaped pores parallel to mineral cleavages, grain boundaries and foliation, however, the ν fixed point decreases nonlinearly with decreasing pore aspect ratio (α: width/length. With increasing depth or pressure, cracks with smaller α values are progressively closed, making the ν fixed point rise and finally reach to the point at ν0 = 0.2.

  16. Measurement of high temperature elastic moduli of an 18Cr-9Ni-2.95 Cu-0.58 Nb-0.1C (Wt %) austenitic stainless steel

    Science.gov (United States)

    Tripathy, Haraprasanna; Hajra, Raj Narayan; Sudha, C.; Raju, S.; Saibaba, Saroja

    2018-04-01

    The Young's modulus (E) and Shear modulus (G) of an indigenously developed 18Cr-9Ni-0.1C-2.95 Cu-0.58Nb (wt %) austenitic stainless steel has been evaluated in the temperature range 298 K to 1273 K (25 °C to 1000 °C), using Impulse excitation technique (IET). The Bulk modulus (K) and the poison's ratio have been estimated from the measured values of E and G. It is observed that the elastic constants (E, G and K) are found to decrease in a nonlinear fashion with increase in temperature. The Cu precipitation is found to influence the elastic moduli of the steel in the cooling cycle. The observed elastic moduli are fitted to 3rd order polynomial equations in order to describe the temperature dependence of E, G, K moduli in the temperature range 298-1273 K (25 °C to 1000 °C). The room temperature values of E,G and K moduli is found to be 207, 82 and 145 GPa respectively for the present steel.

  17. NUMERICAL ESTIMATION OF EFFECTIVE ELASTIC MODULI OF SYNTACTIC FOAMS REINFORCED BY SHORT GLASS FIBERS

    Directory of Open Access Journals (Sweden)

    Wei Yu

    2016-03-01

    Full Text Available The mechanical properties of hollow glass microsphere/epoxy resin syntactic foams reinforced by short glass fibers are studied using representative volume elements. Both the glass fibers and the hollow glass microspheres exhibit random arrangement in the epoxy resin. The volume fraction and wall thickness of hollow glass microspheres and the volume fraction of glass fibers are considered as parameters. It is observed that the elastic modulus values of syntactic foams decrease with the increase of microsphere volume fraction when the microsphere relative wall thickness is lower. However, it increases with the increase of microsphere volume fraction when the relative wall thickness exceeds a critical value. The elastic modulus value goes through a maximum when the relative wall thickness is around 0.06 at 25 % volume fraction of microspheres. The addition of glass fibers reduces the critical wall thickness values of the microspheres and increases the mechanical properties of the composites. The highest stress lies on the equatorial plane perpendicular to the loading direction. Adding fibers reduces the large stress distribution areas on the microspheres, and the fibers aligned with the loading direction play an important load-bearing role.

  18. Elastic moduli of faceted aluminum nitride nanotubes measured by contact resonance atomic force microscopy

    International Nuclear Information System (INIS)

    Stan, G; Cook, R F; Ciobanu, C V; Thayer, T P; Wang, G T; Creighton, J R; Purushotham, K P; Bendersky, L A

    2009-01-01

    A new methodology for determining the radial elastic modulus of a one-dimensional nanostructure laid on a substrate has been developed. The methodology consists of the combination of contact resonance atomic force microscopy (AFM) with finite element analysis, and we illustrate it for the case of faceted AlN nanotubes with triangular cross-sections. By making precision measurements of the resonance frequencies of the AFM cantilever-probe first in air and then in contact with the AlN nanotubes, we determine the contact stiffness at different locations on the nanotubes, i.e. on edges, inner surfaces, and outer facets. From the contact stiffness we have extracted the indentation modulus and found that this modulus depends strongly on the apex angle of the nanotube, varying from 250 to 400 GPa for indentation on the edges of the nanotubes investigated.

  19. Goddard rattler-jamming mechanism for quantifying pressure dependence of elastic moduli of grain packs

    Energy Technology Data Exchange (ETDEWEB)

    Pride, Steven R.; Berryman, James G.

    2009-01-05

    An analysis is presented to show how it is possible for unconsolidated granular packings to obey overall non-Hertzian pressure dependence due to the imperfect and random spatial arrangements of the grains in these packs. With imperfect arrangement, some gaps that remain between grains can be closed by strains applied to the grain packing. As these gaps are closed, former rattler grains become jammed and new stress-bearing contacts are created that increase the elastic stiffness of the packing. By allowing for such a mechanism, detailed analytical expressions are obtained for increases in bulk modulus of a random packing of grains with increasing stress and strain. Only isotropic stress and strain are considered in this analysis. The model is shown to give a favorable fit to laboratory data on variations in bulk modulus due to variations in applied pressure for bead packs.

  20. Elasticity moduli, thermal expansion coefficients and Debye temperature of titanium alloys

    International Nuclear Information System (INIS)

    Beletskij, V.M.; Glej, V.A.; Maksimyuk, P.A.; Tabachnik, V.I.; Opanasenko, V.F.

    1979-01-01

    Studied are the characteristics of titanium alloys which reflect best the bonding forces for atoms in a crystal lattice: elastic modules, their temperature dependences, thermal expansion coefficient and Debye temperatures. For the increase of the accuracy of measuring modules and especially their changes with temperature an ultrasonic echo-impulse method of superposition has been used. The temperature dependences of Young modulus of the VT1-0, VT16 and VT22 titanium alloys are plotted. The Young module and its change with temperature depend on the content of alloying elements. The Young module decrease with temperature may be explained within the framework of the inharmonic effect theory. The analysis of the results obtained permits to suppose that alloying of titanium alloys with aluminium results in an interatomic interaction increase that may be one of the reasons of their strength increase

  1. Fiber/collagen composites for ligament tissue engineering: influence of elastic moduli of sparse aligned fibers on mesenchymal stem cells.

    Science.gov (United States)

    Thayer, Patrick S; Verbridge, Scott S; Dahlgren, Linda A; Kakar, Sanjeev; Guelcher, Scott A; Goldstein, Aaron S

    2016-08-01

    Electrospun microfibers are attractive for the engineering of oriented tissues because they present instructive topographic and mechanical cues to cells. However, high-density microfiber networks are too cell-impermeable for most tissue applications. Alternatively, the distribution of sparse microfibers within a three-dimensional hydrogel could present instructive cues to guide cell organization while not inhibiting cell behavior. In this study, thin (∼5 fibers thick) layers of aligned microfibers (0.7 μm) were embedded within collagen hydrogels containing mesenchymal stem cells (MSCs), cultured for up to 14 days, and assayed for expression of ligament markers and imaged for cell organization. These microfibers were generated through the electrospinning of polycaprolactone (PCL), poly(ester-urethane) (PEUR), or a 75/25 PEUR/PCL blend to produce microfiber networks with elastic moduli of 31, 15, and 5.6 MPa, respectively. MSCs in composites containing 5.6 MPa fibers exhibited increased expression of the ligament marker scleraxis and the contractile phenotype marker α-smooth muscle actin versus the stiffer fiber composites. Additionally, cells within the 5.6 MPa microfiber composites were more oriented compared to cells within the 15 and 31 MPa microfiber composites. Together, these data indicate that the mechanical properties of microfiber/collagen composites can be tuned for the engineering of ligament and other target tissues. © 2016 Wiley Periodicals, Inc. J Biomed Mater Res Part A: 104A: 1894-1901, 2016. © 2016 Wiley Periodicals, Inc.

  2. Thermal expansion and elastic moduli of the silicide based intermetallic alloys Ti5Si3(X) and Nb5Si3

    International Nuclear Information System (INIS)

    Zhang, L.; Wu, J.

    1997-01-01

    Silicides are among those potential candidates for high temperature application because of their high melting temperature, low density and good oxidation resistance. Recent interest is focused on molybdenum silicides and titanium silicides. Extensive investigation has been carried out on MoSi 2 , yet comparatively less work was performed on titanium silicides such as Ti 5 Si 3 and Ti 3 and TiSi 2 which are of lower density than MoSi 2 . Fundamental understanding of the titanium silicides' properties for further evaluation their potential for practical application are thus needed. The thermal expansion coefficients and elastic moduli of intermetallic compounds are two properties important for evaluation as a first step. The thermal expansion determines the possible stress that might arise during cooling for these high melting point compounds, which is crucial to the preparation of defect free specimens; and the elastic moduli are usually reflections of the cohesion in crystal. In Frommeyer's work and some works afterwards, the coefficients of thermal expansion were measured on both polycrystalline and single crystal Ti 5 Si 3 . The elastic modulus of polycrystalline Ti 5 Si 3 was measured by Frommeyer and Rosenkranz. However, in the above works, the referred Ti 5 Si 3 was the binary one, no alloying effect has been reported on this matter. Moreover, the above parameters (coefficient of thermal expansion and elastic modulus) of Nb 5 Si 3 remain unreported so far. In this paper, the authors try to extend the knowledge of alloyed Ti 5 Si 3 compounds with Nb and Cr additions. Results on the coefficients of thermal expansion and elastic moduli of Ti 5 Si 3 compounds and Nb 5 Si 3 are presented and the discussion is focused on the alloying effect

  3. Anisotropic elastic and thermal properties of titanium borides by first-principles calculations

    Energy Technology Data Exchange (ETDEWEB)

    Sun, Liang; Gao, Yimin [State Key Laboratory for Mechanical Behavior of Materials, Xi’an Jiaotong University, Xi’an 710049 (China); Xiao, Bing [Department of Physics and Quantum Theory Group, School of Science and Engineering, Tulane University, New Orleans, LA 70118 (United States); Li, Yefei, E-mail: yefeili@126.com [State Key Laboratory for Mechanical Behavior of Materials, Xi’an Jiaotong University, Xi’an 710049 (China); Wang, Guoliang [State Key Laboratory for Mechanical Behavior of Materials, Xi’an Jiaotong University, Xi’an 710049 (China)

    2013-12-05

    Highlights: •Elastic properties of titanium borides are calculated by first principles calculation. •Thermodynamical stability of titanium borides is analyzed. •Heat capacity and thermal expansion coefficient for titanium borides are calculated and compared. •Grüneisen parameters of titanium borides are calculated. -- Abstract: The anisotropic elastic and thermal expansions of the titanium borides (TiB{sub 2}, Ti{sub 3}B{sub 4}, TiB{sub P}nma and TiB{sub F}m3{sup ¯}m) are calculated from first-principles using density functional theory. All borides show different anisotropic elastic properties; the bulk, shear and Young’s moduli are consistent with those determined experimentally. The temperature dependence of thermal expansions is mainly caused by the restoration of thermal energy due to phonon excitations at low temperature. When the temperature is higher than 500 K, the volumetric coefficient is increased linearly by increasing temperature. Meanwhile, the heat capacities of titanium borides are obtained based on the knowledge of thermal expansion coefficient and the elasticity, the calculations are in good agreement with the experiments.

  4. Elastic wave speeds and moduli in polycrystalline ice Ih, si methane hydrate, and sll methane-ethane hydrate

    Science.gov (United States)

    Helgerud, M.B.; Waite, W.F.; Kirby, S.H.; Nur, A.

    2009-01-01

    We used ultrasonic pulse transmission to measure compressional, P, and shear, S, wave speeds in laboratory-formed polycrystalline ice Ih, si methane hydrate, and sll methane-ethane hydrate. From the wave speed's linear dependence on temperature and pressure and from the sample's calculated density, we derived expressions for bulk, shear, and compressional wave moduli and Poisson's ratio from -20 to 15??C and 22.4 to 32.8 MPa for ice Ih, -20 to 15??C and 30.5 to 97.7 MPa for si methane hydrate, and -20 to 10??C and 30.5 to 91.6 MPa for sll methane-ethane hydrate. All three materials had comparable P and S wave speeds and decreasing shear wave speeds with increasing applied pressure. Each material also showed evidence of rapid intergranular bonding, with a corresponding increase in wave speed, in response to pauses in sample deformation. There were also key differences. Resistance to uniaxial compaction, indicated by the pressure required to compact initially porous samples, was significantly lower for ice Ih than for either hydrate. The ice Ih shear modulus decreased with increasing pressure, in contrast to the increase measured in both hydrates ?? 2009.

  5. Calculating Effective Elastic Properties of Berea Sandstone Using Segmentation-less Method without Targets

    Science.gov (United States)

    Ikeda, K.; Goldfarb, E. J.; Tisato, N.

    2017-12-01

    Digital rock physics (DRP) allows performing common laboratory experiments on numerical models to estimate, for example, rock hydraulic permeability. The standard procedure of DRP involves turning a rock sample into a numerical array using X-ray micro computed tomography (micro-CT). Each element of the array bears a value proportional to the X-ray attenuation of the rock at the element (voxel). However, the traditional DRP methodology, which includes segmentation, over-predicts rock moduli by significant amounts (e.g., 100%). Recently, a new methodology - the segmentation-less approach - has been proposed leading to more accurate DRP estimate of elastic moduli. This new method is based on homogenization theory. Typically, segmentation-less approach requires calibration points from known density objects, known as targets. Not all micro-CT datasets have these reference points. Here, we describe how we perform segmentation- and target-less DRP to estimate elastic properties of rocks (i.e., elastic moduli), which are crucial parameters to perform subsurface modeling. We calculate the elastic properties of a Berea sandstone sample that was scanned at a resolution of 40 microns per voxel. We transformed the CT images into density matrices using polynomial fitting curve with four calibration points: the whole rock, the center of quartz grains, the center of iron oxide grains, and the center of air-filled volumes. The first calibration point is obtained by assigning the density of the whole rock to the average of all CT-numbers in the dataset. Then, we locate the center of each phase by finding local extrema point in the dataset. The average CT-numbers of these center points are assigned the density equal to either pristine minerals (quartz and iron oxide) or air. Next, density matrices are transformed to porosity and moduli matrices by means of an effective medium theory. Finally, effective static bulk and shear modulus are numerically calculated by using a Matlab code

  6. Elastic moduli, thermal expansion, and inferred permeability of Climax quartz monzonite and Sudbury gabbro to 5000C and 55 MPa

    International Nuclear Information System (INIS)

    Page, L.; Heard, H.C.

    1981-01-01

    Young's modulus (E), bulk modulus (K), and the coefficient of thermal linear expansion (α) have been determined for Climax quartz monzonite to 500 0 C and pressures (P) to 55 MPa and for Sudbury gabbro to 300 0 C and 55 MPa. For each rock, both E and K decreased with T and increased with P in a nonlinear manner. In the monzonite, E and K decreased by up to 60% as P decreased from 55.2 to 6.9 MPa isothermally, while the gabbro indicated a decrease up to 70% over the same pressure range. As T increased isobarically, E and K for the monzonite decreased by up to a factor of approx. 80% from 19 to 500 0 C. The moduli of the gabbro decreased by as much as 70% from 19 to 300 0 C. α for the monzonite increased with T and decreased with P in a nonmonotonic fashion, with most measured values for α greater than values calculated for the crack-free aggregate. Depending on P, α in the monzonite increased from 8 to 11.10 -6 0 C -1 at 40 0 C to 22 to 25.10 -6 C -1 at 475 0 C. For the gabbro, α also generally decreased with increasing P. Values ranged from 6 to 11.10 -6 0 C -1 , showing a nonlinear trend and very little net increas over the T range from 19 to 300 0 C. Calculated permeability of these rocks based on the α determinations indicated that permeabilities may increase by up to a factor of 3 over the temperature interval 19 to 300 0 C, and the permeability of the monzonite is inferred to increase by up to a factor of 8 by 500 0 C. In both rocks, most measurements are consistent with microcracks controlling the thermoelastic response by opening with T and closing with sigma and P

  7. Numerical calculations of effective elastic properties of two cellular structures

    International Nuclear Information System (INIS)

    Tuncer, Enis

    2005-01-01

    Young's moduli of regular two-dimensional truss-like and eye-shaped structures are simulated using the finite element method. The structures are idealizations of soft polymeric materials used in ferro-electret applications. In the simulations, the length scales of the smallest representative units are varied, which changes the dimensions of the cell walls in the structures. A power-law expression with a quadratic as the exponent term is proposed for the effective Young's moduli of the systems as a function of the solid volume fraction. The data are divided into three regions with respect to the volume fraction: low, intermediate and high. The parameters of the proposed power-law expression in each region are later represented as a function of the structural parameters, the unit-cell dimensions. The expression presented can be used to predict a structure/property relationship in materials with similar cellular structures. The contribution of the cell-wall thickness to the elastic properties becomes significant at concentrations >0.15. The cell-wall thickness is the most significant factor in predicting the effective Young's modulus of regular cellular structures at high volume fractions of solid. At lower concentrations of solid, the eye-shaped structure yields a lower Young's modulus than a truss-like structure with similar anisotropy. Comparison of the numerical results with those of experimental data for poly(propylene) show good agreement regarding the influence of cell-wall thickness on elastic properties of thin cellular films

  8. Ultrasonic measurements at elevated pressures (9 GPa) to determine Poisson's ratio and other elastic moduli of NaCl and NaF

    International Nuclear Information System (INIS)

    Morris, C.E.; Jamieson, J.C.; Yarger, F.L.

    1976-01-01

    Transit times of longitudinal and transverse ultrasonic waves were measured simultaneously in NaCl and NaF as a function of ''quasihydrostatic'' pressure to 9 GPa. The dimensionless ratio of these transit times yields directly the ratio of the longitudinal to shear velocity. This velocity ratio is independent of sample length. Using third-order elasticity theory a correction for a probable superimposed uniaxial stress component may be made. When done, this allows the direct determination of Poisson's ratio for each pressure. Shock-wave data are used to obtain other elastic moduli and velocities of shear and longitudinal waves. Apparatus for making these measurements is described and data for NaCl and NaF are presented

  9. Density functional theory for calculation of elastic properties of orthorhombic crystals: Application to TiSi2

    International Nuclear Information System (INIS)

    Ravindran, P.; Fast, L.; Korzhavyi, P.A.; Johansson, B.; Wills, J.; Eriksson, O.

    1998-01-01

    A theoretical formalism to calculate the single crystal elastic constants for orthorhombic crystals from first principle calculations is described. This is applied for TiSi 2 and we calculate the elastic constants using a full potential linear muffin-tin orbital method using the local density approximation (LDA) and generalized gradient approximation (GGA). The calculated values compare favorably with recent experimental results. An expression to calculate the bulk modulus along crystallographic axes of single crystals, using elastic constants, has been derived. From this the calculated linear bulk moduli are found to be in good agreement with the experiments. The shear modulus, Young's modulus, and Poisson's ratio for ideal polycrystalline TiSi 2 are also calculated and compared with corresponding experimental values. The directional bulk modulus and the Young's modulus for single crystal TiSi 2 are estimated from the elastic constants obtained from LDA as well as GGA calculations and are compared with the experimental results. The shear anisotropic factors and anisotropy in the linear bulk modulus are obtained from the single crystal elastic constants. From the site and angular momentum decomposed density of states combined with a charge density analysis and the elastic anisotropies, the chemical bonding nature between the constituents in TiSi 2 is analyzed. The Debye temperature is calculated from the average elastic wave velocity obtained from shear and bulk modulus as well as the integration of elastic wave velocities in different directions of the single crystal. The calculated elastic properties are found to be in good agreement with experimental values when the generalized gradient approximation is used for the exchange and correlation potential. copyright 1998 American Institute of Physics

  10. Elastic Properties of Tricalcium Aluminate from High-Pressure Experiments and First-Principles Calculations

    KAUST Repository

    Moon, Juhyuk

    2012-06-04

    The structure and elasticity of tricalcium aluminate (C 3A) have been experimentally and theoretically studied. From high-pressure X-ray diffraction experiments, the bulk modulus of 102(6) and 110(3) GPa were obtained by fitting second- and third-order finite strain equation of state, respectively. First-principles calculations with a generalized gradient approximation gave an isotropic bulk modulus of 102.1 GPa and an isothermal bulk modulus of 106.0 GPa. The static calculations using the exchange-correlation functional show an excellent agreement with the experimental measurements. Based on the agreement, accurate elastic constants and other elastic moduli were computed. The slight difference of behavior at high pressure can be explained by the infiltration of pressure-transmitting silicone oil into structural holes in C 3A. The computed elastic and mechanical properties will be useful in understanding structural and mechanical properties of cementitious materials, particularly with the increasing interest in the advanced applications at the nanoscale. © 2012 The American Ceramic Society.

  11. Elastic Properties of Tricalcium Aluminate from High-Pressure Experiments and First-Principles Calculations

    KAUST Repository

    Moon, Juhyuk; Yoon, Seyoon; Wentzcovitch, Renata M.; Clark, Simon M.; Monteiro, Paulo J.M.

    2012-01-01

    The structure and elasticity of tricalcium aluminate (C 3A) have been experimentally and theoretically studied. From high-pressure X-ray diffraction experiments, the bulk modulus of 102(6) and 110(3) GPa were obtained by fitting second- and third-order finite strain equation of state, respectively. First-principles calculations with a generalized gradient approximation gave an isotropic bulk modulus of 102.1 GPa and an isothermal bulk modulus of 106.0 GPa. The static calculations using the exchange-correlation functional show an excellent agreement with the experimental measurements. Based on the agreement, accurate elastic constants and other elastic moduli were computed. The slight difference of behavior at high pressure can be explained by the infiltration of pressure-transmitting silicone oil into structural holes in C 3A. The computed elastic and mechanical properties will be useful in understanding structural and mechanical properties of cementitious materials, particularly with the increasing interest in the advanced applications at the nanoscale. © 2012 The American Ceramic Society.

  12. Bulk rock elastic moduli at high pressures, derived from the mineral textures and from extrapolated laboratory data

    International Nuclear Information System (INIS)

    Ullemeyer, K; Keppler, R; Lokajíček, T; Vasin, R N; Behrmann, J H

    2015-01-01

    The elastic anisotropy of bulk rock depends on the mineral textures, the crack fabric and external parameters like, e.g., confining pressure. The texture-related contribution to elastic anisotropy can be predicted from the mineral textures, the largely sample-dependent contribution of the other parameters must be determined experimentally. Laboratory measurements of the elastic wave velocities are mostly limited to pressures of the intermediate crust. We describe a method, how the elastic wave velocity trends and, by this means, the elastic constants can be extrapolated to the pressure conditions of the lower crust. The extrapolated elastic constants are compared to the texture-derived ones. Pronounced elastic anisotropy is evident for phyllosilicate minerals, hence, the approach is demonstrated for two phyllosilicate-rich gneisses with approximately identical volume fractions of the phyllosilicates but different texture types. (paper)

  13. Calculation of elastic-plastic strain ranges for fatigue analysis based on linear elastic stresses

    International Nuclear Information System (INIS)

    Sauer, G.

    1998-01-01

    Fatigue analysis requires that the maximum strain ranges be known. These strain ranges are generally computed from linear elastic analysis. The elastic strain ranges are enhanced by a factor K e to obtain the total elastic-plastic strain range. The reliability of the fatigue analysis depends on the quality of this factor. Formulae for calculating the K e factor are proposed. A beam is introduced as a computational model for determining the elastic-plastic strains. The beam is loaded by the elastic stresses of the real structure. The elastic-plastic strains of the beam are compared with the beam's elastic strains. This comparison furnishes explicit expressions for the K e factor. The K e factor is tested by means of seven examples. (orig.)

  14. Structural stability and elastic properties of L12 Co3(Ga,W) precipitate from first-principle calculations

    International Nuclear Information System (INIS)

    Yao Qiang; Zhu Yuhong; Wang Yan

    2011-01-01

    Ultrasoft pseudopotential within a generalized gradient approximation was employed to study the structural stability, electronic structure, and elastic properties of ternary Co 3 (Ga,W) precipitate. The Young's and shear moduli of the polycrystals containing the Co 3 (Ga,W) precipitate were calculated using the Voigt-Reuss-Hill averaging scheme. Results show that the stable ternary Co 3 (Ga,W) compound has the L1 2 structure, and is ductile in nature. The structural stability of the Co 3 (Ga,W) compound is discussed together with the calculated electronic structure.

  15. First-principle calculations of structural, electronic, optical, elastic ...

    Indian Academy of Sciences (India)

    S CHEDDADI

    2017-11-28

    Nov 28, 2017 ... First-principle calculations on the structural, electronic, optical, elastic and thermal properties of the chalcopyrite ... The Kohn–Sham equations were solved using the ... RMTKmax = 7 was used for all the investigated systems,.

  16. Fracture mode, microstructure and temperature-dependent elastic moduli for thermoelectric composites of PbTe-PbS with SiC nanoparticle additions

    Science.gov (United States)

    Ni, Jennifer E.; Case, Eldon D.; Schmidt, Robert D.; Wu, Chun-I.; Hogan, Timothy P.; Trejo, Rosa M.; Lara-Curzio, Edgar; Kanatzidis, Mercouri G.

    2013-12-01

    Twenty-six (Pb0.95Sn0.05Te)0.92(PbS)0.08-0.055% PbI2-SiC nanoparticle (SiCnp) composite thermoelectric specimens were either hot pressed or pulsed electric current sintered (PECS). Bloating (a thermally induced increase in porosity, P, for as-densified specimens) was observed during annealing at temperatures >603 K for hot-pressed specimens and PECS-processed specimens from wet milled powders, but in contrast seven out of seven specimens densified by PECS from dry milled powders showed no observable bloating following annealing at temperatures up to 936 K. In this study, bloating in the specimens was accessed via thermal annealing induced changes in (i) porosity measured by scanning electron microscopy on fractured specimen surfaces, (ii) specimen volume and (iii) elastic moduli. The moduli were measured by resonant ultrasound spectroscopy. SiCnp additions (1-3.5 vol.%) changed the fracture mode from intergranular to transgranular, inhibited grain growth, and limited bloating in the wet milled PECS specimens. Inhibition of bloating likely occurs due to cleaning of contamination from powder particle surfaces via PECS processing which has been reported previously in the literature.

  17. Elastic moduli, damping and modulus of rupture changes in a high alumina refractory castable due to different types of thermal shock

    Directory of Open Access Journals (Sweden)

    Pereira, A. H. A.

    2012-06-01

    Full Text Available The work herein verifies the changes of the elastic moduli, damping and modulus of rupture (MOR of a high alumina refractory castable due to heating, cooling and heating-cooling thermal shock damage. Twelve prismatic specimens were prepared for the tests and divided into four groups. The thermal shocks were performed on three groups, each containing three specimens having abrupt temperature changes of 1100°C during heating in the first group, during cooling in the second and during heating followed by cooling in the third group. The fourth group, which was taken as a reference did not receive any thermal shock. The elastic moduli were measured after each thermal shock cycle. After 10 cycles, the MOR, the damping and the damping dependence on excitation amplitude were measured at room temperature for all specimens. The elastic moduli showed a similar decrease and the damping a similar increase due to the cooling and heating-cooling thermal shocks. The heating thermal shocks caused no significant changes on the elastic moduli and damping. However, the MOR appeared to be sensitive to the heating thermal shock. This work also shows that the damping for the studied refractory castable is non-linear (i.e., amplitude of excitation sensitive and that this non-linearity increases when the damage level rises.

    En este trabajo se investigaron las alteraciones de los módulos elásticos dinámicos, del amortiguamiento y del módulo de rotura (MOR de un material refractario moldeable de alta alúmina después de recibir choques térmicos de calentamiento, enfriamiento y calentamiento seguido de enfriamiento (calentamiento-enfriamiento. Para ello se prepararon doce cuerpos prismáticos dividiéndolos en cuatro grupos. Los choques térmicos se le aplicaron a sólo tres grupos, cada uno con tres muestras. Al primer grupo se le aplicó un cambio brusco de temperatura de 1100 °C en calentamiento, en enfriamiento al segundo grupo y calentamiento seguido

  18. Elastic moduli of normal and pathological human breast tissues: an inversion-technique-based investigation of 169 samples

    International Nuclear Information System (INIS)

    Samani, Abbas; Zubovits, Judit; Plewes, Donald

    2007-01-01

    Understanding and quantifying the mechanical properties of breast tissues has been a subject of interest for the past two decades. This has been motivated in part by interest in modelling soft tissue response for surgery planning and virtual-reality-based surgical training. Interpreting elastography images for diagnostic purposes also requires a sound understanding of normal and pathological tissue mechanical properties. Reliable data on tissue elastic properties are very limited and those which are available tend to be inconsistent, in part as a result of measurement methodology. We have developed specialized techniques to measure tissue elasticity of breast normal tissues and tumour specimens and applied them to 169 fresh ex vivo breast tissue samples including fat and fibroglandular tissue as well as a range of benign and malignant breast tumour types. Results show that, under small deformation conditions, the elastic modulus of normal breast fat and fibroglandular tissues are similar while fibroadenomas were approximately twice the stiffness. Fibrocystic disease and malignant tumours exhibited a 3-6-fold increased stiffness with high-grade invasive ductal carcinoma exhibiting up to a 13-fold increase in stiffness compared to fibrogalndular tissue. A statistical analysis showed that differences between the elastic modulus of the majority of those tissues were statistically significant. Implications for the specificity advantages of elastography are reviewed

  19. Elastic moduli of normal and pathological human breast tissues: an inversion-technique-based investigation of 169 samples

    Energy Technology Data Exchange (ETDEWEB)

    Samani, Abbas [Department of Medical Biophysics/Electrical and Computer Engineering, University of Western Ontario, Medical Sciences Building, London, Ontario, N6A 5C1 (Canada); Zubovits, Judit [Department of Anatomic Pathology, Sunnybrook Health Sciences Centre, 2075 Bayview Avenue, Toronto, Ontario, M4N 3M5 (Canada); Plewes, Donald [Department of Medical Biophysics, University of Toronto, 2075 Bayview Avenue, Toronto, Ontario, M4N 3M5 (Canada)

    2007-03-21

    Understanding and quantifying the mechanical properties of breast tissues has been a subject of interest for the past two decades. This has been motivated in part by interest in modelling soft tissue response for surgery planning and virtual-reality-based surgical training. Interpreting elastography images for diagnostic purposes also requires a sound understanding of normal and pathological tissue mechanical properties. Reliable data on tissue elastic properties are very limited and those which are available tend to be inconsistent, in part as a result of measurement methodology. We have developed specialized techniques to measure tissue elasticity of breast normal tissues and tumour specimens and applied them to 169 fresh ex vivo breast tissue samples including fat and fibroglandular tissue as well as a range of benign and malignant breast tumour types. Results show that, under small deformation conditions, the elastic modulus of normal breast fat and fibroglandular tissues are similar while fibroadenomas were approximately twice the stiffness. Fibrocystic disease and malignant tumours exhibited a 3-6-fold increased stiffness with high-grade invasive ductal carcinoma exhibiting up to a 13-fold increase in stiffness compared to fibrogalndular tissue. A statistical analysis showed that differences between the elastic modulus of the majority of those tissues were statistically significant. Implications for the specificity advantages of elastography are reviewed.

  20. Elastic moduli of normal and pathological human breast tissues: an inversion-technique-based investigation of 169 samples

    Science.gov (United States)

    Samani, Abbas; Zubovits, Judit; Plewes, Donald

    2007-03-01

    Understanding and quantifying the mechanical properties of breast tissues has been a subject of interest for the past two decades. This has been motivated in part by interest in modelling soft tissue response for surgery planning and virtual-reality-based surgical training. Interpreting elastography images for diagnostic purposes also requires a sound understanding of normal and pathological tissue mechanical properties. Reliable data on tissue elastic properties are very limited and those which are available tend to be inconsistent, in part as a result of measurement methodology. We have developed specialized techniques to measure tissue elasticity of breast normal tissues and tumour specimens and applied them to 169 fresh ex vivo breast tissue samples including fat and fibroglandular tissue as well as a range of benign and malignant breast tumour types. Results show that, under small deformation conditions, the elastic modulus of normal breast fat and fibroglandular tissues are similar while fibroadenomas were approximately twice the stiffness. Fibrocystic disease and malignant tumours exhibited a 3-6-fold increased stiffness with high-grade invasive ductal carcinoma exhibiting up to a 13-fold increase in stiffness compared to fibrogalndular tissue. A statistical analysis showed that differences between the elastic modulus of the majority of those tissues were statistically significant. Implications for the specificity advantages of elastography are reviewed.

  1. Measurements of P- and S wave velocities in a rock massif and its use in estimating elastic moduli

    Czech Academy of Sciences Publication Activity Database

    Živor, Roman; Vilhelm, J.; Rudajev, Vladimír; Lokajíček, Tomáš

    2011-01-01

    Roč. 8, č. 2 (2011), s. 157-167 ISSN 1214-9705 R&D Projects: GA AV ČR IAA300130906 Institutional research plan: CEZ:AV0Z30130516 Keywords : seismic source * seismic waves velocity * elastic constants * geophone * piezo -electric transducer Subject RIV: DC - Siesmology, Volcanology, Earth Structure Impact factor: 0.530, year: 2011 http://www.irsm.cas.cz/abstracts/AGG/02_11/6_Zivor.pdf

  2. Ultrasonic determination of the elastic moduli and their pressure dependences in very dense YBa2Cu3O7-x

    International Nuclear Information System (INIS)

    Cankurtaran, M.; Saunders, G.A.; Goretta, K.C.; Poeppel, R.B.

    1991-12-01

    The effects of hydrostatic pressure and temperature have been measured on the velocities of longitudinal and shear ultrasonic waves propagated in a very dense (96% of theoretical density) ceramic specimen of YBa 2 Cu 3 O 7-x . In YBa 2 Cu 3 O 7-x ceramics with such a high density the effects of porosity on the elastic properties should be much reduced. Nevertheless the bulk modulus of this dense material has the same small magnitude (∼ 55GPa) as that measured ultrasonically in much less dense YBa 2 Cu 3 O 7-x ceramics. The temperature dependences of the velocities of longitudinal and shear ultrasonic waves, which have been measured between 10 K and 300 K, show the step-like increase at 200 K on cooling and a similar decrease at 225 K during warming with hysteresis in the range 190 K to 235 K that has previously been observed in less dense ceramics and tentatively attributed to a phase transformation. The pressure dependences of both mode velocities for dense YBa 2 Cu 3 O 7-x ceramic show a pronounced change of slope at a pressure P c . For pressures below and above P c the pressure dependence of ultrasonic velocity is essentially linear. Above the knee, the enormous pressure dependences of the longitudinal mode velocity and hence of the bulk modulus persist. The temperature dependences of pressure derivatives of elastic stiffnesses and bulk modulus have been measured between 250 K and 295 K. The pressure P c at which the kink occurs decreases almost linearly with decreasing temperature and extrapolates to atmospheric pressure at about 220 K

  3. Atomistic calculations of interface elastic properties in noncoherent metallic bilayers

    International Nuclear Information System (INIS)

    Mi Changwen; Jun, Sukky; Kouris, Demitris A.; Kim, Sung Youb

    2008-01-01

    The paper describes theoretical and computational studies associated with the interface elastic properties of noncoherent metallic bicrystals. Analytical forms of interface energy, interface stresses, and interface elastic constants are derived in terms of interatomic potential functions. Embedded-atom method potentials are then incorporated into the model to compute these excess thermodynamics variables, using energy minimization in a parallel computing environment. The proposed model is validated by calculating surface thermodynamic variables and comparing them with preexisting data. Next, the interface elastic properties of several fcc-fcc bicrystals are computed. The excess energies and stresses of interfaces are smaller than those on free surfaces of the same crystal orientations. In addition, no negative values of interface stresses are observed. Current results can be applied to various heterogeneous materials where interfaces assume a prominent role in the systems' mechanical behavior

  4. A calculational round robin in elastic-plastic fracture mechanics

    International Nuclear Information System (INIS)

    Larsson, L.H.

    1983-01-01

    Eighteen organisations participated in this elastic-plastic fracture mechanics (EPFM) numerical analysis round robin which treated the same three-point bend problem as a similar round robin conducted by ASTM four years earlier. The work involved the calculation of overall deformation, J, CTOD and crack profile using plane strain elastic-plastic finite element analysis for a monotonically increasing load up to a maximum deformation which was far beyond the elastic regime. It was found that all of the elastic solutions were accurate to within a few per cent. In the elastic-plastic regime, however, there was a large scatter of the results, increasing with increasing plastic deformation and roughly of the same order as in the ASTM round robin which contained ten solutions. No significant progress has taken place in the state of the art of numerical EPFM analysis over the four-year interval. The reasons for this scatter and tentative conclusions on the most suitable numerical analysis methods in EPFM are discussed. (author)

  5. Elastic moduli of boron carbide/copper composites from -400C to 8000C by ultrasonic methods

    International Nuclear Information System (INIS)

    Gieske, J.H.

    1980-10-01

    An ultrasonic through-transmission technique for high attenuating materials was developed to determine the ultrasonic longitudinal and shear velocities in B 4 C/Cu composites to 800 0 C. Ultrasonic velocity data was used to calculate Young's modulus, shear modulus, and Poisson's ratio for the composites from -40 0 C to 800 0 C. 5 figures, 1 table

  6. Comparative first-principles calculations of the electronic, optical, elastic and thermodynamic properties of XCaF{sub 3} (X = K, Rb, Cs) cubic perovskites

    Energy Technology Data Exchange (ETDEWEB)

    Li, Li; Wang, Y.-J. [College of Mathematics and Physics, Chongqing University of Posts and Telecommunications, 2 Chongwen Road, Nan' an District, Chongqing 400065 (China); Institute of Physics, Polish Academy of Sciences, Al. Lotników 32/46, 02-668 Warsaw (Poland); Liu, D.-X.; Ma, C.-G. [College of Mathematics and Physics, Chongqing University of Posts and Telecommunications, 2 Chongwen Road, Nan' an District, Chongqing 400065 (China); Brik, M.G., E-mail: mikhail.brik@ut.ee [College of Mathematics and Physics, Chongqing University of Posts and Telecommunications, 2 Chongwen Road, Nan' an District, Chongqing 400065 (China); Institute of Physics, University of Tartu, W. Ostwald Str. 1, Tartu 50411 (Estonia); Institute of Physics, Jan Długosz University, Armii Krajowej 13/15, PL-42200 Częstochowa (Poland); Suchocki, A. [College of Mathematics and Physics, Chongqing University of Posts and Telecommunications, 2 Chongwen Road, Nan' an District, Chongqing 400065 (China); Institute of Physics, Polish Academy of Sciences, Al. Lotników 32/46, 02-668 Warsaw (Poland); Institute of Physics, Kazimierz Wielki University, Weyssenhoffa 11, 85-072 Bydgoszcz (Poland); Piasecki, M. [Institute of Physics, Jan Długosz University, Armii Krajowej 13/15, PL-42200 Częstochowa (Poland); Reshak, A.H. [New Technologies – Research Centre, University of West Bohemia, Univerzitni 8, 306 14 Pilsen (Czech Republic); School of Material Engineering, University Malaysia Perlis, 01007 Kangar, Perlis (Malaysia)

    2017-02-15

    Three fluoroperovskites with the general formula XCaF{sub 3} (X = K, Rb, Cs) have been systematically studied using the first-principles methods. The structural, electronic, optical, elastic and thermodynamic properties of these three compounds were calculated at the ambient and elevated hydrostatic pressure. Variation of all these properties with pressure was analyzed; it was shown that the structural and elastic constants change linearly with increased pressure, whereas the calculated band gaps follow the quadratic dependence on pressure. Influence of the first cation variation (K – Rb – Cs) on these properties was discussed. Elastic anisotropy (directional dependence of the Young moduli) of these compounds was modeled and analyzed for the first time. - Highlights: • Three cubic perovskites XCaF{sub 3} (X = K, Rb, Cs) were studied by ab initio methods. • Systematic variation of physical properties with the first cation change was traced. • Pressure effects on physical properties were calculated and modeled. • Debye temperature and Grüneisen constant for all materials were calculated for the first time. • Elastic anisotropy was visualized by plotting Young moduli directional dependences.

  7. Elastic-Plastic Calculation of a Dilatation Compensation Component

    Science.gov (United States)

    Atanasiu, Costică; Iliescu, Nicolae; Sorohan, Ștefan

    2017-12-01

    Compensators are elastic structures that have the role of taking over the axial displacements that occur in the junction areas of the technological equipment (pipelines or containers) through which the fluids circulate at pressures and high temperatures. These elastic structures, realized in a very wide range of shapes and sizes, are sujected by the inner pressure and an axial force produced by dilatation of structures in which they are mounted. The calculation of the expansion compensators raises many problems caused by the working regimes of the technological equipments they belong to. Following previous studies, undertaken by calculus and experimental, by the authors of this paper, it was found that in operation the state of stress in these elastic structures exceeds the flow limit of the material from which they are manufacturated. For this reason, in the present paper, the authors present the results of a calculus study, by FEM, on the stress and strain state, in the elasto-plastic regime of a leticular compensator. The calculation was made for two loading modes, separately applied and superimposed. The nonlinear mechanical behavior of this compensator is analyzed and discussed comparatively to the results of previous studies performed in elastic regime on the same type of compensator.

  8. Computation of the lamina stacking sequence effect on elastic moduli of a plain-weave Nicalon/SiC laminated composite with a [0/30/60] lay-up

    International Nuclear Information System (INIS)

    Zhao Wei; Yu Niann-i

    1998-01-01

    Estimation of the elastic modulus is important in engineering design. One difference between CFCCs (continuous fiber-reinforced ceramic-matrix composites), and CMCs (whisker, particulate, or short fiber-reinforced ceramic-matrix composites), is that the anisotropic behavior of CFCCs plays an important role in affecting their mechanical behavior. This feature may also contribute to the variation of elastic properties and strengths of CFCC. In this paper, a Fortran program is developed to quantify the lamina stacking sequence effect on the effective elastic moduli of the laminated CFCCs. The material for modeling is a plain-weave Nicalon fiber-reinforced silicon carbide (Nicalon/SiC) CFCCs. Results show that various stacking sequences within the CFCC (a [0/30/60] lay-up) will give different effective elastic moduli of the CFCCs. This trend leads to a variation of the slope of the linear portion on the flexural stress-strain curve, i.e., changing the position of the starting point of the non-linear portion, and the shape of the whole curve, which gives a different value of the peak stress in the curve. (orig.)

  9. Moduli determination of continuous fiber ceramic composites (CFCCs)

    International Nuclear Information System (INIS)

    Liaw, P.K.; Hsu, D.K.; Miriyala, N.; Snead, L.L.; McHargue, C.J.

    1995-01-01

    Nicalon TM /silicon carbide composites were fabricated by the Forced Chemical Vapor Infiltration (FCVI) method. Both through-thickness and in-plane (fiber fabric plane) moduli were determined using ultrasonic techniques. The through-thickness elastic constants (moduli) were found to be much less than the in-plane moduli. Increased porosity significantly decreased both in-plane and through-thickness moduli. A periodic model using a homogenization method was formulated to predict the effect of porosity on the moduli of woven fabric composites. The predicted moduli were found to be in reasonably good agreement with the experimental results. ((orig.))

  10. DFT calculation for elastic constants of orthorhombic structure within WIEN2K code: A new package (ortho-elastic)

    International Nuclear Information System (INIS)

    Reshak, Ali H.; Jamal, Morteza

    2012-01-01

    Highlights: ► A new package for calculating elastic constants of orthorhombic structure is released. ► The package called ortho-elastic. ► It is compatible with [FP-(L)APW+lo] method implemented in WIEN2k code. ► Several orthorhombic structure compounds were used to test the new package. ► Elastic constants calculated using this package show good agreement with experiment. - Abstract: A new package for calculating the elastic constants of orthorhombic structure is released. The package called ortho-elastic. The formalism of calculating the ortho-elastic constants is described in details. The package is compatible with the highly accurate all-electron full-potential (linearized) augmented plane-wave plus local orbital [FP-(L)APW+lo] method implemented in WIEN2k code. Several orthorhombic structure compounds were used to test the new package. We found that the calculated elastic constants using the new package show better agreement with the available experimental data than the previous theoretical results used different methods. In this package the second-order derivative E ″ (ε) of polynomial fit E=E(ε) of energy vs strains at zero strain (ε=0), used to calculate the orthorhombic elastic constants.

  11. Elastic and thermo-physical properties of TiC, TiN, and their intermediate composition alloys using ab initio calculations

    International Nuclear Information System (INIS)

    Kim, Jiwoong; Kang, Shinhoo

    2012-01-01

    Highlights: ► Elastic properties of TiC, TiN and their alloys were calculated by ab initio calculations. ► Debye temperature and Gruneisen constant of TiC, TiN and their alloys were calculated as a function of nitrogen content. ► Thermo-physical properties were calculated as a function of nitrogen content. ► Thermal expansion of the alloys was fitted in different temperature range. - Abstract: The equilibrium lattice parameters, elastic properties, material brittleness, heat capacities, and thermal expansion coefficients of TiC, TiN, and their intermediate composition alloys (Ti(C 1−x N x ), x = 0.25, 0.5, and 0.75) were calculated using ab initio density functional theory (DFT) methods. We employed the Debye–Gruneisen model to calculate a finite temperature heat capacity and thermal expansion coefficient. The calculated elastic moduli and thermal expansion coefficients agreed well with the experimental data and with other DFT calculations. Accurate heat capacities of TiC, TiN, and their intermediate composition alloys were obtained by calculating not only the phonon contributions but also the electron contributions to the heat capacity. Our calculations indicated that the heat capacity differences between each composition originated mainly from the electronic contributions.

  12. Desenvolvimento de um equipamento para a caracterização não-destrutiva dos módulos elásticos de materiais cerâmicos Development of equipment for non-destructive characterization of elastic moduli of ceramic materials

    Directory of Open Access Journals (Sweden)

    A. H. A Pereira

    2010-06-01

    Full Text Available Foi desenvolvido um equipamento para a caracterização não-destrutiva dos módulos elásticos aplicável a cerâmicas, concretos e materiais frágeis baseado na norma ASTM E 1875-00. Pode-se medir com exatidão, praticidade e simultaneidade o módulo de Young, de cisalhamento e a razão de Poisson. O equipamento obtém, via espectroscopia de ressonância sônica, as freqüências naturais de vibração flexurais e torcionais do corpo de prova e calcula os módulos. O equipamento foi desenvolvido em três partes: suporte do corpo de prova, eletrônica e software. O suporte aplica as condições de contorno mecânicas e a excitação necessária, a eletrônica gera e capta os sinais e o software executa os cálculos. A validação foi realizada com ensaios inter-técnicas e inter-laboratoriais de materiais refratários e de referência. Os resultados mostraram que o equipamento é mais versátil do que as opções atuais para a medida simultânea das três propriedades elásticas apresentadas acima.In this work was developed an equipment for non-destructive characterization of elastic moduli applicable to ceramics, concretes, and brittle materials based on ASTM E 1875-00 standard. The Young's modulus, shear modulus and Poisson's ratio can be simultaneously and easily measured with accuracy applying the new equipment. The natural torsional and flexural vibration frequencies of the sample are measured through sonic resonance spectroscopy. This permits the calculation of the elastic moduli. The system was developed in three parts: the sample holder, the electronics and the software. The sample holder applies the mechanical boundary conditions and excitation. The electronics captures and generates the signals. Finally, the software performs the calculations. The validation was carried out with inter-laboratory and inter-technique tests of refractories and reference materials. The results showed that the equipment is more versatile than the current

  13. A calculational round robin in elastic-plastic fracture mechanics

    International Nuclear Information System (INIS)

    Larsson, L.H.

    Eighteen organizations participated in this round robin which treated the same three-point bend problem as an ASTM round robin four years earlier. Overall deformation, J, CTOD and crack profile were the main results required using plane strain elastic-plastic finite element analysis for a monotonically increasing load up to a maximum deformation which was far beyond the elastic regime. All elastic solutions were accurate to within a few percent. In the elastic-plastic regime, however, there was a large scatter of the results, increasing with increasing plastic deformation and roughly of the same order as in the ASTM round robin which contained ten solutions. Apparently no significant progress has taken place in the state of the art of numerical EPFM analysis in four years time. The paper discusses the reasons for this scatter and draws tentative conclusions on the most suitable numerical analysis methods in EPFM. (Auth.)

  14. First-principles calculations for elastic properties of OsB{sub 2} under pressure

    Energy Technology Data Exchange (ETDEWEB)

    Yang Junwei [Institute of Atomic and Molecular Physics, Sichuan University, Chengdu 610065 (China); Chen Xiangrong, E-mail: x.r.chen@tom.co [Institute of Atomic and Molecular Physics, Sichuan University, Chengdu 610065 (China); International Centre for Materials Physics, Chinese Academy of Sciences, Shenyang 110016 (China); Luo Fen [Institute of Atomic and Molecular Physics, Sichuan University, Chengdu 610065 (China); Ji Guangfu [Laboratory for Shock Wave and Detonation Physics Research, Institute of Fluid Physics, Chinese Academy of Engineering Physics, Mianyang 621900 (China)

    2009-11-01

    The structure, elastic properties and elastic anisotropy of orthorhombic OsB{sub 2} are investigated by density functional theory method with the ultrasoft pseudopotential scheme in the frame of the generalized gradient approximation (GGA) as well as local density approximation (LDA). The obtained structural parameters, elastic constants, elastic anisotropy and Debye temperature for OsB{sub 2} under pressure are consistent with the available experimental data and other theoretical results. It is found that the elastic constants, bulk modulus and Debye temperature of OsB{sub 2} tend to increase with increasing pressure. It is predicted that OsB{sub 2} is not a superhard material from our calculations.

  15. First-principles calculations for elastic properties of OsB2 under pressure

    International Nuclear Information System (INIS)

    Yang Junwei; Chen Xiangrong; Luo Fen; Ji Guangfu

    2009-01-01

    The structure, elastic properties and elastic anisotropy of orthorhombic OsB 2 are investigated by density functional theory method with the ultrasoft pseudopotential scheme in the frame of the generalized gradient approximation (GGA) as well as local density approximation (LDA). The obtained structural parameters, elastic constants, elastic anisotropy and Debye temperature for OsB 2 under pressure are consistent with the available experimental data and other theoretical results. It is found that the elastic constants, bulk modulus and Debye temperature of OsB 2 tend to increase with increasing pressure. It is predicted that OsB 2 is not a superhard material from our calculations.

  16. First-principles calculations for elastic properties of OsB 2 under pressure

    Science.gov (United States)

    Yang, Jun-Wei; Chen, Xiang-Rong; Luo, Fen; Ji, Guang-Fu

    2009-11-01

    The structure, elastic properties and elastic anisotropy of orthorhombic OsB 2 are investigated by density functional theory method with the ultrasoft pseudopotential scheme in the frame of the generalized gradient approximation (GGA) as well as local density approximation (LDA). The obtained structural parameters, elastic constants, elastic anisotropy and Debye temperature for OsB 2 under pressure are consistent with the available experimental data and other theoretical results. It is found that the elastic constants, bulk modulus and Debye temperature of OsB 2 tend to increase with increasing pressure. It is predicted that OsB 2 is not a superhard material from our calculations.

  17. Elastic Modulus at High Frequency of Polymerically Stabilized Suspensions

    NARCIS (Netherlands)

    Nommensen, P.A.; Duits, Michael H.G.; van den Ende, Henricus T.M.; Mellema, J.

    2000-01-01

    The elastic moduli of polymerically stabilized suspensions consisting of colloidal silica particles coated with endgrafted PDMS (Mn = 80 000) in heptane, were measured as a function of concentration. And the elastic modulus at high frequency G'.. was quantitatively described by model calculations

  18. Calculation of elastic constants of BCC transition metals: tight-binding recursion method

    International Nuclear Information System (INIS)

    Masuda, K.; Hamada, N.; Terakura, K.

    1984-01-01

    The elastic constants of BCC transition metals (Fe, Nb, Mo and W) are calculated by using the tight-binding d band and the Born-Mayer repulsive potential. Introducing a small distortion characteristic to C 44 (or C') elastic deformation and calculating the energy change up to second order in the atomic displacement, the shear elastic constants C 44 and C' are determined. The elastic constants C 11 and C 12 are then calculated by using the relations B=1/3(C 11 + 2C 12 ) and C'=1/2(C 11 -C 12 ), where B is the bulk modulus. In general, the agreement between the present results and the experimental values is satisfactory. The characteristic elasticity behaviour, i.e. the strong Nsub(d) (number of d electrons) dependence of the observed anisotropy factor A=C 44 /C', will also be discussed. (author)

  19. Density functional calculations of elastic properties of portlandite, Ca(OH)(2)

    DEFF Research Database (Denmark)

    Laugesen, Jakob Lund

    2005-01-01

    The elastic constants of portlandite, Ca(OH)(2), are calculated by use of density functional theory. A lattice optimization of an infinite (periodic boundary conditions) lattice is performed on which strains are applied. The elastic constants are extracted by minimizing Hooke's law of linear...

  20. The elastic response of composite materials

    International Nuclear Information System (INIS)

    Laws, N.

    1980-01-01

    The theory of linear elasticity is used to study the elastic response of composite materials. The main concern is the prediction of overall moduli. Some attention is paid to the problem of deciding upon when the idea of an overall modulus is meaningful. In addition it is shown how to calculate some rigorous bounds on the overall moduli, and some predictions of the self-consistent method are discussed. The paper mainly concentrates on isotropic dispersions of spheres, unidirectional fibre-reinforced materials and laminates. (author)

  1. Elastic, electronic properties and intra-atomic bonding in orthorhombic and tetragonal polymorphs of BaZn2As2 from first-principles calculations

    International Nuclear Information System (INIS)

    Shein, I.R.; Ivanovskii, A.L.

    2014-01-01

    Highlights: • α and β polymorphs of BaZn 2 As 2 as a parent phase of the new DMSs are examined. • Structural, elastic, electronic properties are evaluated from first principles. • Inter-atomic bonding picture is discussed. -- Abstract: Very recently, on the example of hole- and spin-doped BaZn 2 As 2 , quite an unexpected area of potential applications of 122-like phases was proposed as a promising platform for searching the new diluted magnetic semiconductors (DMSs) (2013; K. Zhao, et al, Nature Commun. 4:1442). Herein, by means of the first-principles calculations, we have examined in detail the basic structural, elastic, electronic properties and the peculiarities of the inter-atomic bonding in α and β polymorphs of 122-like BaZn 2 As 2 – a parent phase of the new DMSs. Our characterization of these materials covers the optimized structural parameters, the main elastic parameters (elastic constants, bulk, shear, and Young’s moduli, Poisson’s ratio, anisotropy indexes, and Pugh’s criterion), as well as electronic bands and densities of electronic states

  2. Elastic properties of gamma-Pu by resonant ultrasound spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Migliori, Albert [Los Alamos National Laboratory; Betts, J [Los Alamos National Laboratory; Trugman, A [Los Alamos National Laboratory; Mielke, C H [Los Alamos National Laboratory; Mitchell, J N [Los Alamos National Laboratory; Ramos, M [Los Alamos National Laboratory; Stroe, I [WORXESTER, MA

    2009-01-01

    Despite intense experimental and theoretical work on Pu, there is still little understanding of the strange properties of this metal. We used resonant ultrasound spectroscopy method to investigate the elastic properties of pure polycrystalline Pu at high temperatures. Shear and longitudinal elastic moduli of the {gamma}-phase of Pu were determined simultaneously and the bulk modulus was computed from them. A smooth linear and large decrease of all elastic moduli with increasing temperature was observed. We calculated the Poisson ratio and found that it increases from 0.242 at 519K to 0.252 at 571K.

  3. A least squares calculational method: application to e±-H elastic scattering

    International Nuclear Information System (INIS)

    Das, J.N.; Chakraborty, S.

    1989-01-01

    The least squares calcualtional method proposed by Das has been applied for the e ± -H elastic scattering problems for intermediate energies. Some important conclusions are made on the basis of the calculation. (author). 7 refs ., 2 tabs

  4. The Calculation of Weighted Price Elasticity of Tax: Turkey (1998-2013

    Directory of Open Access Journals (Sweden)

    Engin YILMAZ

    2015-06-01

    Full Text Available In this study, the assumption of “the weighted price elasticity of tax is a unit in the developing countries” suggested in the first studies which examine the impacts of the inflation on tax revenues, will be reevaluated for Turkey in the period of 1998-2013. We use Turkish tax and price index data for calculating the weighted price elasticity of tax. Via the method of dynamic ordinary least squares (DOLS, the long run weighted price elasticity of tax system is guessed. The importance of this study is the fact that this is first study intended to the calculation of the weighted price elasticity of tax for Turkey. In this sense, it will be instructive study for the reconsideration of the assumption of “the weighted price elasticity of tax is a unit in the developing countries”.

  5. Evolution of macroscopic elastic moduli of martensitic polycrystalline NiTi and NiTiCu shape memory alloys with pseudoplastic straining

    Czech Academy of Sciences Publication Activity Database

    Thomasová, M.; Seiner, Hanuš; Sedlák, Petr; Frost, Miroslav; Ševčík, Martin; Szurman, I.; Kocich, R.; Drahokoupil, Jan; Šittner, Petr; Landa, Michal

    2017-01-01

    Roč. 123, January (2017), s. 146-156 ISSN 1359-6454 R&D Projects: GA ČR(CZ) GP14-28306P; GA ČR GA14-15264S Institutional support: RVO:61388998 ; RVO:68378271 Keywords : shape memory alloys * polycrystals * elastic behavior Subject RIV: BM - Solid Matter Physics ; Magnetism; BM - Solid Matter Physics ; Magnetism (FZU-D) OBOR OECD: Condensed matter physics (including formerly solid state physics, supercond.); Condensed matter physics (including formerly solid state physics, supercond.) (FZU-D) Impact factor: 5.301, year: 2016

  6. In situ determination of layer thickness and elastic moduli of asphalt pavement systems by spectral analysis of surface waves (SASW) method

    International Nuclear Information System (INIS)

    Mohd Azmi Ismail; Sri Atmaja Rosyidi; Abdul Rahim Samsudin; Abdul Ghani Rafek; Khairul Anuar Mohd Nayan

    2003-01-01

    Spectral analysis of surface waves (SASW) is a non-destructive and in situ method for determining the stiffness profile of soil and pavement sites. The method consists of generation, measurement, and processing of dispersive elastic waves in layered systems. The test is performed on the pavement surface at strain level below 0.001%, where the elastic properties are considered independent of strain amplitude. During an SASW test, the surface of the medium under investigation is subject to an impact to generate energy at various frequencies. Two vertical acceleration transducers are set up near the impact source to detect the energy transmitted through the testing media. By recording signals in digitised form using a data acquisition system and processing them, surface wave velocities can be determined by constructing a dispersion curve. Through forward modeling, the shear wave velocities can be obtained, which can be related to the variation of stiffness with depth. This paper presents the results of two case studies for near?surface profiling of two different asphalt pavement sites. (Author)

  7. Fatigue analysis - computation of the actual strain range using elastic calculation

    International Nuclear Information System (INIS)

    Roche, R.L.

    1987-04-01

    The design codes used in nuclear industry do not contain all the same rules allowing to deduce from an elastic calculation the actual deformation variation. Knowledge of strain range is needed for fatigue analysis. Elastic calculation does not give the actual range. The aim of this paper is discussing ways to correct elastic results and proposing a practical method to do it. Two corrections are required. The first one is related to elastic follow up effect when shakedown is not obtained (correction on secondary stress). The second one is related to stress raisers effect (correction on peak stress). It is shown that NEUBER's rule is not convenient for the second correction when shakedown is not fulfilled [fr

  8. First-principles calculation of the structural, electronic, elastic, and optical properties of sulfur-doping ε -GaSe crystal

    International Nuclear Information System (INIS)

    Huang Chang-Bao; Wu Hai-Xin; Ni You-Bao; Wang Zhen-You; Qi Ming; Zhang Chun-Li

    2016-01-01

    The structural, electronic, mechanical properties, and frequency-dependent refractive indexes of GaSe 1–x S x (x = 0, 0.25, and 1) are studied by using the first-principles pseudopotential method within density functional theory. The calculated results demonstrate the relationships between intralayer structure and elastic modulus in GaSe 1–x S x (x = 0, 0.25, and 1). Doping of ε -GaSe with S strengthens the Ga– X bonds and increases its elastic moduli of C 11 and C 66 . Born effective charge analysis provides an explanation for the modification of cleavage properties about the doping of ε -GaSe with S. The calculated results of band gaps suggest that the distance between intralayer atom and substitution of S Se , rather than interlayer force, is a key factor influencing the electronic exciton energy of the layer semiconductor. The calculated refractive indexes indicate that the doping of ε -GaSe with S reduces its refractive index and increases its birefringence. (paper)

  9. All-loop calculations of total, elastic and single diffractive cross sections in RFT via the stochastic approach

    International Nuclear Information System (INIS)

    Kolevatov, R. S.; Boreskov, K. G.

    2013-01-01

    We apply the stochastic approach to the calculation of the Reggeon Field Theory (RFT) elastic amplitude and its single diffractive cut. The results for the total, elastic and single difractive cross sections with account of all Pomeron loops are obtained.

  10. All-loop calculations of total, elastic and single diffractive cross sections in RFT via the stochastic approach

    Energy Technology Data Exchange (ETDEWEB)

    Kolevatov, R. S. [SUBATECH, Ecole des Mines de Nantes, 4 rue Alfred Kastler, 44307 Nantes Cedex 3 (France); Boreskov, K. G. [Institute of Theoretical and Experimental Physics, 117259, Moscow (Russian Federation)

    2013-04-15

    We apply the stochastic approach to the calculation of the Reggeon Field Theory (RFT) elastic amplitude and its single diffractive cut. The results for the total, elastic and single difractive cross sections with account of all Pomeron loops are obtained.

  11. Change of elastic constants induced by point defects in hop crystals

    International Nuclear Information System (INIS)

    Tome, C.

    1979-10-01

    An approximate model is developed to calculate the change of elastic constants induced by point defects in hcp metals, supposed the defect configuration is known. General expressions relating the change of elastic moduli to the final atomic coordinates and to the defect force field are derived using the specific symmetry of the defect. Explicit calculations are done for Mg. The predicted change of elastic moduli turns out to be negative for vacancies and trigonal interstitials while for hexagonal interstitials a positive change is predicted. Compatibility with experimental data would suggest that the trigonal configuration is the stable one. (author)

  12. The first-principles calculations for the elastic properties of Zr2Al under compression

    International Nuclear Information System (INIS)

    Yuan Xiaoli; Wei Dongqing; Chen Xiangrong; Zhang Qingming; Gong Zizheng

    2011-01-01

    Graphical abstract: The calculated elastic constants C ij as a function of pressure P. Display Omitted Research highlights: → It is found that the five independent elastic constants increase monotonically with pressure. C 11 and C 33 vary rapidly as pressure increases, C 13 and C 12 becomes moderate. However, C 44 increases comparatively slowly with pressure. Figure shows excellent satisfaction of the calculated elastic constants of Zr 2 Al to these equations and hence in our calculation, the Zr 2 Al is mechanically stable at pressure up to 100 GPa. - Abstract: The first-principles calculations were applied to investigate the structural, elastic constants of Zr 2 Al alloy with increasing pressure. These properties are based on the plane wave pseudopotential density functional theory (DFT) method within the generalized gradient approximation (GGA) for exchange and correlation. The result of the heat of formation of Zr 2 Al crystal investigated is in excellent consistent with results from other study. The anisotropy, the shear modulus, and Young's modulus for the ideal polycrystalline Zr 2 Al are also studied. It is found that (higher) pressure can significantly improve the ductility of Zr 2 Al. Moreover, the elastic constants of Zr 2 Al increase monotonically and the anisotropies decrease with the increasing pressure. Finally, it is observed that Zr d electrons are mainly contributed to the density of states at the Fermi level.

  13. Elastic and thermal properties of silicon compounds from first-principles calculations

    Energy Technology Data Exchange (ETDEWEB)

    Hou, Haijun; Zhu, H.J. [Yancheng Institute of Technology (China). School of Materials Engineering; Cheng, W.H. [Yancheng Institute of Technology (China). Dept. of Light Chemical Engineering; Xie, L.H. [Sichuan Normal Univ., Chengdu (China). Inst. of Solid State Physics and School of Physics and Electronic Engineering

    2016-11-01

    The structural and elastic properties of V-Si (V{sub 3}Si, VSi{sub 2}, V{sub 5}Si{sub 3}, and V{sub 6}Si{sub 5}) compounds are studied by using first-principles method. The calculated equilibrium lattice parameters and formation enthalpy are in good agreement with the available experimental data and other theoretical results. The calculated results indicate that the V-Si compounds are mechanically stable. Elastic properties including bulk modulus, shear modulus, Young's modulus, and Poisson's ratio are also obtained. The elastic anisotropies of V-Si compounds are investigated via the three-dimensional (3D) figures of directional dependences of reciprocals of Young's modulus. Finally, based on the quasi-harmonic Debye model, the internal energy, Helmholtz free energy, entropy, heat capacity, thermal expansion coefficient, Grueneisen parameter, and Debye temperature of V-Si compounds have been calculated.

  14. Complex Correlation Kohn-T Method of Calculating Total and Elastic Cross Sections. Part 1; Electron-Hydrogen Elastic Scattering

    Science.gov (United States)

    Bhatia, A. K.; Temkin, A.; Fisher, Richard R. (Technical Monitor)

    2001-01-01

    We report on the first part of a study of electron-hydrogen scattering, using a method which allows for the ab initio calculation of total and elastic cross sections at higher energies. In its general form the method uses complex 'radial' correlation functions, in a (Kohn) T-matrix formalism. The titled method, abbreviated Complex Correlation Kohn T (CCKT) method, is reviewed, in the context of electron-hydrogen scattering, including the derivation of the equation for the (complex) scattering function, and the extraction of the scattering information from the latter. The calculation reported here is restricted to S-waves in the elastic region, where the correlation functions can be taken, without loss of generality, to be real. Phase shifts are calculated using Hylleraas-type correlation functions with up to 95 terms. Results are rigorous lower bounds; they are in general agreement with those of Schwartz, but they are more accurate and outside his error bounds at a couple of energies,

  15. Heterotic moduli stabilization

    International Nuclear Information System (INIS)

    Cicoli, M.; De Alwis, S.; Colorado Univ., Boulder, CO; Westphal, A.

    2013-04-01

    We perform a systematic analysis of moduli stabilization for weakly coupled heterotic string theory compactified on smooth Calabi-Yau three-folds. We focus on both supersymmetric and supersymmetry breaking vacua of generic (0,2) compactifications obtained by minimising the total (F+D)-term scalar potential. After reviewing how to stabilise all the geometric moduli in a supersymmetric way by including fractional fluxes, non-perturbative and threshold effects, we show that the inclusion of α' corrections leads to new de Sitter or nearly Minkowski vacua which break supersymmetry spontaneously. The minimum lies at moderately large volumes of all the geometric moduli, at perturbative values of the string coupling and at the right phenomenological value of the GUT gauge coupling. However the structure of the heterotic 3-form flux used for complex structure moduli stabilization does not contain enough freedom to tune the superpotential. This results in the generic prediction of high-scale supersymmetry breaking around the GUT scale. We finally provide a dynamical derivation of anisotropic compactifications with stabilized moduli which allow for perturbative gauge coupling unification around 10 16 GeV.

  16. Heterotic moduli stabilization

    Energy Technology Data Exchange (ETDEWEB)

    Cicoli, M. [Bologna Univ. (Italy). Dipt. Fisica ed Astronomia; INFN, Bologna (Italy); Adbus Salam ICTP, Trieste (Italy); De Alwis, S. [Adbus Salam ICTP, Trieste (Italy); Colorado Univ., Boulder, CO (United States). UCB 390 Physics Dept.; Westphal, A. [DESY Hamburg (Germany). Theory Group

    2013-04-15

    We perform a systematic analysis of moduli stabilization for weakly coupled heterotic string theory compactified on smooth Calabi-Yau three-folds. We focus on both supersymmetric and supersymmetry breaking vacua of generic (0,2) compactifications obtained by minimising the total (F+D)-term scalar potential. After reviewing how to stabilise all the geometric moduli in a supersymmetric way by including fractional fluxes, non-perturbative and threshold effects, we show that the inclusion of {alpha}' corrections leads to new de Sitter or nearly Minkowski vacua which break supersymmetry spontaneously. The minimum lies at moderately large volumes of all the geometric moduli, at perturbative values of the string coupling and at the right phenomenological value of the GUT gauge coupling. However the structure of the heterotic 3-form flux used for complex structure moduli stabilization does not contain enough freedom to tune the superpotential. This results in the generic prediction of high-scale supersymmetry breaking around the GUT scale. We finally provide a dynamical derivation of anisotropic compactifications with stabilized moduli which allow for perturbative gauge coupling unification around 10{sup 16} GeV.

  17. Ultrasonic measurement of elastic moduli of 17-4 pH stainless steel and uranium -2 molybdenum from -400C to 8000C

    International Nuclear Information System (INIS)

    Gieske, J.H.

    1980-10-01

    Young's Modulus, shear modulus, and Poisson's ratio for 17-4 pH stainless steel and uranium -2 molybdenum are calculated from ultrasonic longitudinal and shear velocities determined from -40 0 C to 800 0 C. The ultrasonic velocities were determined at elevated temperatures using a through-transmission buffer rod arrangement. An indium-gallium slurry bond was used as an ultrasonic couplant between Cupernickel 10 alloy buffer rods and the specimen. Microstructural changes and phase transitions in the specimens are evident from the temperature dependence of the ultrasonic data. 10 figures, 3 tables

  18. Elastic properties of cubic perovskite BaRuO{sub 3} from first-principles calculations

    Energy Technology Data Exchange (ETDEWEB)

    Han Deming; Liu Xiaojuan; Lv Shuhui; Li Hongping [State Key Laboratory of Rare Earth Resource Utilization, Changchun Institute of Applied Chemistry, Chinese Academy of Sciences, Changchun 130022 (China); Meng Jian, E-mail: jmeng@ciac.jl.c [State Key Laboratory of Rare Earth Resource Utilization, Changchun Institute of Applied Chemistry, Chinese Academy of Sciences, Changchun 130022 (China)

    2010-08-01

    We present first-principles investigations on the structural and elastic properties of the cubic perovskite BaRuO{sub 3} using density-functional theory within both local density approximation (LDA) and generalized gradient approximation (GGA). Basic physical properties, such as lattice constant, shear modulus, elastic constants (C{sub ij}) are calculated. The calculated energy band structures show that the cubic perovskite BaRuO{sub 3} is metallic. We have also predicted the Young's modulus (Y), Poisson's ratio ({upsilon}), and Anisotropy factor (A).

  19. Moduli-induced baryogenesis

    Energy Technology Data Exchange (ETDEWEB)

    Ishiwata, Koji; Jeong, Kwang Sik [Deutsches Elektronen-Synchrotron (DESY), Hamburg (Germany); Takahashi, Fuminobu [Tohoku Univ., Sendai (Japan). Dept. of Physics; Tokyo Univ., Kashiwa (Japan). Kavli IPMU, TODIAS

    2013-12-15

    We study a scenario for baryogenesis in modular cosmology and discuss its implications for the moduli stabilization mechanism and the supersymmetry (SUSY) breaking scale. If moduli fields dominate the Universe and decay into the standard model particles through diatonic couplings, the right amount of baryon asymmetry can be generated through CP violating decay of gluino into quark and squark followed by baryon-number violating squark decay. We find that, in the KKLT-type moduli stabilization, at least two non-perturbative terms are required to obtain a sizable CP phase, and that the successful baryogenesis is possible for the soft SUSY breaking mass heavier than O(1) TeV. A part of the parameter space for successful baryogenesis can be probed at the collider experiments, dinucleon decay search experiment, and the measurements of electric dipole moments of neutron and electron. It is also shown that similar baryogenesis works in the case of the gravitino- or the saxion-dominated Universe.

  20. The elastic and thermodynamic properties of ZrMo2 from first principles calculations

    International Nuclear Information System (INIS)

    Liu, Xian-Kun; Zhou, Wei; Zheng, Zhou; Peng, Shu-Ming

    2014-01-01

    Highlights: • Elastic and thermodynamic properties of ZrMo 2 under high temperature and pressure are calculated by first principles. • Mechanical stability is testified from elastic constants at zero pressure. • Phonon scattering of ZrMo 2 under different temperature are obtained. - Abstract: The elastic and thermodynamic properties of ZrMo 2 under high temperature and pressure are investigated by first-principles calculations based on pseudopotential plane-wave density functional theory (DFT) within the generalized gradient approximation (GGA) and quasi-harmonic Debye model. The calculated lattice parameters are in good agreement with the available experimental data. The calculated elastic constants of ZrMo 2 increase monotonically with increasing pressure, and the relationship between the elastic constants and pressure show that ZrMo 2 satisfies the mechanical stability criteria under applied pressure (0–65 GPa). The related mechanical properties such as bulk modulus (B), shear modulus (G), Young’s modulus (E), and Poisson’s ratio (v) are also studied for polycrystalline of ZrMo 2 . The calculated B/G value shows that ZrMo 2 behaves in a ductile manner, and higher pressure can significantly improve the ductility of ZrMo 2 . The pressure and temperature dependencies of the relative volume, the bulk modulus, the elastic constants, the heat capacity and the thermal expansion coefficient, as well as the Grüneisen parameters are obtained and discussed by the quasi-harmonic Debye model in the ranges of 0–1800 K and 0–65 GPa

  1. Elastic constants of a Laves phase compound: C15 NbCr2

    International Nuclear Information System (INIS)

    Ormeci, A.; Chu, F.; Wills, J.M.; Chen, S.P.; Albers, R.C.; Thoma, D.J.; Mitchell, T.E.

    1997-01-01

    The single-crystal elastic constants of C15 NbCr 2 have been computed by using a first-principles, self-consistent, full-potential total energy method. From these single-crystal elastic constants the isotropic elastic moduli are calculated using the Voigt and Reuss averages. The calculated values are in fair agreement with the experimental values. The implications of the results are discussed with regards to Poisson's ratio and the direction dependence of Young's modulus

  2. FP-APW plus lo calculations of the elastic properties in zinc-blende III-P compounds under pressure effects

    Czech Academy of Sciences Publication Activity Database

    Bouhemadou, A.; Khenata, R.; Kharoubi, M.; Seddik, R.; Al-Douri, Y.; Reshak, Ali H

    2009-01-01

    Roč. 45, č. 2 (2009), s. 474-479 ISSN 0927-0256 Institutional research plan: CEZ:AV0Z60870520 Keywords : III-P compounds * Elastic moduli * Pressure effect Subject RIV: BO - Biophysics Impact factor: 1.522, year: 2009

  3. Comparison of stress and total energy methods for calculation of elastic properties of semiconductors.

    Science.gov (United States)

    Caro, M A; Schulz, S; O'Reilly, E P

    2013-01-16

    We explore the calculation of the elastic properties of zinc-blende and wurtzite semiconductors using two different approaches: one based on stress and the other on total energy as a function of strain. The calculations are carried out within the framework of density functional theory in the local density approximation, with the plane wave-based package VASP. We use AlN as a test system, with some results also shown for selected other materials (C, Si, GaAs and GaN). Differences are found in convergence rate between the two methods, especially in low symmetry cases, where there is a much slower convergence for total energy calculations with respect to the number of plane waves and k points used. The stress method is observed to be more robust than the total energy method with respect to the residual error in the elastic constants calculated for different strain branches in the systems studied.

  4. Quantum Mechanical Calculations Of Elastic Properties Of Doped Tetragonal Yttria-Stabilized Zirconium Dioxide

    Directory of Open Access Journals (Sweden)

    Yuriy Natanzon

    2008-01-01

    Full Text Available We report first principles calculations of the electronic and elastic properties of yttriastabilized tetragonal zirconium dioxide doped with metal oxides like: GeO2, TiO2, SiO2,MgO and Al2O3. It is shown that addition of such dopants affects selected elastic propertiesof ZrO2, which is driven by the attraction of electron density by dopant atom and creationof stronger dopant–oxygen bonds. This effect contributes to the increase of superplasticityof doped material.

  5. First Principles Calculations for X-ray Resonant Spectra and Elastic Properties

    International Nuclear Information System (INIS)

    Yongbin Lee

    2006-01-01

    In this thesis, we discuss applications of first principles methods to x-ray resonant spectra and elastic properties calculation. We start with brief reviews about theoretical background of first principles methods, such as density functional theory, local density approximation (LDA), LDA+U, and the linear augmented plane wave (LAPW) method to solve Kohn-Sham equations. After that we discuss x-ray resonant scattering (XRMS), x-ray magnetic circular dichroism (XMCD) and the branching problem in the heavy rare earths Ledges. In the last chapter we discuss the elastic properties of the second hardest material AlMgB 14

  6. Resonant Acoustic Determination of Complex Elastic Moduli

    Science.gov (United States)

    1991-03-01

    Classification uncssified/.unimled - sae as report [] DnC ui, Unclassified 22a Name of Responsible Individual 22b Telephone (Include Area code) 22c Office Symbol...4090 DISP " Run: "Block2$ 4100 WAIT 1 4110 DISP "Mode: "Blocic3$ 4120 WAIT 1 4130 DISP" Date: "Block4$ 4140 WAIT 1 4150 DISP "Mass: "Mass;"grams

  7. Proposal of Design Formulae for Equivalent Elasticity of Masonry Structures Made with Bricks of Low Modulus

    Directory of Open Access Journals (Sweden)

    Muhammad Ridwan

    2017-01-01

    Full Text Available Bricks of low elastic modulus are occasionally used in some developing countries, such as Indonesia and India. Most of the previous research efforts focused on masonry structures built with bricks of considerably high elastic modulus. The objective of this study is to quantify the equivalent elastic modulus of lower-stiffness masonry structures, when the mortar has a higher modulus of elasticity than the bricks, by employing finite element (FE simulations and adopting the homogenization technique. The reported numerical simulations adopted the two-dimensional representative volume elements (RVEs using quadrilateral elements with four nodes. The equivalent elastic moduli of composite elements with various bricks and mortar were quantified. The numerically estimated equivalent elastic moduli from the FE simulations were verified using previously established test data. Hence, a new simplified formula for the calculation of the equivalent modulus of elasticity of such masonry structures is proposed in the present study.

  8. Trends in elasticity and electronic structure of 5d transition metal diborides: first-principles calculations

    International Nuclear Information System (INIS)

    Hao Xianfeng; Wu Zhijian; Xu Yuanhui; Zhou Defeng; Liu Xiaojuan; Meng Jian

    2007-01-01

    We investigate the cohesive energy, heat of formation, elastic constant and electronic band structure of transition metal diborides TMB 2 (TM = Hf, Ta, W, Re, Os and Ir, Pt) in the Pmmn space group using the ab initio pseudopotential total energy method. Our calculations indicate that there is a relationship between elastic constant and valence electron concentration (VEC): the bulk modulus and shear modulus achieve their maximum when the VEC is in the range of 6.8-7.2. In addition, trends in the elastic constant are well explained in terms of electronic band structure analysis, e.g., occupation of valence electrons in states near the Fermi level, which determines the cohesive energy and elastic properties. The maximum in bulk modulus and shear modulus is attributed to the nearly complete filling of TM d-B p bonding states without filling the antibonding states. On the basis of the observed relationship, we predict that alloying W and Re in the orthorhombic structure OsB 2 might be harder than alloying the Ir element. Indeed, the further calculations confirmed this expectation

  9. Trends in elasticity and electronic structure of 5d transition metal diborides: first-principles calculations

    Energy Technology Data Exchange (ETDEWEB)

    Hao Xianfeng [Key Laboratory of Rare Earth Chemistry and Physics, Changchun Institute of Applied Chemistry, Chinese Academy of Sciences, Changchun 130022 (China); Wu Zhijian [Key Laboratory of Rare Earth Chemistry and Physics, Changchun Institute of Applied Chemistry, Chinese Academy of Sciences, Changchun 130022 (China); Xu Yuanhui [School of Biological Engineering, Changchun University of Technology, Changchun 130012 (China); Zhou Defeng [School of Biological Engineering, Changchun University of Technology, Changchun 130012 (China); Liu Xiaojuan [Key Laboratory of Rare Earth Chemistry and Physics, Changchun Institute of Applied Chemistry, Chinese Academy of Sciences, Changchun 130022 (China); Meng Jian [Key Laboratory of Rare Earth Chemistry and Physics, Changchun Institute of Applied Chemistry, Chinese Academy of Sciences, Changchun 130022 (China)

    2007-05-16

    We investigate the cohesive energy, heat of formation, elastic constant and electronic band structure of transition metal diborides TMB{sub 2} (TM = Hf, Ta, W, Re, Os and Ir, Pt) in the Pmmn space group using the ab initio pseudopotential total energy method. Our calculations indicate that there is a relationship between elastic constant and valence electron concentration (VEC): the bulk modulus and shear modulus achieve their maximum when the VEC is in the range of 6.8-7.2. In addition, trends in the elastic constant are well explained in terms of electronic band structure analysis, e.g., occupation of valence electrons in states near the Fermi level, which determines the cohesive energy and elastic properties. The maximum in bulk modulus and shear modulus is attributed to the nearly complete filling of TM d-B p bonding states without filling the antibonding states. On the basis of the observed relationship, we predict that alloying W and Re in the orthorhombic structure OsB{sub 2} might be harder than alloying the Ir element. Indeed, the further calculations confirmed this expectation.

  10. Fatigue analysis - computation of the actual strain range using elastic calculations (factor Ke)

    International Nuclear Information System (INIS)

    Roche, R.L.

    1987-01-01

    Pressure vessels are not eternal, their life is not endless, but must be long enough for profitable use. Fatigue is the most important damage limiting life time. It is due to variable loading and especially to deformation-controlled loading like thermal dilatation (thermal stress). Hence, it is of prime importance to perform an fatigue analysis in the design phase in order to be sure the pressure vessel life meet requirement of the design specification. It is also useful to perform such an analysis for assessing the remaining life. To compute the fatigue damage, knowledge of the strain range is needed. As calculation taking into account non linear behavior of the material are very expensive and not always reliable, the current practice is using elastic computation. The aim of this paper is to discuss the methods for correcting the elastically calculated strain range and to propose a sound and practical method

  11. Density functional theory and evolution algorithm calculations of elastic properties of AlON

    Energy Technology Data Exchange (ETDEWEB)

    Batyrev, I. G.; Taylor, D. E.; Gazonas, G. A.; McCauley, J. W. [U.S. Army Research Laboratory, Aberdeen Proving Ground, Maryland 21005 (United States)

    2014-01-14

    Different models for aluminum oxynitride (AlON) were calculated using density functional theory and optimized using an evolutionary algorithm. Evolutionary algorithm and density functional theory (DFT) calculations starting from several models of AlON with different Al or O vacancy locations and different positions for the N atoms relative to the vacancy were carried out. The results show that the constant anion model [McCauley et al., J. Eur. Ceram. Soc. 29(2), 223 (2009)] with a random distribution of N atoms not adjacent to the Al vacancy has the lowest energy configuration. The lowest energy structure is in a reasonable agreement with experimental X-ray diffraction spectra. The optimized structure of a 55 atom unit cell was used to construct 220 and 440 atom models for simulation cells using DFT with a Gaussian basis set. Cubic elastic constant predictions were found to approach the experimentally determined AlON single crystal elastic constants as the model size increased from 55 to 440 atoms. The pressure dependence of the elastic constants found from simulated stress-strain relations were in overall agreement with experimental measurements of polycrystalline and single crystal AlON. Calculated IR intensity and Raman spectra are compared with available experimental data.

  12. Systematic study of the elastic properties of Mn3AC antiperovskite with A = Zn, Al, Ga, In, Tl, Ge and Sn

    International Nuclear Information System (INIS)

    Medkour, Y.; Roumili, A.; Maouche, D.; Saoudi, A.; Louail, L.

    2012-01-01

    Highlights: ► Single crystal elastic constants C 11 , C 12 and C 44 were calculated. ► Elastic moduli for polycrystalline aggregate were obtained. ► Increasing the atomic number of A element reduces B, G′, Y and v. ► Mn 3 AlC has a high melting point and light weight. - Abstract: First principle calculations were made to investigate the elastic properties of Mn 3 AC antiperovskites, A = Zn, Al, Ga, In, Tl, Ge and Sn. The estimated equilibrium lattice parameters are in agreement with the experimental ones. From the single crystal elastic constants we have calculated the polycrystalline elastic moduli: the bulk modulus B, shear modulus G, tetragonal shear modulus G′, Young’s modulus Y, Cauchy’s pressure CP, Poisson’s ratio v, elastic anisotropy factor and Pugh’s criterion G/B. Using Debye’s approximation we have deduced the elastic wave velocities and Debye’s temperature.

  13. First principles investigation of structural, electronic, elastic and thermal properties of rare-earth-doped titanate Ln2TiO5

    Directory of Open Access Journals (Sweden)

    Hui Niu

    2012-09-01

    Full Text Available Systematic first-principles calculations based on density functional theory were performed on a wide range of Ln2TiO5 compositions (Ln = La, Ce, Pr, Nd, Sm, Gd, Tb, Dy and Y in order to investigate their structural, elastic, electronic, and thermal properties. At low temperature, these compounds crystallize in orthorhombic structures with a Pnma symmetry, and the calculated equilibrium structural parameters agree well with experimental results. A complete set of elastic parameters including elastic constants, Hill's bulk moduli, Young's moduli, shear moduli and Poisson's ratio were calculated. All Ln2TiO5 are ductile in nature. Analysis of densities of states and charge densities and electron localization functions suggests that the oxide bonds are highly ionic with some degree of covalency in the Ti-O bonds. Thermal properties including the mean sound velocity, Debye temperature, and minimum thermal conductivity were obtained from the elastic constants.

  14. Theoretical investigations on the elastic and thermodynamic properties of Ti2AlC0.5N0.5 solid solution

    International Nuclear Information System (INIS)

    Du, Y.L.; Sun, Z.M.; Hashimoto, H.; Barsoum, M.W.

    2009-01-01

    We have performed theoretical studies on the elastic and thermodynamic properties of the solid solution: Ti 2 AlC 0.5 N 0.5 . The lattice parameters, elastic constants, bulk, shear, Young's moduli, Poisson's ratio and Debye temperature were calculated and compared with those of the end members, Ti 2 AlC and Ti 2 AlN. The temperature dependence of the bulk moduli, thermal expansion coefficient and specific heats of Ti 2 AlC 0.5 N 0.5 were obtained from the quasi-harmonic Debye model. The calculated elastic and thermodynamic properties were compared with experimental data.

  15. Calculated Changes in the Elastic Properties of MgCNi3 at the Superconducting Transition

    Directory of Open Access Journals (Sweden)

    R. Abd-Shukor

    2013-01-01

    Full Text Available We calculated the elastic properties of MgCNi3 at the superconducting transition ( using various thermodynamic and acoustic data. From the calculations, a step discontinuity of 8 ppm in the bulk modulus, 7 ppm in the Young’s modulus, and 3 ppm in the longitudinal sound velocity ( is expected at . The step discontinuities at the transition temperature indicated the importance of lattice changes to the superconducting mechanism of MgCNi3. The Debye temperature was calculated to be 460 K. The electron-phonon coupling constants calculated in the weak and strong coupling limits of the BCS theory and the van Hove scenario showed that MgCNi3 is a moderately strong coupled superconductor.

  16. Calculation of the Strip Foundation on Solid Elastic Base, Taking into Account the Karst Collapse

    Science.gov (United States)

    Sharapov, R.; Lodigina, N.

    2017-07-01

    Karst processes greatly complicate the construction and operation of buildings and structures. Due to the karstic deformations at different times there have been several major accidents, which analysis showed that in all cases the fundamental errors committed at different stages of building development: site selection, engineering survey, design, construction or operation of the facilities. Theory analysis of beams on elastic foundation is essential in building practice. Specialist engineering facilities often have to resort to multiple designing in finding efficient forms of construction of these facilities. In work the calculation of stresses in cross-sections of the strip foundation evenly distributed load in the event of karst. A comparison of extreme stress in the event of karst and without accounting for the strip foundation as a beam on an elastic foundation.

  17. The Relationship between Trabecular Bone Structure Modeling Methods and the Elastic Modulus as Calculated by FEM

    Directory of Open Access Journals (Sweden)

    Tomasz Topoliński

    2012-01-01

    Full Text Available Trabecular bone cores were collected from the femoral head at the time of surgery (hip arthroplasty. Investigated were 42 specimens, from patients with osteoporosis and coxarthrosis. The cores were scanned used computer microtomography (microCT system at an isotropic spatial resolution of 36 microns. Image stacks were converted to finite element models via a bone voxel-to-element algorithm. The apparent modulus was calculated based on the assumptions that for the elastic properties, E=10 MPa and ν=0.3. The compressive deformation as calculated by finite elements (FE analysis was 0.8%. The models were coarsened to effectively change the resolution or voxel size (from 72 microns to 288 microns or from 72 microns to 1080 microns. The aim of our study is to determine how an increase in the distance between scans changes the elastic properties as calculated by FE models. We tried to find a border value voxel size at which the module values were possible to calculate. As the voxel size increased, the mean voxel volume increased and the FEA-derived apparent modulus decreased. The slope of voxel size versus modulus relationship correlated with several architectural indices of trabecular bone.

  18. Moduli of weighted hyperplane arrangements

    CERN Document Server

    Lahoz, Martí; Macrí, Emanuele; Stellari, Paolo

    2015-01-01

    This book focuses on a large class of geometric objects in moduli theory and provides explicit computations to investigate their families. Concrete examples are developed that take advantage of the intricate interplay between Algebraic Geometry and Combinatorics. Compactifications of moduli spaces play a crucial role in Number Theory, String Theory, and Quantum Field Theory – to mention just a few. In particular, the notion of compactification of moduli spaces has been crucial for solving various open problems and long-standing conjectures. Further, the book reports on compactification techniques for moduli spaces in a large class where computations are possible, namely that of weighted stable hyperplane arrangements.

  19. Calculated temperature dependence of elastic constants and phonon dispersion of hcp and bcc beryllium

    Science.gov (United States)

    Hahn, Steven; Arapan, Sergiu; Harmon, Bruce; Eriksson, Olle

    2011-03-01

    Conventional first principle methods for calculating lattice dynamics are unable to calculate high temperature thermophysical properties of materials containing modes that are entropically stabilized. In this presentation we use a relatively new approach called self-consistent ab initio lattice dynamics (SCAILD) to study the hcp to bcc transition (1530 K) in beryllium. The SCAILD method goes beyond the harmonic approximation to include phonon-phonon interactions and produces a temperature-dependent phonon dispersion. In the high temperature bcc structure, phonon-phonon interactions dynamically stabilize the N-point phonon. Fits to the calculated phonon dispersion were used to determine the temperature dependence of the elastic constants in the hcp and bcc phases. Work at the Ames Laboratory was supported by the Department of Energy-Basic Energy Sciences under Contract No. DE-AC02-07CH11358.

  20. Thermodynamics and elastic properties of Ir from first-principle calculations

    International Nuclear Information System (INIS)

    Li Qiang; Huang Duohui; Cao Qilong; Wang Fanhou

    2013-01-01

    Within the framework of the quasiharmonic approximation, the thermodynamics and elastic properties, including phonon dispersion curves, equation of state, linear thermal expansion coefficient and temperature-dependent entropy, enthalpy, heat capacity, elastic constants, bulk modulus, shear modulus, Young's modulus of Ir have been studied using first-principles projector-augmented wave method. The results revealed that the predicted phonon dispersion curves of Ir are in agreement with the experimental measurements by neutron diffractions. Considering the thermal electronic contribution to Helmholtz free energy, the calculated entropy, enthalpy, heat capacity and linear thermal expansion co- efficient from the first-principle are consistent well with the experimental data. At 2600 K, the electronic heat capacity accounts for 17% of the total heat capacity at constant pressure, thus the thermal electronic contribution to Helmholtz free energy is very important. The predicted elastic constants, bulk modulus, shear modulus and Young's modulus at room temperature are also in agreement with the available measurements and increase with the increasing temperature. (authors)

  1. Structural, electronic and elastic properties of potassium hexatitanate crystal from first-principles calculations

    International Nuclear Information System (INIS)

    Hua Manyu; Li Yimin; Long Chunguang; Li Xia

    2012-01-01

    The structural, electronic and elastic properties of potassium hexatitanate (K 2 Ti 6 O 13 ) whisker were investigated using first-principles calculations. The calculated cell parameters of K 2 Ti 6 O 13 including lattice constants and atomic positions are in good agreement with the experimental data. The obtained formation enthalpy (-61.1535 eV/atom) and cohesive energy (-137.4502 eV/atom) are both negative, showing its high structural stability. Further analysis of the electronic structures shows that the potassium hexatitanate is a wide-band semiconductor. Within K 2 Ti 6 O 13 crystal, the Ti---O bonding interactions are stronger than that of K---O, while no apparent K---Ti bonding interactions can be observed. The structural stability of K 2 Ti 6 O 13 was closely associated with the covalent bond interactions between Ti (d) and O (p) orbits. Further calculations on elastic properties show that K 2 Ti 6 O 13 is a high stiffness and brittle material with small anisotropy in shear and compression.

  2. Microscopic calculations of elastic scattering between light nuclei based on a realistic nuclear interaction

    Energy Technology Data Exchange (ETDEWEB)

    Dohet-Eraly, Jeremy [F.R.S.-FNRS (Belgium); Sparenberg, Jean-Marc; Baye, Daniel, E-mail: jdoheter@ulb.ac.be, E-mail: jmspar@ulb.ac.be, E-mail: dbaye@ulb.ac.be [Physique Nucleaire et Physique Quantique, CP229, Universite Libre de Bruxelles (ULB), B-1050 Brussels (Belgium)

    2011-09-16

    The elastic phase shifts for the {alpha} + {alpha} and {alpha} + {sup 3}He collisions are calculated in a cluster approach by the Generator Coordinate Method coupled with the Microscopic R-matrix Method. Two interactions are derived from the realistic Argonne potentials AV8' and AV18 with the Unitary Correlation Operator Method. With a specific adjustment of correlations on the {alpha} + {alpha} collision, the phase shifts for the {alpha} + {alpha} and {alpha} + {sup 3}He collisions agree rather well with experimental data.

  3. Moduli spaces of unitary conformal field theories

    International Nuclear Information System (INIS)

    Wendland, K.

    2000-08-01

    We investigate various features of moduli spaces of unitary conformal field theories. A geometric characterization of rational toroidal conformal field theories in arbitrary dimensions is presented and discussed in relation to singular tori and those with complex multiplication. We study the moduli space M 2 of unitary two-dimensional conformal field theories with central charge c = 2. All the 26 non-exceptional non-isolated irreducible components of M 2 are constructed that may be obtained by an orbifold procedure from toroidal theories. The parameter spaces and partition functions are calculated explicitly. All multicritical points and lines are determined, such that all but three of these 26 components are directly or indirectly connected to the space of toroidal theories in M 2 . Relating our results to those by Dixon, Ginsparg, Harvey on the classification of c = 3/2 superconformal field theories, we give geometric interpretations to all non-isolated orbifolds discussed by them and correct their statements on multicritical points within the moduli space of c = 3/2 superconformal field theories. In the main part of this work, we investigate the moduli space M of N = (4, 4) superconformal field theories with central charge c = 6. After a slight emendation of its global description we give generic partition functions for models contained in M. We explicitly determine the locations of various known models in the component of M associated to K3 surfaces

  4. Lattice dynamics, thermodynamics and elastic properties of C22-Zr{sub 6}FeSn{sub 2} from first-principles calculations

    Energy Technology Data Exchange (ETDEWEB)

    Feng, Xuan-Kai [School of Materials Science and Engineering, Shanghai University, Shanghai 200444 (China); Shi, Siqi, E-mail: sqshi@shu.edu.cn [School of Materials Science and Engineering, Shanghai University, Shanghai 200444 (China); Materials Genome Institute, Shanghai University, Shanghai 200444 (China); Shen, Jian-Yun [General Research Institute for Nonferrous Metals, Beijing 100088 (China); Shang, Shun-Li [Department of Materials Science and Engineering, The Pennsylvania State University, University Park, PA 16802 (United States); Yao, Mei-Yi, E-mail: yaomeiyi@shu.edu.cn [School of Materials Science and Engineering, Shanghai University, Shanghai 200444 (China); Liu, Zi-Kui [Department of Materials Science and Engineering, The Pennsylvania State University, University Park, PA 16802 (United States)

    2016-10-15

    Since Zr-Fe-Sn is one of the key ternary systems for cladding and structural materials in nuclear industry, it is of significant importance to understand physicochemical properties related to Zr-Fe-Sn system. In order to design the new Zr alloys with advanced performance by CALPHAD method, the thermodynamic model for the lower order systems is required. In the present work, first-principles calculations are employed to obtain phonon, thermodynamic and elastic properties of Zr{sub 6}FeSn{sub 2} with C22 structure and the end-members (C22-Zr{sub 6}FeFe{sub 2}, C22-Zr{sub 6}SnSn{sub 2} and C22-Zr{sub 6}SnFe{sub 2}) in the model of (Zr){sub 6}(Fe, Sn){sub 2}(Fe, Sn){sub 1}. It is found that the imaginary phonon modes are absent for C22-Zr{sub 6}FeSn{sub 2} and C22-Zr{sub 6}SnSn{sub 2}, indicating they are dynamically stable, while the other two end-members are unstable. Gibbs energies of C22-Zr{sub 6}FeSn{sub 2} and C22-Zr{sub 6}SnSn{sub 2} are obtained from the quasiharmonic phonon approach and can be added in the thermodynamic database: Nuclearbase. The C22-Zr{sub 6}FeSn{sub 2}’s single-crystal elasticity tensor components along with polycrystalline bulk, shear and Young’s moduli are computed with a least-squares approach based upon the stress tensor computed from first-principles method. The results indicate that distortion is more difficult in the directions normal the c-axis than along to it.

  5. A first principle calculation of anisotropic elastic, mechanical and electronic properties of TiB

    Science.gov (United States)

    Zhang, Junqin; Zhao, Bin; Ma, Huihui; Wei, Qun; Yang, Yintang

    2018-04-01

    The structural, mechanical and electronic properties of the NaCl-type structure TiB are theoretically calculated based on the first principles. The density of states of TiB shows obvious density peaks at -0.70eV. Furthermore, there exists a pseudogap at 0.71eV to the right of the Fermi level. The calculated structural and mechanical parameters (i.e., bulk modulus, shear modulus, Young's modulus, Poisson's ratio and universal elastic anisotropy index) were in good agreement both with the previously reported experimental values and theoretical results at zero pressure. The mechanical stability criterion proves that TiB at zero pressure is mechanistically stable and exhibits ductility. The universal anisotropic index and the 3D graphics of Young's modulus are also given in this paper, which indicates that TiB is anisotropy under zero pressure. Moreover, the effects of applied pressures on the structural, mechanical and anisotropic elastic of TiB were studied in the range from 0 to 100GPa. It was found that ductility and anisotropy of TiB were enhanced with the increase of pressure.

  6. Elastic and elastic-plastic behaviour of a piping system during blowdown - Comparison of measurement and calculation

    International Nuclear Information System (INIS)

    Petruschke, W.; Strunk, G.

    1987-01-01

    The investigations according to the system identification show that the piping model using beam theory and flexibility factors according to the Karman theory are adequate for evaluating natural frequencies, mode shapes, static displacements and stresses. The same accuracy can be seen by comparing the piping response due to blowdown within the elastic range. The simplified elastic-plastic analysis in general overestimates the maximum amplitudes while the frequency content is not simulated very well. For practical purposes, it can be an adequate tool in many cases. The elastic-plastic analysis is the most expensive procedure but gives also the best results. The use of beam elements with multilinear moment-curvature relationships results in a good approximation for the global behaviour (displacements). The strains according to this theory only include the beam deformation modes

  7. Moduli spaces in algebraic geometry

    International Nuclear Information System (INIS)

    Goettsche, L.

    2000-01-01

    This volume of the new series of lecture notes of the Abdus Salam International Centre for Theoretical Physics contains the lecture notes of the School on Algebraic Geometry which took place at the Abdus Salam International Centre for Theoretical Physics from 26 July to 13 August 1999. The school consisted of 2 weeks of lecture courses and one week of conference. The topic of the school was moduli spaces. More specifically the lectures were divided into three subtopics: principal bundles on Riemann surfaces, moduli spaces of vector bundles and sheaves on projective varieties, and moduli spaces of curves

  8. Mechanical strength calculation of the disk type windings with elastic couplings by the finite element method

    International Nuclear Information System (INIS)

    Sivkova, G.N.; Spirchenko, Yu.V.; Chvartatskij, P.V.

    1981-01-01

    Stressed-deformed state of toroidal field coils of the disc type with elastic couplings of the tokamaks has been investigated with provision for the effect of the central core pliability by means of the two-dimensional version of the finite element method. Numerical solution of the finite element method is performed by means of the ES 1040 computer according to the computer code permitting taking account of boundary conditions of elastic support. The calculation has been performed using as the example the project of T-20 facility coil of the disc type. Consideration of pliability of the central core of the facility inductor is accomplished by the introduction of additional rigidities to the complete matrix of rigidity. Scheme of the structure distretization includes 141 units, 211 elements. The accuracy of solution depends on the reduction accuracy of the volume load to unit forces and on the number of finite elements. Analysis of the solution convergence is performed by the comparison of solutions obtained for three different schemes of the disk discretization without regard for the inductor pliability. The comparative analysis of the results shows that transfer epures for all the three discretization versions practically coincide and stresses differ not more than by 10%. On the whole the above investigation has demonstrated good convergence of the problem solution [ru

  9. On the representation of electron multiple elastic-scattering distributions for Monte Carlo calculations

    International Nuclear Information System (INIS)

    Kawrakow, I.; Bielajew, A.F.

    1998-01-01

    A new representation of elastic electron-nucleus (Coulomb) multiple-scattering distributions is developed. Using the screened Rutherford cross section with the Moliere screening parameter as an example, a simple analytic angular transformation of the Goudsmit-Saunderson multiple-scattering distribution accounts for most of the structure of the angular distribution leaving a residual 3-parameter (path-length, transformed angle and screening parameter) function that is reasonably slowly varying and suitable for rapid, accurate interpolation in a computer-intensive algorithm. The residual function is calculated numerically for a wide range of Moliere screening parameters and path-lengths suitable for use in a general-purpose condensed-history Monte Carlo code. Additionally, techniques are developed that allow the distributions to be scaled to account for energy loss. This new representation allows ''''on-the-fly'''' sampling of Goudsmit-Saunderson angular distributions in a screened Rutherford approximation suitable for class II condensed-history Monte Carlo codes. (orig.)

  10. Hauser-Feshbach cross-section calculations for elastic and inelastic scattering of alpha particles-program CORA

    International Nuclear Information System (INIS)

    Hartman, A.; Siemaszko, M.; Zipper, W.

    1975-01-01

    The program CORA was prepared on the basis of Hauser and Feshbach compound reaction formalism. It allows the differential cross-section distributions for the elastic and inelastic scattering of alpha particles (via compound nucleus state) to be calculated. The transmission coefficients are calculated on the basis of a four parameter optical model. The search procedure is also included. (author)

  11. An elastic elements calculation in the construction of electrical connectors based on flexible printed cables

    Directory of Open Access Journals (Sweden)

    Yefimenko A. A.

    2016-05-01

    Full Text Available In this article we consider the method of constructive parameters calculation of the elastic elements, which are used in electrical connectors of flexible printed cables. Electrical connectors characterized by the fact that the contact pair is needed to provide pressure. It is also important to know the optimum ratio between stability of the contact connection and the necessary value of the transition resistance. These ratios are studied sufficiently for discrete electrical connectors, however for connectors of flexible printed cables this theme is not explored enough. The purpose of this work is to develop methods that will allow to carry out calculations for elastic elements, which provide communication, and to determine the size of case elements for electrical connectors. We consider two types of connectors. First are removable electrical connections where it is necessary to find a compromise between the resistance value and the separating (engaging force. Second are permanent connections, where counts only the value of the transition resistance. For the first type of connectors were considered a simple form of the liner, in the shape of a rubber block, as in this case, the pressure should be created only by the compression of the liner and fixing it. It is important to get accurate results of the pressure calculation for removable electrical connections, because in this case we consider especial shape of elastomeric liner, which allows to create the pressure not only by compression of the liner, but by deformation it as a spring. For this task, the engaging force was specified on the basis of already known facts. It was important to set the amount of deformation that defines the shape and size of the liner and the case. We solved the problem of transition from the units of measuring hardness, specified in the technical specifications of rubber, to the value of the Young's modulus used in the calculations of constructive parameters of

  12. Dimensional reduction for D3-brane moduli

    International Nuclear Information System (INIS)

    Cownden, Brad; Frey, Andrew R.; Marsh, M.C. David; Underwood, Bret

    2016-01-01

    Warped string compactifications are central to many attempts to stabilize moduli and connect string theory with cosmology and particle phenomenology. We present a first-principles derivation of the low-energy 4D effective theory from dimensional reduction of a D3-brane in a warped Calabi-Yau compactification of type IIB string theory with imaginary self-dual 3-form flux, including effects of D3-brane motion beyond the probe approximation, and find the metric on the moduli space of brane positions, the universal volume modulus, and axions descending from the 4-form potential. As D3-branes may be considered as carrying either electric or magnetic charges for the self-dual 5-form field strength, we present calculations in both duality frames. Our results are consistent with, but extend significantly, earlier results on the low-energy effective theory arising from D3-branes in string compactifications.

  13. Improved measurements of elastic properties at acoustic resonant frequencies

    International Nuclear Information System (INIS)

    Rosinger, H.E.; Ritchie, I.G.; Shillinglaw, A.J.

    1976-01-01

    The choice of specimens of rectangular cross section for determination of dynamic elastic moduli by the resonant bar technique is often dictated by specimen fabrication problems. The specimen of rectangular cross section lends itself to accurate determination of elastic vibration shapes by a method in which a simple noncontacting optical transducer is used. The unequivocal indexing of the various vibration modes obtained in this way more than compensates for the added computational difficulties associated with rectangular geometry. The approximations used in the calculations of Young's modulus and the shear modulus for bars of rectangular cross section are tested experimentally and it is shown that high precision can be obtained. Determinations of changes in dynamic elastic moduli with temperature or stress are also described. (author)

  14. Moduli space of torsional manifolds

    International Nuclear Information System (INIS)

    Becker, Melanie; Tseng, L.-S.; Yau, S.-T.

    2007-01-01

    We characterize the geometric moduli of non-Kaehler manifolds with torsion. Heterotic supersymmetric flux compactifications require that the six-dimensional internal manifold be balanced, the gauge bundle be Hermitian Yang-Mills, and also the anomaly cancellation be satisfied. We perform the linearized variation of these constraints to derive the defining equations for the local moduli. We explicitly determine the metric deformations of the smooth flux solution corresponding to a torus bundle over K3

  15. On the application of the procedure of dynamic relaxation for the calculation of an elastical bedded hushy sperical shell

    International Nuclear Information System (INIS)

    Thiede, R.

    1980-01-01

    In the treatment of elastically embeded shells by finite element methods, a calculation of the rigid body deformations before each iteration essentially improves the convergence of the method. This is also the case when calculating with fictitions densities instead of the real material densities. Some evidence has been obtained for the choice of a damping factor by empirical evaluation of several model calculations. (GL) [de

  16. TO THE SOLUTION OF PROBLEMS ABOUT THE RAILWAYS CALCULATION FOR STRENGTH TAKING INTO ACCOUNT UNEQUAL ELASTICITY OF THE SUBRAIL BASE

    Directory of Open Access Journals (Sweden)

    D. M. Kurhan

    2014-11-01

    Full Text Available Purpose. The module of elasticity of the subrail base is one of the main characteristics for an assessment intense the deformed condition of a track. Need for different cases to consider unequal elasticity of the subrail base repeatedly was considered, however, results contained rather difficult mathematical approaches and the obtained decisions didn't keep within borders of standard engineering calculation of a railway on strength. Therefore the purpose of this work is obtaining the decision within this document. Methodology. It is offered to consider a rail model as a beam which has the distributed loading of such outline corresponding to value of the module of elasticity that gives an equivalent deflection at free seating on bearing parts. Findings. The method of the accounting of gradual change of the module of elasticity of the subrail base by means of the correcting coefficient in engineering calculation of a way on strength was received. Expansion of existing calculation of railways strength was developed for the accounting of sharp change of the module of elasticity of the subrail base (for example, upon transition from a ballast design of a way on the bridge. The characteristic of change of forces operating from a rail on a basis, depending on distance to the bridge on an approach site from a ballast design of a way was received. The results of the redistribution of forces after a sudden change in the elastic modulus of the base under the rail explain the formation of vertical irregularities before the bridge. Originality. The technique of engineering calculation of railways strength for performance of calculations taking into account unequal elasticity of the subrail base was improved. Practical value. The obtained results allow carrying out engineering calculations for an assessment of strength of a railway in places of unequal elasticity caused by a condition of a way or features of a design. The solution of the return task on

  17. Moduli mediation without moduli-induced gravitino problem

    Energy Technology Data Exchange (ETDEWEB)

    Akita, Kensuke [Department of Physics, Waseda University, Tokyo, 169-8555 (Japan); Kobayashi, Tatsuo [Department of Physics, Hokkaido University,Sapporo, 060-0810 (Japan); Oikawa, Akane; Otsuka, Hajime [Department of Physics, Waseda University, Tokyo, 169-8555 (Japan)

    2016-05-30

    We study the moduli-induced gravitino problem within the framework of the phenomenologically attractive mirage mediations. The huge amount of gravitino generated by the moduli decay can be successfully diluted by introducing an extra light modulus field which does not induce the supersymmetry breaking. Since the lifetime of extra modulus field becomes longer than usually considered modulus field, our proposed mechanism is applied to both the low- and high-scale supersymmetry breaking scenarios. We also point out that such an extra modulus field appears in the flux compactification of type II string theory.

  18. Ultrasonic measurement of elastic constants at temperatures from 20 to 11000C

    International Nuclear Information System (INIS)

    Moyer, M.W.; Hammond, J.P.

    1976-09-01

    Measurements of the elastic moduli at temperatures from 20 to 1100 0 C of a number of materials of interest in the Liquid Metal Fast Breeder Reactor and the High Temperature Gas Reactor were accomplished using acoustic techniques. A two-step process was required to complete the measurements. First, the acoustic velocities were measured accurately on bulk samples at room temperature, then a wire sample was used to make elevated-temperature measurements. A computer was used to calculate the moduli and plot the data. A detailed summary has been made of the sources of error and a calculation of the precision of the measurements is given

  19. Elastic properties of LaSnxNi5-x compounds

    International Nuclear Information System (INIS)

    Yeheskel, O.; Nattrass, C.E.; Leisure, R.G.; Jacob, I.; Bowman, R.C. Jr.

    2004-01-01

    Ultrasonic methods were used to measure the room-temperature elastic moduli of polycrystalline LaSn x Ni 5-x compounds for 0≤x≤0.5. These materials are of great importance for their hydrogen storage properties. The samples, prepared by a hot isostatic pressing method, had near-theoretical densities with calculated porosities ranging from 0 to 1.5%. The porosity-corrected moduli decreased with increasing x. Poisson's ratio was approximately constant at 0.314 for all the compounds. The Debye temperature, calculated from the RT polycrystalline moduli, decreased from 359 to 344 K as x increased from 0 to 0.5. The results were used to calculate the elastic interaction energy of an interstitial hydrogen atom with the strain fields of all the other interstitial hydrogen. This energy was in turn used to calculate the critical temperature below which phase separation occurs in LaM x Ni 5-x H y compounds (M=Sn or Al). It was found that the critical temperature decreases with increasing x, confirming in a more general way a conclusion drawn for a specific case from earlier thermodynamic measurements. It is suggested that the lowering of the critical temperature plays a role in limiting the width of the plateaus in pressure-composition isotherms for the two-phase regions of these compounds. This suggestion implies a relation between the elastic properties and the maximum hydrogen capacity

  20. String moduli inflation. An overview

    Energy Technology Data Exchange (ETDEWEB)

    Cicoli, Michele [Deutsches Elektronen-Synchrotron (DESY), Hamburg (Germany); Quevedo, Fernando [Cambridge Univ. (United Kingdom). DAMTP/CMS; Abdus Salam International Centre for Theoretical Physics, Trieste (Italy)

    2011-06-15

    We present an overview of inflationary models derived from string theory focusing mostly on closed string moduli as inflatons. After a detailed discussion of the {eta}-problem and different approaches to address it, we describe possible ways to obtain a de Sitter vacuum with all closed string moduli stabilised. We then look for inflationary directions and present some of the most promising scenarios where the inflatons are either the real or the imaginary part of Kaehler moduli. We pay particular attention on extracting potential observable implications, showing how most of the scenarios predict negligible gravitational waves and could therefore be ruled out by the Planck satellite. We conclude by briefly mentioning some open challenges in string cosmology beyond deriving just inflation. (orig.)

  1. String moduli inflation. An overview

    International Nuclear Information System (INIS)

    Cicoli, Michele; Quevedo, Fernando

    2011-06-01

    We present an overview of inflationary models derived from string theory focusing mostly on closed string moduli as inflatons. After a detailed discussion of the η-problem and different approaches to address it, we describe possible ways to obtain a de Sitter vacuum with all closed string moduli stabilised. We then look for inflationary directions and present some of the most promising scenarios where the inflatons are either the real or the imaginary part of Kaehler moduli. We pay particular attention on extracting potential observable implications, showing how most of the scenarios predict negligible gravitational waves and could therefore be ruled out by the Planck satellite. We conclude by briefly mentioning some open challenges in string cosmology beyond deriving just inflation. (orig.)

  2. Numerical Calculation of Effect of Elastic Deformation on Aerodynamic Characteristics of a Rocket

    Directory of Open Access Journals (Sweden)

    Laith K. Abbas

    2014-01-01

    Full Text Available The application and workflow of Computational Fluid Dynamics (CFD/Computational Structure Dynamics (CSD on solving the static aeroelastic problem of a slender rocket are introduced. To predict static aeroelastic behavior accurately, two-way coupling and inertia relief methods are used to calculate the static deformations and aerodynamic characteristics of the deformed rocket. The aerodynamic coefficients of rigid rocket are computed firstly and compared with the experimental data, which verified the accuracy of CFD output. The results of the analysis for elastic rocket in the nonspinning and spinning states are compared with the rigid ones. The results highlight that the rocket deformation aspects are decided by the normal force distribution along the rocket length. Rocket deformation becomes larger with increasing the flight angle of attack. Drag and lift force coefficients decrease and pitching moment coefficients increase due to rocket deformations, center of pressure location forwards, and stability of the rockets decreases. Accordingly, the flight trajectory may be affected by the change of these aerodynamic coefficients and stability.

  3. Singular moduli and Arakelov intersection

    International Nuclear Information System (INIS)

    Weng Lin.

    1994-05-01

    The value of the modular function j(τ) at imaginary quadratic arguments τ in the upper half plane is usually called singular moduli. In this paper, we use Arakelov intersection to give the prime factorizations of a certain combination of singular moduli, coming from the Hecke correspondence. Such a result may be considered as the degenerate one of Gross and Zagier on Heegner points and derivatives of L-series in their paper [GZ1], and is parallel to the result in [GZ2]. (author). 2 refs

  4. Elastic properties of some transition metal arsenides

    Science.gov (United States)

    Nayak, Vikas; Verma, U. P.; Bisht, P. S.

    2018-05-01

    The elastic properties of transition metal arsenides (TMAs) have been studied by employing Wien2K package based on density functional theory in the zinc blende (ZB) and rock salt (RS) phase treating valance electron scalar relativistically. Further, we have also treated them non-relativistically to find out the relativistic effect. We have calculated the elastic properties by computing the volume conservative stress tensor for small strains, using the method developed by Charpin. The obtained results are discussed in paper. From the obtained results, it is clear that the values of C11 > C12 and C44 for all the compounds. The values of shear moduli of these compounds are also calculated. The internal parameter for these compounds shows that ZB structures of these compounds have high resistance against bond order. We find that the estimated elastic constants are in good agreement with the available data.

  5. Measurement of elastic modules of structural ceramic by acoustic resonance

    International Nuclear Information System (INIS)

    Ahn, Bong Young; Lee Seong Suck; Kim, Young Gil

    1993-01-01

    Elastic moduli of structural ceramic materials, Al 2 O 3 , SiC, Si 3 N 4 , were measured by acoustic resonance method. Young's modulus, shear modulus, and Poisson's ratio were calculated from the torsional and flexural resonant frequencies, densities, and the dimensions of the specimen. The results by acoustic resonance method were compared with the results by ultrasonic method and the differences were less than 4%.

  6. Elastic constants of a Laves phase compound: C15 NbCr{sub 2}

    Energy Technology Data Exchange (ETDEWEB)

    Ormeci, A. [Koc Univ., Istanbul (Turkey)]|[Los Alamos National Lab., NM (United States); Chu, F.; Wills, J.M.; Chen, S.P.; Albers, R.C.; Thoma, D.J.; Mitchell, T.E. [Los Alamos National Lab., NM (United States)

    1997-04-01

    The single-crystal elastic constants of C15 NbCr{sub 2} have been computed by using a first-principles, self-consistent, full-potential total energy method. From these single-crystal elastic constants the isotropic elastic moduli are calculated using the Voigt and Reuss averages. The calculated values are in fair agreement with the experimental values. The implications of the results are discussed with regards to Poisson`s ratio and the direction dependence of Young`s modulus.

  7. On the Moduli of Convexity

    Czech Academy of Sciences Publication Activity Database

    Guirao, A. J.; Hájek, Petr Pavel

    2007-01-01

    Roč. 135, č. 10 (2007), s. 3233-3240 ISSN 0002-9939 R&D Projects: GA AV ČR IAA100190502 Institutional research plan: CEZ:AV0Z10190503 Keywords : Banach spaces * moduli of convexity * uniformly rotund norms Subject RIV: BA - General Mathematics Impact factor: 0.520, year: 2007

  8. Some practical results for calculating the elastic properties of cubic polycrystals with texture measured by neutron diffraction

    International Nuclear Information System (INIS)

    Lychagina, T.A.; Brokmeier, H.G.

    1999-01-01

    Complete text of publication follows. It is well known that the elastic properties of a polycrystalline material are strongly dependent on the one hand the single crystal elastic properties and on the other hand its crystallographic texture [1]. The calculation of these properties needs the quantitative texture given by the orientation distribution function (ODF), which represents texture mathematically. By a given set of experimental pole figures a number of programs are available to calculate the ODF, which might have an influence on the resulting properties. The aim of this work is to compare elastic properties of cubic materials calculated with ODFs obtained by different methods. The calculations were carried out on a cold rolled Al-6%Mg alloy sheet and on a copper rod. Experimental pole figures were obtained by means of neutron diffraction [2] and used for ODF calculation. The conformity between different results will be discussed. (author) [1] H.J. Bunge 1982, Texture Analysis in Material Science - Mathematical Methods, Butterworth, London.; [2] H.G. Brokmeier, U. Zink, R. Schnieber, B. Witassek, Material Science Forum (1998), 273-275, 277

  9. Atomistic calculation of size effects on elastic coefficients in nanometre-sized tungsten layers and wires

    International Nuclear Information System (INIS)

    Villain, P.; Beauchamp, P.; Badawi, K.F.; Goudeau, P.; Renault, P.-O.

    2004-01-01

    Equilibrium state and elastic coefficients of nanometre-sized single crystal tungsten layers and wires are investigated by atomistic simulations. The variations of the equilibrium distances as a function of the layer thickness or wire cross-section are mainly due to elastic effects of surface tension forces. A strong decrease of the Young's modulus is observed when the transverse dimensions are reduced below 2-3 nm

  10. Strain localization and elastic-plastic coupling during deformation of porous sandstone

    Energy Technology Data Exchange (ETDEWEB)

    Dewers, Thomas A. [Sandia National Laboratories (SNL-NM), Albuquerque, NM (United States). Geomechanics Dept.; Issen, Kathleen A. [Clarkson Univ., Potsdam, NY (United States). Mechanical and Aeronautical Engineering; Holcomb, David J. [Sandia National Laboratories (SNL-NM), Albuquerque, NM (United States). Geomechanics Dept.; Olsson, William A. [Sandia National Laboratories (SNL-NM), Albuquerque, NM (United States). Geomechanics Dept.; Ingraham, Mathew D. [Sandia National Laboratories (SNL-NM), Albuquerque, NM (United States). Geomechanics Dept.

    2017-09-12

    Results of axisymmetric compression tests on weak, porous Castlegate Sandstone (Cretaceous, Utah, USA), covering a range of dilational and compactional behaviors, are examined for localization behavior. Assuming isotropy, bulk and shear moduli evolve as increasing functions of mean stress and Mises equivalent shear stress respectively, and as decreasing functions of work-conjugate plastic strains. Acoustic emissions events located during testing show onset of localization and permit calculation of observed shear and low-angle compaction localization zones, or bands, as localization commences. Total strain measured experimentally partitions into: A) elastic strain with constant moduli, B) elastic strain due to stress dependence of moduli, C) elastic strain due to moduli degradation with increasing plastic strain, and D) plastic strain. The third term is the elastic-plastic coupling strain, and though often ignored, contributes significantly to pre-failure total strain for brittle and transitional tests. Constitutive parameters and localization predictions derived from experiments are compared to theoretical predictions. In the brittle regime, predictions of band angles (angle between band normal and maximum compression) demonstrate good agreement with observed shear band angles. Compaction localization was observed in the transitional regime in between shear localization and spatially pervasive compaction, over a small range of mean stresses. In contrast with predictions however, detailed acoustic emissions analyses in this regime show low angle, compaction-dominated but shear-enhanced, localization.

  11. Moduli fields as quintessence and the chameleon

    International Nuclear Information System (INIS)

    Brax, Philippe; Martin, Jerome

    2007-01-01

    We consider models where moduli fields are not stabilized and play the role of quintessence. In order to evade gravitational tests, we investigate the possibility that moduli behave as chameleon fields. We find that, for realistic moduli superpotentials, the chameleon effect is not strong enough, implying that moduli quintessence models are gravitationally ruled out. More generally, we state a no-go theorem for quintessence in supergravity whereby models either behave like a pure cosmological constant or violate gravitational tests

  12. First-principles calculations for the elastic properties of Ni-base model superalloys: Ni/Ni3Al multilayers

    International Nuclear Information System (INIS)

    Yun-Jiang, Wang; Chong-Yu, Wang

    2009-01-01

    A model system consisting of Ni[001](100)/Ni 3 Al[001](100) multi-layers are studied using the density functional theory in order to explore the elastic properties of single crystal Ni-based superalloys. Simulation results are consistent with the experimental observation that rafted Ni-base superalloys virtually possess a cubic symmetry. The convergence of the elastic properties with respect to the thickness of the multilayers are tested by a series of multilayers from 2γ'+2γ to 10γ'+10γ atomic layers. The elastic properties are found to vary little with the increase of the multilayer's thickness. A Ni/Ni 3 Al multilayer with 10γ'+10γ atomic layers (3.54 nm) can be used to simulate the mechanical properties of Ni-base model superalloys. Our calculated elastic constants, bulk modulus, orientation-dependent shear modulus and Young's modulus, as well as the Zener anisotropy factor are all compatible with the measured results of Ni-base model superalloys R1 and the advanced commercial superalloys TMS-26, CMSX-4 at a low temperature. The mechanical properties as a function of the γ' phase volume fraction are calculated by varying the proportion of the γ and γ' phase in the multilayers. Besides, the mechanical properties of two-phase Ni/Ni 3 Al multilayer can be well predicted by the Voigt–Reuss–Hill rule of mixtures. (classical areas of phenomenology)

  13. First-principles calculations of the electronic, vibrational, and elastic properties of the magnetic laminate Mn2GaC

    International Nuclear Information System (INIS)

    Thore, A.; Dahlqvist, M.; Alling, B.; Rosén, J.

    2014-01-01

    In this paper, we report the by first-principles predicted properties of the recently discovered magnetic MAX phase Mn 2 GaC. The electronic band structure and vibrational dispersion relation, as well as the electronic and vibrational density of states, have been calculated. The band structure close to the Fermi level indicates anisotropy with respect to electrical conductivity, while the distribution of the electronic and vibrational states for both Mn and Ga depend on the chosen relative orientation of the Mn spins across the Ga sheets in the Mn–Ga–Mn trilayers. In addition, the elastic properties have been calculated, and from the five elastic constants, the Voigt bulk modulus is determined to be 157 GPa, the Voigt shear modulus 93 GPa, and the Young's modulus 233 GPa. Furthermore, Mn 2 GaC is found relatively elastically isotropic, with a compression anisotropy factor of 0.97, and shear anisotropy factors of 0.9 and 1, respectively. The Poisson's ratio is 0.25. Evaluated elastic properties are compared to theoretical and experimental results for M 2 AC phases where M = Ti, V, Cr, Zr, Nb, Ta, and A = Al, S, Ge, In, Sn.

  14. Effect of PbO on the elastic behavior of ZnO–P2O5 glass systems

    Directory of Open Access Journals (Sweden)

    H.A.A. Sidek

    Full Text Available A series of ternary phosphate glasses in the form of 40(P2O5–(60 − xZnO–xPbO and 50(P2O5–(50 − xZnO–xPbO where x = 0–60 mol%, have been successfully prepared by conventional melt quenching technique. Both longitudinal and shear ultrasonic velocities were measured in different compositions of PbO using the MBS8000 ultrasonic data acquisition system at 10 MHz frequency and at room temperature. The ultrasonic velocity data, the density and the calculated elastic moduli are found to be composition dependent and discussed in terms of PbO modifiers. The correlation of elastic moduli with the atomic packing density of these glasses was discussed. To predict the compositional dependence of elastic moduli of this glass system, the interpretation of the variation in the experimental elastic behavior observed has been studied based on various of the bond compression and the Makishima–Mackenzie models. Keywords: Elastic moduli, Glasses, Zinc phosphate, Bond compression, Makishima–Mackenzie models

  15. Structural, elastic, electronic and dynamical properties of OsB and ReB: Density functional calculations

    Science.gov (United States)

    Li, Yanling; Zeng, Zhi; Lin, Haiqing

    2010-06-01

    The structural, elastic, electronic and dynamical properties of ReB and OsB are investigated by first-principles calculations based on density functional theory. It turns out that ReB and OsB are metallic ultra-incompressible solids with small elastic anisotropy and high hardness. The change of c/ a ratio in OsB indicates that there is a structural phase transition at about 31 GPa. Phonon spectra calculations show that both OsB and ReB are stable dynamically and there are abnormal phonon dispersions along special directions in Brillouin zone. OsB and ReB do not show superconductivity due to very weak electron-phonon interactions in them.

  16. First-Principle Calculations for Elastic and Thermodynamic Properties of Diamond

    International Nuclear Information System (INIS)

    Fu Zhijian; Chen Xiangrong; Gou Qingquan; Ji Guangfu

    2009-01-01

    The elastic constants and thermodynamic properties of diamond are investigated by using the CRYSTAL03 program. The lattice parameters, the bulk modulus, the heat capacity, the Grueneisen parameter, and the Debye temperature are obtained. The results are in good agreement with the available experimental and theoretical data. Moreover, the relationship between V/V 0 and pressure, the elastic constants under high pressure are successfully obtained. Especially, the elastic constants of diamond under high pressure are firstly obtained theoretically. At the same time, the variations of the thermal expansion α with pressure P and temperature Tare obtained systematically in the ranges of 0-870 GPa and 0-1600 K. (condensed matter: electronic structure, electrical, magnetic, and optical properties)

  17. Moduli backreaction on inflationary attractors

    International Nuclear Information System (INIS)

    Roest, Diederik; Werkman, Pelle

    2016-07-01

    We investigate the interplay between moduli dynamics and inflation, focusing on the KKLT- scenario and cosmological α-attractors. General couplings between these sectors can induce a significant backreaction and potentially destroy the inflationary regime; however, we demonstrate that this generically does not happen for α-attractors. Depending on the details of the superpotential, the volume modulus can either be stable during the entire inflationary trajectory, or become tachyonic at some point and act as a waterfall field, resulting in a sudden end of inflation. In the latter case there is a universal supersymmetric minimum where the scalars end up, preventing the decompactification scenario. The gravitino mass is independent from the inflationary scale with no fine-tuning of the parameters. The observational predictions conform to the universal value of attractors, fully compatible with the Planck data, with possibly a capped number of e-folds due to the interplay with moduli.

  18. Moduli Backreaction on Inflationary Attractors

    CERN Document Server

    Roest, Diederik; Werkman, Pelle

    2016-01-01

    We investigate the interplay between moduli dynamics and inflation, focusing on the KKLT-scenario and cosmological $\\alpha$-attractors. General couplings between these sectors can induce a significant backreaction and potentially destroy the inflationary regime; however, we demonstrate that this generically does not happen for $\\alpha$-attractors. Depending on the details of the superpotential, the volume modulus can either be stable during the entire inflationary trajectory, or become tachyonic at some point and act as a waterfall field, resulting in a sudden end of inflation. In the latter case there is a universal supersymmetric minimum where the scalars end up, preventing the decompactification scenario. The observational predictions conform to the universal value of attractors, fully compatible with the Planck data, with possibly a capped number of e-folds due to the interplay with moduli.

  19. Measurement of the elastic tensor of SmScO3 and NdScO3 using resonant ultrasound spectroscopy with ab initio calculations

    Directory of Open Access Journals (Sweden)

    K. A. Pestka II

    2011-09-01

    Full Text Available The complete elastic tensors of SmScO3 and NdScO3 were measured using resonant ultrasound spectroscopy (RUS in combination with ab-initio calculations. Measurement of the elastic tensor of these recently synthesized single crystal RE scandates is essential for understanding dynamic lattice applications including phonon confinement, strain induced thin film growth and superlattice construction. On average, the experimental elastic constants differed by less than 5% of the theoretical values, further validating the accuracy of modern ab-initio calculations as a means of estimating the initial elastic constants used in RUS measurements.

  20. An Laudau-Lifschitz theory based algorithm on calculating post-buckling configuration of a rod buckling in elastic media

    Science.gov (United States)

    Huang, Shicheng; Tan, Likun; Hu, Nan; Grover, Hannah; Chu, Kevin; Chen, Zi

    This reserach introduces a new numerical approach of calculating the post-buckling configuration of a thin rod embedded in elastic media. The theoretical base is the governing ODEs describing the balance of forces and moments, the length conservation, and the physics of bending and twisting by Laudau and Lifschitz. The numerical methods applied in the calculation are continuation method and Newton's method of iteration in combination with spectrum method. To the authors' knowledge, it is the first trial of directly applying the L-L theory to numerically studying the phenomenon of rod buckling in elastic medium. This method accounts for nonlinearity of geometry, thus is capable of calculating large deformation. The stability of this method is another advantage achieved by expressing the governing equations in a set of first-order derivative form. The wave length, amplitude, and decay effect all agree with the experiment without any further assumptions. This program can be applied to different occasions with varying stiffness of the elastic medai and rigidity of the rod.

  1. The effect of the new nucleon-nucleus elastic scattering data in LAHET trademark Version 2.8 on neutron displacement cross section calculations

    International Nuclear Information System (INIS)

    Pitcher, E.J.; Ferguson, P.D.; Russell, G.J.; Prael, R.E.; Madland, D.G.; Court, J.D.; Daemen, L.L.; Wechsler, M.S.

    1997-01-01

    The latest release of the medium-energy Monte Carlo transport code LAHET includes a new nucleon-nucleus elastic scattering treatment based on a global medium-energy phenomenological optical-model potential. Implementation of this new model in LAHET allows nuclear elastic scattering for neutrons with energies greater than 15 MeV and for protons with energies greater than 50 MeV. Previous investigations on the impact of the new elastic scattering data revealed that the addition of the proton elastic scattering channel can lead to a significant increase in the calculated damage energy under certain conditions. The authors report here results on the impact of the new elastic scattering data on calculated displacement cross sections in various elements for neutrons with energies in the range 16 to 3,160 MeV. Calculated displacement cross sections at 20 MeV in low-mass materials are in better agreement with SPECTER-calculated cross sections

  2. Contact area calculation between elastic solids bounded by mound rough surfaces

    NARCIS (Netherlands)

    Palasantzas, G

    In this work, we investigate the influence of mound roughness on the contact area between elastic bodies. The mound roughness is described by the r.m.s. roughness amplitude w, the average mound separation Lambda, and the system correlation length xi. In general, the real contact area has a complex

  3. Elastic deformations of floaters for offshore wind turbines: Dynamic modelling and sectional load calculations

    DEFF Research Database (Denmark)

    Borg, Michael; Bredmose, Henrik; Hansen, Anders Melchior

    2017-01-01

    To achieve economically and technically viable floating support structures for large 10MW+ wind turbines, structural flexibility may increase to the extent that becomes relevant to incorporate along with the corresponding physical effects within aero-hydro-servo-elastic simulation tools. Previous...

  4. ELSEPA—Dirac partial-wave calculation of elastic scattering of electrons and positrons by atoms, positive ions and molecules

    Science.gov (United States)

    Salvat, Francesc; Jablonski, Aleksander; Powell, Cedric J.

    2005-01-01

    The FORTRAN 77 code system ELSEPA for the calculation of elastic scattering of electrons and positrons by atoms, positive ions and molecules is presented. These codes perform relativistic (Dirac) partial-wave calculations for scattering by a local central interaction potential V(r). For atoms and ions, the static-field approximation is adopted, with the potential set equal to the electrostatic interaction energy between the projectile and the target, plus an approximate local exchange interaction when the projectile is an electron. For projectiles with kinetic energies up to 10 keV, the potential may optionally include a semiempirical correlation-polarization potential to describe the effect of the target charge polarizability. Also, for projectiles with energies less than 1 MeV, an imaginary absorptive potential can be introduced to account for the depletion of the projectile wave function caused by open inelastic channels. Molecular cross sections are calculated by means of a single-scattering independent-atom approximation in which the electron density of a bound atom is approximated by that of the free neutral atom. Elastic scattering by individual atoms in solids is described by means of a muffin-tin model potential. Partial-wave calculations are feasible on modest personal computers for energies up to about 5 MeV. The ELSEPA code also implements approximate factorization methods that allow the fast calculation of elastic cross sections for much higher energies. The interaction model adopted in the calculations is defined by the user by combining the different options offered by the code. The nuclear charge distribution can be selected among four analytical models (point nucleus, uniformly charged sphere, Fermi's distribution and Helm's uniform-uniform distribution). The atomic electron density is handled in numerical form. The distribution package includes data files with electronic densities of neutral atoms of the elements hydrogen to lawrencium ( Z=1

  5. Structural, electronic, elastic and thermal properties of Li{sub 2}AgSb. First-principles calculations

    Energy Technology Data Exchange (ETDEWEB)

    Li, Ji-Hong [Sichuan Univ., Chengdu (China). Inst. of Atomic and Molecular Physics; Longdong Univ., Qingyang (China). College of Physics and Electronic Engineering; Zhu, Xu-Hui [Sichuan Univ., Chengdu (China). Inst. of Atomic and Molecular Physics; Cheng, Yan [Sichuan Univ., Chengdu (China). Inst. of Atomic and Molecular Physics; Sichuan Univ., Chengdu (China). Key Laboratory of High Energy Density Physics and Technology of Ministry of Education; Ji, Guang-Fu [Chinese Academy of Engineering Physics, Mianyang (China). National Key Laboratory of Shock Wave and Detonation Physics

    2015-07-01

    Based on the first-principles density functional theory calculations combined with the quasi-harmonic Debye model, the pressure dependencies of the structural, elastic, electronic and thermal properties of Li{sub 2}AgSb were systematically investigated. The calculated lattice parameters and unit cell volume of Li{sub 2}AgSb at the ground state were in good agreement with the available experimental data. The obtained elastic constants, the bulk modulus and the shear modulus revealed that Li{sub 2}AgSb is mechanically stable and behaves in a ductile manner under the applied pressure. The elasticity-relevant properties, the Young's modulus and the Poisson's ratio showed that pressure can enhance the stiffness of Li{sub 2}AgSb and that Li{sub 2}AgSb is mechanically stable up to 20 GPa. The characteristics of the band structure and the partial density of states of Li{sub 2}AgSb were analysed, showing that Li{sub 2}AgSb is a semiconductor with a direct band gap of 217 meV at 0 GPa and that the increasing pressure can make the band structure of Li{sub 2}AgSb become an indirect one. Studies have shown that, unlike temperature, pressure has little effect on the heat capacity and the thermal expansion coefficient of Li{sub 2}AgSb.

  6. Constrained Nudged Elastic Band calculation of the Peierls barrier with atomic relaxations

    Czech Academy of Sciences Publication Activity Database

    Gröger, Roman; Vitek, V.

    2012-01-01

    Roč. 20, č. 3 (2012), 035019 ISSN 0965-0393 R&D Projects: GA ČR GAP204/10/0255; GA MŠk(CZ) ED1.1.00/02.0068 Institutional research plan: CEZ:AV0Z20410507 Keywords : dislocation * Peierls barrier * Nudged Elastic Band Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 1.932, year: 2012

  7. First-principle calculations of the electronic, optical and elastic properties of ZnSiP2 semiconductor

    International Nuclear Information System (INIS)

    Kumar, V.; Tripathy, S.K.

    2014-01-01

    Highlights: • Optical properties of ZnSiP 2 studied under different pressure for stable structure. • Birefringence has been calculated at different wavelengths. • Lattice constants, ħω p , bulk modulus and its derivative have been calculated. • C ij , Y, υ and Zener anisotropic factor have also been estimated. • Our calculated values are relative more close to the experimental values. -- Abstract: The plane wave pseudo-potential method within density functional theory (DFT) has been used to investigate the structural, electronic, optical and elastic properties of ZnSiP 2 chalcopyrite semiconductor. The lattice constants are calculated from the optimized unit cells and compare with the experimental value. The band structure, total density of states (TDOS) and partial density of states (PDOS) have been discussed. The energy gap has been calculated along the Γ direction found to be 1.383 eV, which shows that ZnSiP 2 is pseudo-direct in nature. We have also analyzed the frequency dependent dielectric constant ε(ω) and calculated the birefringence (Δn). The optical properties under three different hydrostatic pressures of 0 GPa, 10 GPa and 20 GPa have been described for the first time in the energy range 0–20 eV. The values of bulk modulus (B), pressure derivative of bulk modulus (B ∗ ), elastic constants (C ij ), Young’s modulus (Y), anisotropic factor (A) and Poisson’s ratio (ν) have been calculated. The calculated values of all above parameters are compared with the available experimental values and the values reported by different workers. A fairly good agreement has been found between them

  8. The effect of boron concentration on the structure and elastic properties of Ru-Ir alloys: first-principles calculations

    Science.gov (United States)

    Li, Xiaolong; Zhou, Zhaobo; Hu, Riming; Zhou, Xiaolong; Yu, Jie; Liu, Manmen

    2018-04-01

    The Phase stability, electronic structure, elastic properties and hardness of Ru-Ir alloys with different B concentration were investigated by first principles calculations. The calculated formation enthaplies and cohesive energies show that these compounds are all thermodynamically stable. Information on electronic structure indicates that they possess metallic characteristic and Ru-Ir-B alloys were composed of the Ru-B and Ir-B covalent bond. The elastic properties were calculated, which included bulk modulus, shear modulus, Young’s modulus, Poisson’s ratio and hardness. The calculated results reveal that the plastic of Ru-Ir-B alloys increase with the increase of the content of B atoms, but the hardness of Ru-Ir-B alloys have no substantial progress with the increase of the content of B atoms. However, it is interesting that the hardness of the Ru-Ir-B compound was improved obviously as the B content was higher than 18 atoms because of a phase structure transition.

  9. Moduli destabilization via gravitational collapse

    Energy Technology Data Exchange (ETDEWEB)

    Hwang, Dong-il [Sogang Univ., Seoul (Korea, Republic of). Center for Quantum Spacetime; Pedro, Francisco G. [Deutsches Elektronen-Synchrotron DESY, Hamburg (Germany). Theory Group; Yeom, Dong-han [Sogang Univ., Seoul (Korea, Republic of). Center for Quantum Spacetime; Kyoto Univ. (Japan). Yukawa Inst. for Theoretical Physics

    2013-06-15

    We examine the interplay between gravitational collapse and moduli stability in the context of black hole formation. We perform numerical simulations of the collapse using the double null formalism and show that the very dense regions one expects to find in the process of black hole formation are able to destabilize the volume modulus. We establish that the effects of the destabilization will be visible to an observer at infinity, opening up a window to a region in spacetime where standard model's couplings and masses can differ significantly from their background values.

  10. Elastic properties of uniaxial-fiber reinforced composites - General features

    Science.gov (United States)

    Datta, Subhendu; Ledbetter, Hassel; Lei, Ming

    The salient features of the elastic properties of uniaxial-fiber-reinforced composites are examined by considering the complete set of elastic constants of composites comprising isotropic uniaxial fibers in an isotropic matrix. Such materials exhibit transverse-isotropic symmetry and five independent elastic constants in Voigt notation: C(11), C(33), C(44), C(66), and C(13). These C(ij) constants are calculated over the entire fiber-volume-fraction range 0.0-1.0, using a scattered-plane-wave ensemple-average model. Some practical elastic constants such as the principal Young moduli and the principal Poisson ratios are considered, and the behavior of these constants is discussed. Also presented are the results for the four principal sound velocities used to study uniaxial-fiber-reinforced composites: v(11), v(33), v(12), and v(13).

  11. The moduli problem for plane branches

    CERN Document Server

    Zariski, Oscar

    2006-01-01

    Moduli problems in algebraic geometry date back to Riemann's famous count of the 3g-3 parameters needed to determine a curve of genus g. In this book, Zariski studies the moduli space of curves of the same equisingularity class. After setting up and reviewing the basic material, Zariski devotes one chapter to the topology of the moduli space, including an explicit determination of the rare cases when the space is compact. Chapter V looks at specific examples where the dimension of the generic component can be determined through rather concrete methods. Zariski's last chapter concerns the application of deformation theory to the moduli problem, including the determination of the dimension of the generic component for a particular family of curves. An appendix by Bernard Teissier reconsiders the moduli problem from the point of view of deformation theory. He gives new proofs of some of Zariski's results, as well as a natural construction of a compactification of the moduli space.

  12. Calculations of single crystal elastic constants for yttria partially stabilised zirconia from powder diffraction data

    Science.gov (United States)

    Lunt, A. J. G.; Xie, M. Y.; Baimpas, N.; Zhang, S. Y.; Kabra, S.; Kelleher, J.; Neo, T. K.; Korsunsky, A. M.

    2014-08-01

    Yttria Stabilised Zirconia (YSZ) is a tough, phase-transforming ceramic that finds use in a wide range of commercial applications from dental prostheses to thermal barrier coatings. Micromechanical modelling of phase transformation can deliver reliable predictions in terms of the influence of temperature and stress. However, models must rely on the accurate knowledge of single crystal elastic stiffness constants. Some techniques for elastic stiffness determination are well-established. The most popular of these involve exploiting frequency shifts and phase velocities of acoustic waves. However, the application of these techniques to YSZ can be problematic due to the micro-twinning observed in larger crystals. Here, we propose an alternative approach based on selective elastic strain sampling (e.g., by diffraction) of grain ensembles sharing certain orientation, and the prediction of the same quantities by polycrystalline modelling, for example, the Reuss or Voigt average. The inverse problem arises consisting of adjusting the single crystal stiffness matrix to match the polycrystal predictions to observations. In the present model-matching study, we sought to determine the single crystal stiffness matrix of tetragonal YSZ using the results of time-of-flight neutron diffraction obtained from an in situ compression experiment and Finite Element modelling of the deformation of polycrystalline tetragonal YSZ. The best match between the model predictions and observations was obtained for the optimized stiffness values of C11 = 451, C33 = 302, C44 = 39, C66 = 82, C12 = 240, and C13 = 50 (units: GPa). Considering the significant amount of scatter in the published literature data, our result appears reasonably consistent.

  13. Calculations of single crystal elastic constants for yttria partially stabilised zirconia from powder diffraction data

    Energy Technology Data Exchange (ETDEWEB)

    Lunt, A. J. G., E-mail: alexander.lunt@eng.ox.ac.uk; Xie, M. Y.; Baimpas, N.; Korsunsky, A. M. [Department of Engineering Science, University of Oxford, Parks Road, Oxford OX1 3PJ (United Kingdom); Zhang, S. Y.; Kabra, S.; Kelleher, J. [ISIS Neutron and Muon Source, Rutherford Appleton Laboratory, Harwell, Oxford OX11 0QX (United Kingdom); Neo, T. K. [Specialist Dental Group, Mount Elizabeth Orchard, 3 Mount Elizabeth, #08-03/08-08/08-10, Singapore 228510 (Singapore)

    2014-08-07

    Yttria Stabilised Zirconia (YSZ) is a tough, phase-transforming ceramic that finds use in a wide range of commercial applications from dental prostheses to thermal barrier coatings. Micromechanical modelling of phase transformation can deliver reliable predictions in terms of the influence of temperature and stress. However, models must rely on the accurate knowledge of single crystal elastic stiffness constants. Some techniques for elastic stiffness determination are well-established. The most popular of these involve exploiting frequency shifts and phase velocities of acoustic waves. However, the application of these techniques to YSZ can be problematic due to the micro-twinning observed in larger crystals. Here, we propose an alternative approach based on selective elastic strain sampling (e.g., by diffraction) of grain ensembles sharing certain orientation, and the prediction of the same quantities by polycrystalline modelling, for example, the Reuss or Voigt average. The inverse problem arises consisting of adjusting the single crystal stiffness matrix to match the polycrystal predictions to observations. In the present model-matching study, we sought to determine the single crystal stiffness matrix of tetragonal YSZ using the results of time-of-flight neutron diffraction obtained from an in situ compression experiment and Finite Element modelling of the deformation of polycrystalline tetragonal YSZ. The best match between the model predictions and observations was obtained for the optimized stiffness values of C11 = 451, C33 = 302, C44 = 39, C66 = 82, C12 = 240, and C13 = 50 (units: GPa). Considering the significant amount of scatter in the published literature data, our result appears reasonably consistent.

  14. Improved adiabatic calculation of muonic-hydrogen-atom cross sections. I. Isotopic exchange and elastic scattering in asymmetric collisions

    International Nuclear Information System (INIS)

    Cohen, J.S.; Struensee, M.C.

    1991-01-01

    The improved adiabatic representation is used in calculations of elastic and isotopic-exchange cross sections for asymmetric collisions of pμ, dμ, and tμ with bare p, d, and t nuclei and with H, D, and T atoms. This formulation dissociates properly, correcting a well-known deficiency of the standard adiabatic method for muonic-atom collisions, and includes some effects at zeroth order that are normally considered nonadiabatic. The electronic screening is calculated directly and precisely within the improved adiabatic description; it is found to be about 30% smaller in magnitude than the previously used value at large internuclear distances and to deviate considerably from the asymptotic form at small distances. The reactance matrices, needed for calculations of molecular-target effects, are given in tables

  15. A Metric for Heterotic Moduli

    Science.gov (United States)

    Candelas, Philip; de la Ossa, Xenia; McOrist, Jock

    2017-12-01

    Heterotic vacua of string theory are realised, at large radius, by a compact threefold with vanishing first Chern class together with a choice of stable holomorphic vector bundle. These form a wide class of potentially realistic four-dimensional vacua of string theory. Despite all their phenomenological promise, there is little understanding of the metric on the moduli space of these. What is sought is the analogue of special geometry for these vacua. The metric on the moduli space is important in phenomenology as it normalises D-terms and Yukawa couplings. It is also of interest in mathematics, since it generalises the metric, first found by Kobayashi, on the space of gauge field connections, to a more general context. Here we construct this metric, correct to first order in {α^{\\backprime}}, in two ways: first by postulating a metric that is invariant under background gauge transformations of the gauge field, and also by dimensionally reducing heterotic supergravity. These methods agree and the resulting metric is Kähler, as is required by supersymmetry. Checking the metric is Kähler is intricate and the anomaly cancellation equation for the H field plays an essential role. The Kähler potential nevertheless takes a remarkably simple form: it is the Kähler potential of special geometry with the Kähler form replaced by the {α^{\\backprime}}-corrected hermitian form.

  16. Elasticity and wave velocity in fcc iron (austenite) at elevated temperatures - Experimental verification of ab-initio calculations.

    Science.gov (United States)

    Hutchinson, Bevis; Malmström, Mikael; Lönnqvist, Johan; Bate, Pete; Ehteshami, Hossein; Korzhavyi, Pavel A

    2018-07-01

    High temperature crystal elasticity constants for face centred cubic austenite are important for interpreting the ultrasonic properties of iron and steels but cannot be determined by normal single crystal methods. Values of these constants have recently been calculated using an ab-initio approach and the present work was carried out to test their applicability using laser-ultrasonic measurements. Steel samples having a known texture were examined at temperatures between 800 °C and 1100 °C to measure the velocity of longitudinal P-waves which were found to be in good agreement with modelled values. Copyright © 2018 Elsevier B.V. All rights reserved.

  17. Moduli stabilization in non-geometric backgrounds

    International Nuclear Information System (INIS)

    Becker, Katrin; Becker, Melanie; Vafa, Cumrun; Walcher, Johannes

    2007-01-01

    Type II orientifolds based on Landau-Ginzburg models are used to describe moduli stabilization for flux compactifications of type II theories from the world-sheet CFT point of view. We show that for certain types of type IIB orientifolds which have no Kaehler moduli and are therefore intrinsically non-geometric, all moduli can be explicitly stabilized in terms of fluxes. The resulting four-dimensional theories can describe Minkowski as well as anti-de Sitter vacua. This construction provides the first string vacuum with all moduli frozen and leading to a 4D Minkowski background

  18. The moduli and gravitino (non)-problems in models with strongly stabilized moduli

    International Nuclear Information System (INIS)

    Evans, Jason L.; Olive, Keith A.; Garcia, Marcos A.G.

    2014-01-01

    In gravity mediated models and in particular in models with strongly stabilized moduli, there is a natural hierarchy between gaugino masses, the gravitino mass and moduli masses: m 1/2 << m 3/2 << m φ . Given this hierarchy, we show that 1) moduli problems associated with excess entropy production from moduli decay and 2) problems associated with moduli/gravitino decays to neutralinos are non-existent. Placed in an inflationary context, we show that the amplitude of moduli oscillations are severely limited by strong stabilization. Moduli oscillations may then never come to dominate the energy density of the Universe. As a consequence, moduli decay to gravitinos and their subsequent decay to neutralinos need not overpopulate the cold dark matter density

  19. Local elastic properties of nano-confined fluids: A density functional study

    Energy Technology Data Exchange (ETDEWEB)

    Sun, Zongli, E-mail: zongli_sun@163.com [Science and Technology College, North China Electric Power University, Baoding 071051 (China); Kang, Yanshuang [College of Science, Agriculture University of Hebei, Baoding 071001 (China)

    2014-05-01

    The understanding of mechanical properties of confined fluids is essential for modeling and manipulating of nano-scaled systems. Unlike the uniform phase, the confined fluids usually display different features in structure and related properties. Due to the presence of the confining geometry, the density profile and many physical and chemical properties may be position-dependent. The aim of our research is to derive an expression for the local elastic property by using the classical elastic theory. Both the bulk and shear moduli are expressed as functional of density of particle. The theoretical result derived is applied to the Lennard-Jones fluids confined in nano-cavity. Comparison of our numerical result and the simulation result is made and qualitative agreement is observed. Further, influence of bulk density, temperature and external potential on moduli is calculated and the physical mechanism is analyzed. Relationship between contact modulus and the interfacial tension is also calculated. Their opposite trend with temperature is observed.

  20. Local elastic properties of nano-confined fluids: A density functional study

    International Nuclear Information System (INIS)

    Sun, Zongli; Kang, Yanshuang

    2014-01-01

    The understanding of mechanical properties of confined fluids is essential for modeling and manipulating of nano-scaled systems. Unlike the uniform phase, the confined fluids usually display different features in structure and related properties. Due to the presence of the confining geometry, the density profile and many physical and chemical properties may be position-dependent. The aim of our research is to derive an expression for the local elastic property by using the classical elastic theory. Both the bulk and shear moduli are expressed as functional of density of particle. The theoretical result derived is applied to the Lennard-Jones fluids confined in nano-cavity. Comparison of our numerical result and the simulation result is made and qualitative agreement is observed. Further, influence of bulk density, temperature and external potential on moduli is calculated and the physical mechanism is analyzed. Relationship between contact modulus and the interfacial tension is also calculated. Their opposite trend with temperature is observed.

  1. Using Ultrasonic Lamb Waves To Measure Moduli Of Composites

    Science.gov (United States)

    Kautz, Harold E.

    1995-01-01

    Measurements of broad-band ultrasonic Lamb waves in plate specimens of ceramic-matrix/fiber and metal-matrix/fiber composite materials used to determine moduli of elasticity of materials. In one class of potential applications of concept, Lamb-wave responses of specimens measured and analyzed at various stages of thermal and/or mechanical processing to determine effects of processing, without having to dissect specimens. In another class, structural components having shapes supporting propagation of Lamb waves monitored ultrasonically to identify signs of deterioration and impending failure.

  2. A fluctuation method to calculate the third order elastic constants in crystalline solids

    Energy Technology Data Exchange (ETDEWEB)

    Chen, Zimu [School of Materials Science and Engineering, Beihang University, Beijing 100191 (China); Qu, Jianmin, E-mail: j-qu@northwestern.edu [Department of Civil and Environmental Engineering, Department of Mechanical Engineering, Northwestern University, Evanston, Illinois 60208 (United States)

    2015-05-28

    This paper derives exact expressions of the isothermal third order elastic constants (TOE) in crystalline solids in terms of the kinetic and potential energies of the system. These expressions reveal that the TOE constants consist of a Born component and a relaxation component. The Born component is simply the third derivative of the system's potential energy with respect to the deformation, while the relaxation component is related to the non-uniform rearrangements of the atoms when the system is subject to a macroscopic deformation. Further, based on the general expressions derived here, a direct (fluctuation) method of computing the isothermal TOE constants is developed. Numerical examples of using this fluctuation method are given to compute the TOE constants of single crystal iron.

  3. Elastic properties and electronic structure of WS{sub 2} under pressure from first-principles calculations

    Energy Technology Data Exchange (ETDEWEB)

    Li, Li [Sichuan Univ., Chengdu (China). Inst. of Atomic and Molecular Physics; Civil Aviation Flight Univ. of China, Guanghan (China). Dept. of Physics; Zeng, Zhao-Yi [Chongqing Normal Univ., Chongqing (China). College of Physics and Electronic Engineering; Liang, Ting; Tang, Mei; Cheng, Yan [Sichuan Univ., Chengdu (China). Inst. of Atomic and Molecular Physics

    2017-07-01

    The influence of pressure on the elastic and mechanical properties of the hexagonal transition-metal dichalcogenide WS{sub 2} is investigated using the first-principles calculations. With the increase in pressure, the lattice parameters and the volume of WS{sub 2} decrease, which is exactly in agreement with the available experimental data and other calculated results. The elastic constants C{sub ij}, bulk modulus B, shear modulus G, Young's modulus E, and Poisson's ratio σ of WS{sub 2} also increase with pressure. At last, for the first time, the band gaps of energy, the partial density of states, and the total density of states under three different pressures are obtained and analysed. It is found that the band gap of WS{sub 2} decreases from 0.843 to 0 eV when the external pressure varies from 0 to 20 GPa, which implies that WS{sub 2} may transform from semiconductors to semimetal phase at a pressure about 20 GPa.

  4. Site preference and elastic properties of ternary alloying additions in B2 YAg alloys by first-principles calculations

    Energy Technology Data Exchange (ETDEWEB)

    Wu Yurong, E-mail: winwyr@126.com [College of Electromechanical Engineering, Hunan University of Science and Technology, Xiantang 411201 (China); Hu Wangyu [Department of Applied Physics, Hunan University, Changsha 410082 (China); Xu Longshan [Department of Materials Science and Engineering, Xiamen University of Technology, Xiamen 361024 (China)

    2012-09-15

    First-principles calculations were preformed to study the site preference behavior and elastic properties of 3d (Ti-Cu) transition-metal elements in B2 ductility YAg alloy. In YAg, Ti is found to occupy the Y sublattice whereas V, Cr, Co, Fe, Ni and Cu tend to substitute for Ag sublattice. Due to the addition of 3d transition metals, the lattice parameters of YAg is decreased in the order: Vcalculated elastic constants show that Cr, Fe, Co and Cu can improve the ductility of YAg alloy, and Fe is the most effective element to improve the ductility of YAg, while Ti, Ni and V alloying elements can reduce the ductility of YAg alloy, especially, V transforms ductile into brittle for YAg alloy. In addition, both V and Ni alloying elements can increase the hardness of YAg alloy, and Y{sub 8}Ag{sub 7}V is harder than Y{sub 8}Ag{sub 7}Ni.

  5. First-principles calculation on the thermodynamic and elastic properties of precipitations in Al-Cu alloys

    Science.gov (United States)

    Sun, Dongqiang; Wang, Yongxin; Zhang, Xinyi; Zhang, Minyu; Niu, Yanfei

    2016-12-01

    First-principles calculations based on density functional theory was used to investigate the structural, thermodynamic and elastic properties of precipitations, θ″, θ‧ and θ, in Al-Cu alloys. The values of lattice constants accord with experimental results well. The structural stability of θ is the best, followed by θ‧ and θ″. In addition, due to the highest bulk modulus, shear modulus and Young's modulus, θ possesses the best reinforcement effect in precipitation hardening process considered only from mechanical properties of perfect crystal. According to the values of B/G, Poisson's ratio and C11-C12, θ‧ has the worst ductility, while θ″ has the best ductility, the ductility of θ is in the middle. The ideal tensile strength of θ″, θ‧ and θ calculated along [100] and [001] directions are 20.87 GPa, 23.11 GPa and 24.70 GPa respectively. The analysis of electronic structure suggests that three precipitations all exhibit metallic character, and number of bonding electrons and bonding strength are the nature of different thermodynamic and elastic properties for θ″, θ‧ and θ.

  6. First-principles calculations of structural, elastic, and electronic properties of trigonal ZnSnO{sub 3} under pressure

    Energy Technology Data Exchange (ETDEWEB)

    Liu, Qi-Jun, E-mail: qijunliu@home.swjtu.edu.cn [School of Physical Science and Technology, Southwest Jiaotong University, Key Laboratory of Advanced Technologies of Materials, Ministry of Education of China, Chengdu 610031 (China); Bond and Band Engineering Group, Sichuan Provincial Key Laboratory (for Universities) of High Pressure Science and Technology, Southwest Jiaotong University, Chengdu 610031 (China); Qin, Han; Jiao, Zhen; Liu, Fu-Sheng [School of Physical Science and Technology, Southwest Jiaotong University, Key Laboratory of Advanced Technologies of Materials, Ministry of Education of China, Chengdu 610031 (China); Bond and Band Engineering Group, Sichuan Provincial Key Laboratory (for Universities) of High Pressure Science and Technology, Southwest Jiaotong University, Chengdu 610031 (China); Liu, Zheng-Tang [State Key Laboratory of Solidification Processing, Northwestern Polytechnical University, Xi’an 710072 (China)

    2016-09-01

    First-principles calculations of the structural, elastic, mechanical and electronic properties of ilmenite-type ZnSnO{sub 3} under pressure have been investigated in the present paper. Our calculated lattice constants at zero pressure are in agreement with the published theoretical and experimental data. The elastic constants at zero and high pressure have been obtained, which are used to discuss the mechanical stability of ilmenite-type ZnSnO{sub 3}. The mechanical properties such as bulk modulus, shear modulus, Young’s modulus and Poisson’s ratio under pressure have been studied. Electronic properties show that ilmenite-type ZnSnO{sub 3} is shown to be a direct bandgap of 1.063 (GGA-PW91)/3.977 (PBE0) eV. The bandgap increases with the increasing pressure. Moreover, the partial density of states has been analyzed to explain the increased bandgap. - Highlights: • Physical properties of ilmenite-type ZnSnO{sub 3} under pressure have been investigated. • Ilmenite-type ZnSnO{sub 3} behaves in a ductile manner. • Ilmenite-type ZnSnO{sub 3} is a direct bandgap compound with 3.977 eV. • Bandgap of Ilmenite-type ZnSnO{sub 3} increases with the increasing pressure.

  7. Strong moduli stabilization and phenomenology

    CERN Document Server

    Dudas, Emilian; Mambrini, Yann; Mustafayev, Azar; Olive, Keith A

    2013-01-01

    We describe the resulting phenomenology of string theory/supergravity models with strong moduli stabilization. The KL model with F-term uplifting, is one such example. Models of this type predict universal scalar masses equal to the gravitino mass. In contrast, A-terms receive highly suppressed gravity mediated contributions. Under certain conditions, the same conclusion is valid for gaugino masses, which like A-terms, are then determined by anomalies. In such models, we are forced to relatively large gravitino masses (30-1000 TeV). We compute the low energy spectrum as a function of m_{3/2}. We see that the Higgs masses naturally takes values between 125-130 GeV. The lower limit is obtained from the requirement of chargino masses greater than 104 GeV, while the upper limit is determined by the relic density of dark matter (wino-like).

  8. Determination of static moduli in fractured rocks by T-matrix model

    Czech Academy of Sciences Publication Activity Database

    Chalupa, F.; Vilhelm, J.; Petružálek, Matěj; Bukovská, Z.

    2017-01-01

    Roč. 22, č. 1 (2017), s. 22-31 ISSN 1335-1788 Institutional support: RVO:67985831 Keywords : fractured rocks * dynamic and static moduli * T-matrix model * elastic wave velocity * well logging Subject RIV: DB - Geology ; Mineralogy OBOR OECD: Geology Impact factor: 0.769, year: 2016 http://actamont.tuke.sk/pdf/2017/n1/3chalupa.pdf

  9. Moduli space of Chern-Simons gravity

    International Nuclear Information System (INIS)

    Soda, Jiro; Yamanaka, Yuki

    1990-09-01

    Conformally invariant (2+1)-dimensional gravity, Chern-Shimons gravity, is studied. Its solution space, moduli space, is investigated using the linearization method. The dimension of moduli space is determined as 18g - 18 for g > 1,6 for g = 1 and 0 for g = 0. We discuss the geometrical meaning of our investigation. (author)

  10. Estimation of macroscopic elastic characteristics for hierarchical anisotropic solids based on probabilistic approach

    Science.gov (United States)

    Smolina, Irina Yu.

    2015-10-01

    Mechanical properties of a cable are of great importance in design and strength calculation of flexible cables. The problem of determination of elastic properties and rigidity characteristics of a cable modeled by anisotropic helical elastic rod is considered. These characteristics are calculated indirectly by means of the parameters received from statistical processing of experimental data. These parameters are considered as random quantities. With taking into account probable nature of these parameters the formulas for estimation of the macroscopic elastic moduli of a cable are obtained. The calculating expressions for macroscopic flexural rigidity, shear rigidity and torsion rigidity using the macroscopic elastic characteristics obtained before are presented. Statistical estimations of the rigidity characteristics of some cable grades are adduced. A comparison with those characteristics received on the basis of deterministic approach is given.

  11. String moduli stabilization at the conifold

    Energy Technology Data Exchange (ETDEWEB)

    Blumenhagen, Ralph; Herschmann, Daniela; Wolf, Florian [Max-Planck-Institut für Physik (Werner-Heisenberg-Institut),Föhringer Ring 6, 80805 München (Germany)

    2016-08-18

    We study moduli stabilization for type IIB orientifolds compactified on Calabi-Yau threefolds in the region close to conifold singularities in the complex structure moduli space. The form of the periods implies new phenomena like exponential mass hierarchies even in the regime of negligible warping. Integrating out the heavy conic complex structure modulus leads to an effective flux induced potential for the axio-dilaton and the remaining complex structure moduli containing exponentially suppressed terms that imitate non-perturbative effects. It is shown that this scenario can be naturally combined with the large volume scenario so that all moduli are dynamically stabilized in the dilute flux regime. As an application of this moduli stabilization scheme, a string inspired model of aligned inflation is designed that features a parametrically controlled hierarchy of mass scales.

  12. Gravitational Particle Production and the Moduli Problem

    CERN Document Server

    Felder, G; Linde, Andrei D; Felder, Gary; Kofman, Lev; Linde, Andrei

    2000-01-01

    A theory of gravitational production of light scalar particles during and after inflation is investigated. We show that in the most interesting cases where long-wavelength fluctuations of light scalar fields can be generated during inflation, these fluctuations rather than quantum fluctuations produced after inflation give the dominant contribution to particle production. In such cases a simple analytical theory of particle production can be developed. Application of our results to the theory of quantum creation of moduli fields demonstrates that if the moduli mass is smaller than the Hubble constant then these fields are copiously produced during inflation. This gives rise to the cosmological moduli problem even if there is no homogeneous component of the classical moduli field in the universe. To avoid this version of the moduli problem it is necessary for the Hubble constant H during the last stages of inflation and/or the reheating temperature T_R after inflation to be extremely small.

  13. An efficient Matlab script to calculate heterogeneous anisotropically elastic wave propagation in three dimensions

    Science.gov (United States)

    Boyd, O.S.

    2006-01-01

    We have created a second-order finite-difference solution to the anisotropic elastic wave equation in three dimensions and implemented the solution as an efficient Matlab script. This program allows the user to generate synthetic seismograms for three-dimensional anisotropic earth structure. The code was written for teleseismic wave propagation in the 1-0.1 Hz frequency range but is of general utility and can be used at all scales of space and time. This program was created to help distinguish among various types of lithospheric structure given the uneven distribution of sources and receivers commonly utilized in passive source seismology. Several successful implementations have resulted in a better appreciation for subduction zone structure, the fate of a transform fault with depth, lithospheric delamination, and the effects of wavefield focusing and defocusing on attenuation. Companion scripts are provided which help the user prepare input to the finite-difference solution. Boundary conditions including specification of the initial wavefield, absorption and two types of reflection are available. ?? 2005 Elsevier Ltd. All rights reserved.

  14. Constrained nudged elastic band calculation of the Peierls barrier with atomic relaxations

    International Nuclear Information System (INIS)

    Gröger, R; Vitek, V

    2012-01-01

    We demonstrate that the straightforward application of the nudged elastic band (NEB) method does not determine the correct Peierls barrier of 1/2〈1 1 1〉 screw dislocations in bcc metals. Although this method guarantees that the states (images) of the system are distributed uniformly along the minimum energy path, it does not imply that the dislocation positions are distributed uniformly along this path. In fact, clustering of dislocation positions near potential minima occurs which leads to an overestimate of both the slope of the Peierls barrier and the Peierls stress. We propose a modification in which the NEB method is applied only to a small number of degrees of freedom that determine the position of the dislocation, while all other coordinates of atoms are relaxed by molecular statics as in any atomistic study. This modified NEB method with relaxations gives the Peierls barrier that increases smoothly with the dislocation position and the corresponding Peierls stress agrees well with that evaluated by the direct application of stress in the atomistic modeling of the dislocation glide. (paper)

  15. Measurements of Young's and shear moduli of rail steel at elevated temperatures.

    Science.gov (United States)

    Bao, Yuanye; Zhang, Haifeng; Ahmadi, Mehdi; Karim, Md Afzalul; Felix Wu, H

    2014-03-01

    The design and modelling of the buckling effect of Continuous Welded Rail (CWR) requires accurate material constants, especially at elevated temperatures. However, such material constants have rarely been found in literature. In this article, the Young's moduli and shear moduli of rail steel at elevated temperatures are determined by a new sonic resonance method developed in our group. A network analyser is used to excite a sample hanged inside a furnace through a simple tweeter type speaker. The vibration signal is picked up by a Polytec OFV-5000 Laser Vibrometer and then transferred back to the network analyser. Resonance frequencies in both the flexural and torsional modes are measured, and the Young's moduli and shear moduli are determined through the measured resonant frequencies. To validate the measured elastic constants, the measurements have been repeated by using the classic sonic resonance method. The comparisons of obtained moduli from the two methods show an excellent consistency of the results. In addition, the material elastic constants measured are validated by an ultrasound test based on a pulse-echo method and compared with previous published results at room temperature. The measured material data provides an invaluable reference for the design of CWR to avoid detrimental buckling failure. Copyright © 2013 Elsevier B.V. All rights reserved.

  16. Hybrid Numerical-Analytical Scheme for Calculating Elastic Wave Diffraction in Locally Inhomogeneous Waveguides

    Science.gov (United States)

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

    2018-01-01

    Numerical simulation of traveling wave excitation, propagation, and diffraction in structures with local inhomogeneities (obstacles) is computationally expensive due to the need for mesh-based approximation of extended domains with the rigorous account for the radiation conditions at infinity. Therefore, hybrid numerical-analytic approaches are being developed based on the conjugation of a numerical solution in a local vicinity of the obstacle and/or source with an explicit analytic representation in the remaining semi-infinite external domain. However, in standard finite-element software, such a coupling with the external field, moreover, in the case of multimode expansion, is generally not provided. This work proposes a hybrid computational scheme that allows realization of such a conjugation using a standard software. The latter is used to construct a set of numerical solutions used as the basis for the sought solution in the local internal domain. The unknown expansion coefficients on this basis and on normal modes in the semi-infinite external domain are then determined from the conditions of displacement and stress continuity at the boundary between the two domains. We describe the implementation of this approach in the scalar and vector cases. To evaluate the reliability of the results and the efficiency of the algorithm, we compare it with a semianalytic solution to the problem of traveling wave diffraction by a horizontal obstacle, as well as with a finite-element solution obtained for a limited domain artificially restricted using absorbing boundaries. As an example, we consider the incidence of a fundamental antisymmetric Lamb wave onto surface and partially submerged elastic obstacles. It is noted that the proposed hybrid scheme can also be used to determine the eigenfrequencies and eigenforms of resonance scattering, as well as the characteristics of traveling waves in embedded waveguides.

  17. Evaluating variability with atomistic simulations: the effect of potential and calculation methodology on the modeling of lattice and elastic constants

    Science.gov (United States)

    Hale, Lucas M.; Trautt, Zachary T.; Becker, Chandler A.

    2018-07-01

    Atomistic simulations using classical interatomic potentials are powerful investigative tools linking atomic structures to dynamic properties and behaviors. It is well known that different interatomic potentials produce different results, thus making it necessary to characterize potentials based on how they predict basic properties. Doing so makes it possible to compare existing interatomic models in order to select those best suited for specific use cases, and to identify any limitations of the models that may lead to unrealistic responses. While the methods for obtaining many of these properties are often thought of as simple calculations, there are many underlying aspects that can lead to variability in the reported property values. For instance, multiple methods may exist for computing the same property and values may be sensitive to certain simulation parameters. Here, we introduce a new high-throughput computational framework that encodes various simulation methodologies as Python calculation scripts. Three distinct methods for evaluating the lattice and elastic constants of bulk crystal structures are implemented and used to evaluate the properties across 120 interatomic potentials, 18 crystal prototypes, and all possible combinations of unique lattice site and elemental model pairings. Analysis of the results reveals which potentials and crystal prototypes are sensitive to the calculation methods and parameters, and it assists with the verification of potentials, methods, and molecular dynamics software. The results, calculation scripts, and computational infrastructure are self-contained and openly available to support researchers in performing meaningful simulations.

  18. Research on differences and correlation between tensile, compression and flexural moduli of cement stabilized macadam

    Directory of Open Access Journals (Sweden)

    Yi Yang

    2017-07-01

    Full Text Available In order to reveal the differences and conversion relations between the tensile, compressive and flexural moduli of cement stabilized macadam, in this paper, we develop a new test method for measuring three moduli simultaneously. By using the materials testing system, we test three moduli of the cement stabilized macadam under different loading rates, propose a flexural modulus calculation formula which considers the shearing effect, reveal the change rules of the tensile, compression and flexural moduli with the loading rate and establish the conversion relationships between the three moduli. The results indicate that: three moduli become larger with the increase of the loading rate, showing a power function pattern; with the shear effect considered, the flexural modulus is increased by 47% approximately over that in the current test method; the tensile and compression moduli of cement stabilized macadam are significantly different. Therefore, if only the compression modulus is used as the structural design parameter of asphalt pavement, there will be a great deviation in the analysis of the load response. In order to achieve scientific design and calculation, the appropriate design parameters should be chosen based on the actual stress state at each point inside the pavement structure.

  19. Coupled-channel optical calculation of electron-atom scattering: elastic scattering from sodium at 20 to 150 eV

    International Nuclear Information System (INIS)

    Bray, Igor; Konovalov, D.A.; McCarthy, I.E.

    1991-04-01

    A coupled-channel optical method for electron-atom scattering is applied to elastic electron-sodium scattering at energies of 20, 22.1, 54.4, 100, and 150 eV. It is demonstrated that the effect of all the inelastic channels on elastic scattering may be well reproduced by the 'ab initio' calculated complex non-local polarization potential. Whilst the experiments generally agree at small angles and therefore agree on the total elastic cross section, there is considerable discrepancy at intermediate and backward angles. 9 refs., 2 tabs., 1 fig

  20. Calculations of intersection cross-slip activation energies in fcc metals using nudged elastic band method

    International Nuclear Information System (INIS)

    Rao, S.I.; Dimiduk, D.M.; Parthasarathy, T.A.; El-Awady, J.; Woodward, C.; Uchic, M.D.

    2011-01-01

    The nudged elastic band (NEB) method is used to evaluate activation energies for dislocation intersection cross-slip in face-centered cubic (fcc) nickel and copper, to extend our prior work which used an approximate method. In this work we also extend the study by including Hirth locks (HL) in addition to Lomer-Cottrell locks and glide locks (GL). Using atomistic (molecular statics) simulations with embedded atom potentials we evaluated the activation barrier for a dislocation to transform from fully residing on the glide plane to fully residing on the cross-slip plane when intersecting a 120 o forest dislocation in both Ni and Cu. The initial separation between the screw and the intersecting dislocation on the (1 1 1) glide plane is varied to find a minimum in the activation energy. The NEB method gives energies that are ∼10% lower than those reported in our prior work. It is estimated that the activation energies for cross-slip from the fully glide plane state to the partially cross-slipped state at the 120 o intersection forming GL in Ni and Cu are ∼0.47 and ∼0.65 eV, respectively, and from the fully cross-slip plane state to the partially cross-slipped state forming LC are ∼0.68 and ∼0.67 eV. The activation energies for cross-slip from the fully glide plane state to the partially cross-slipped state at the 120 o intersection forming HL in Ni and Cu are estimated to be ∼0.09 and ∼0.31 eV, respectively. These values are a factor of 3-20 lower than the activation energy for bulk cross-slip in Ni and, a factor of 2-6 lower than the activation energy for cross-slip in Cu estimated by Friedel-Escaig analysis. These results suggest that cross-slip should nucleate preferentially at selected screw dislocation intersections in fcc materials and the activation energies for such mechanisms are also a function of stacking fault energy.

  1. First-principles calculations of the elastic constants of the cubic, orthorhombic and hexagonal phases of BaF{sub 2}

    Energy Technology Data Exchange (ETDEWEB)

    Nyawere, P.W.O., E-mail: otienop98@yahoo.ca [Computational Materials Science Group, Department of Physics, University of Eldoret, P.O. Box 1125-30100 Eldoret (Kenya); Department of Computing, Kabarak University, P.O. - Private Bag - 20157 Kabarak (Kenya); The Abdus Salam International Centre for Theoretical Physics, Trieste (Italy); Makau, N.W., E-mail: wanimak@yahoo.com [Computational Materials Science Group, Department of Physics, University of Eldoret, P.O. Box 1125-30100 Eldoret (Kenya); Amolo, G.O., E-mail: georgeamolo862@gmail.com [Computational Materials Science Group, Department of Physics, University of Eldoret, P.O. Box 1125-30100 Eldoret (Kenya)

    2014-02-01

    All the elastic constants of cubic, orthorhombic and hexagonal phases of BaF{sub 2} have been calculated using first principles methods. We have employed density-functional theory within generalized gradient approximation (GGA) using a plane-wave pseudopotentials method and a plane-wave basis set. The calculated elastic constant values for a cubic phase compare well with recent theoretical and experimental calculations. The bulk modulus derived from the elastic constant calculations of orthorhombic phase of BaF{sub 2} is 94.5 GPa and those of hexagonal phase is 161 GPa. These values are in good agreement with experimental data available. Stability of these phases of BaF{sub 2} is also estimated in different crystallographic directions.

  2. Numerical Calculation of Effect of Elastic Deformation on Aerodynamic Characteristics of a Rocket

    OpenAIRE

    Abbas, Laith K.; Chen, Dongyang; Rui, Xiaoting

    2014-01-01

    The application and workflow of Computational Fluid Dynamics (CFD)/Computational Structure Dynamics (CSD) on solving the static aeroelastic problem of a slender rocket are introduced. To predict static aeroelastic behavior accurately, two-way coupling and inertia relief methods are used to calculate the static deformations and aerodynamic characteristics of the deformed rocket. The aerodynamic coefficients of rigid rocket are computed firstly and compared with the experimental data, which ver...

  3. Calculation of Ground Shock Motion Produced by Airburst Explosions Using Cagniard Elastic Propagation Theory.

    Science.gov (United States)

    1980-09-01

    de.tona1Uted1 over a mass;ive Kayenta sandstone formation. Thes- e.ventsl- provi ic data for checking, the calculations for motion in :1 s;trong1...53 ~ l Z Kayenta ;andst-ne depOsit similar to thit, of CUNSf 1. The thickness of the soil was v,ried from 0 to 6 ft. Measurements of vertical and

  4. The K + - Nucleus Microscopic Optical Potential and Calculations of the Corresponding Differential Elastic and Total Reaction Cross Sections

    International Nuclear Information System (INIS)

    Zemlyanaya, E.V.; Lukyanov, K.V.; Lukyanov, V.K.; Hanna, K.M.

    2009-01-01

    The microscopic optical potential (OP) is calculated for the K+-meson scattering on the 12 C and 40 Ca nuclei at intermediate energies. This potential has no free parameters and based on the known kaon-nucleon amplitude and nuclear density distribution functions. Then, the Klein-Gordon equation is written in the form of the relativistic Schrodinger equation where terms quadratic in the potential was estimated can be neglected. The latter equations adapted to the considered task and solved numerically. The effect of revitalization is shown to play a significant role. A good agreement with the experimental data on differential elastic cross sections is obtained. However, to explain the data on total reaction cross sections the additional surface term of OP was introduced to account for influence of the peripheral nuclear reaction channels

  5. Shear stiffness in nanolaminar Ti3SiC2 challenges ab initio calculations

    International Nuclear Information System (INIS)

    Kisi, E H; Zhang, J F; Kirstein, O; Riley, D P; Styles, M J; Paradowska, A M

    2010-01-01

    Nanolaminates such as the M n+1 AX n (MAX) phases are a material class with ab initio derived elasticity tensors published for over 250 compounds. We have for the first time experimentally determined the full elasticity tensor of the archetype MAX phase, Ti 3 SiC 2 , using polycrystalline samples and in situ neutron diffraction. The experimental elastic constants show extreme shear stiffness, with c 44 more than five times greater than expected for an isotropic material. Such shear stiffness is quite rare in hexagonal materials and strongly contradicts the predictions of all published MAX phase elastic constants derived from ab initio calculations. It is concluded that second order properties such as elastic moduli derived from ab initio calculations require careful experimental verification. The diffraction technique used currently provides the only method of verification for the elasticity tensor for the majority of new materials where single crystals are not available. (fast track communication)

  6. Evaluating elastic modulus and strength of hard coatings by relative method

    International Nuclear Information System (INIS)

    Bao, Y.W.; Zhou, Y.C.; Bu, X.X.; Qiu, Y.

    2007-01-01

    A simple approach named relative method is developed for determining the elastic modulus and strength of hard coatings. Analytical relationship among the moduli of the film, the substrate, and the film/substrate system was derived based on bending model, from which the elastic modulus of the coating can be determined uniquely via the measured moduli of the samples before and after coating. Furthermore, the relationship between the strength of the films and the bending strength of the coated sample is derived, thus both the modulus and the strength of coating can be evaluated via traditional tests on coated samples. Mathematic expressions of those calculations were derived, respectively for rectangular beam samples with three types of coating configurations: single face coating, sandwich coating and around coating. Experimental results using various brittle coatings demonstrated the validity and convenience of this method

  7. Evaluating elastic modulus and strength of hard coatings by relative method

    Energy Technology Data Exchange (ETDEWEB)

    Bao, Y.W. [Shenyang National Laboratory for Materials Science, Institute of Metal Research, Chinese Academy of Sciences, 72 Wenhua Road, Shenyang 110016 (China); China Building Materials Academy, Beijing 100024 (China)], E-mail: ywbao@imr.ac.cn; Zhou, Y.C. [Shenyang National Laboratory for Materials Science, Institute of Metal Research, Chinese Academy of Sciences, 72 Wenhua Road, Shenyang 110016 (China); Bu, X.X. [China Building Materials Academy, Beijing 100024 (China); Qiu, Y. [China Building Materials Academy, Beijing 100024 (China)

    2007-06-15

    A simple approach named relative method is developed for determining the elastic modulus and strength of hard coatings. Analytical relationship among the moduli of the film, the substrate, and the film/substrate system was derived based on bending model, from which the elastic modulus of the coating can be determined uniquely via the measured moduli of the samples before and after coating. Furthermore, the relationship between the strength of the films and the bending strength of the coated sample is derived, thus both the modulus and the strength of coating can be evaluated via traditional tests on coated samples. Mathematic expressions of those calculations were derived, respectively for rectangular beam samples with three types of coating configurations: single face coating, sandwich coating and around coating. Experimental results using various brittle coatings demonstrated the validity and convenience of this method.

  8. Moduli of double EPW-sextics

    CERN Document Server

    O'Grady, Kieran G

    2016-01-01

    The author studies the GIT quotient of the symplectic grassmannian parametrizing lagrangian subspaces of \\bigwedge^3{\\mathbb C}^6 modulo the natural action of \\mathrm{SL}_6, call it \\mathfrak{M}. This is a compactification of the moduli space of smooth double EPW-sextics and hence birational to the moduli space of HK 4-folds of Type K3^{[2]} polarized by a divisor of square 2 for the Beauville-Bogomolov quadratic form. The author will determine the stable points. His work bears a strong analogy with the work of Voisin, Laza and Looijenga on moduli and periods of cubic 4-folds.

  9. Sensitivity of relativistic impulse approximation proton-nucleus elastic scattering calculations on relativistic mean-field parameterizations

    International Nuclear Information System (INIS)

    Hojsik, M.; Gmuca, S.

    1998-01-01

    Relativistic microscopic calculations are presented for proton elastic scattering from 40 Ca at 500 MeV. The underlying target densities are calculated within the framework of the relativistic mean-field theory with several parameter sets commonly in use. The self consistency of the scalar and vector densities (and thus to relativistic mean-field parameters) is investigated. Recently, the relativistic impulse approximation (RIA) has been widely and repeatedly used for the calculations of proton-nucleus scattering at intermediate energies. These calculations have exhibited significant improvements over the nonrelativistic approaches. The relativistic impulse approximation calculations. in particular, provide a dramatically better description of the spin observables, namely the analyzing power, A y , and the spin-rotation function, Q, at least for energies higher than 400 MeV. In the relativistic impulse approximation, the Dirac optical potential is obtained by folding of the local Lorentz-invariant amplitudes with the corresponding nuclear densities. For the spin zero targets the scalar and vector terms give the dominant contributions. Thus the scalar and vector nuclear densities (both, proton and neutron ones) play the dominant role in the relativistic impulse approximation. While the proton vector densities can be obtained by unfolding from the empirically known charge densities, all other densities used rely to a great extent on theoretical models. The various recipes are used to construct the neutron vector densities and the scalar densities for both, neutrons and protons. In this paper we will study the sensitivity of the relativistic impulse approximation results on the various sets of relativistic mean-field parameters currently in use

  10. Elastic stiffnesses of an Nb-Ti/Cu-composite superconductive wire

    Science.gov (United States)

    Kim, Sudook; Ledbetter, Hassel; Ogi, Hirotsugu

    2000-09-01

    Elastic-stiffness coefficients were determined on a 1.4-mm-diameter wire consisting of superconducting Nb-Ti fibers in a copper matrix, with a polyvinyl-resin coating. The matrix contained 324 Nb-Ti fibers. An electromagnetic-acoustic-resonance method was used to obtain five independent elastic-stiffness coefficients assuming transverse-isotropic symmetry. From these we calculated Young moduli, bulk modulus, and principal Poisson ratios. As a check, we used a mechanical-impulse-excitation method to directly measure the Young modulus in the fiber direction. The three-phase composite wire showed a 10% anisotropy in the Young modulus.

  11. Pressure dependence of elastic and dynamical properties of zinc-blende ZnS and ZnSe from first principle calculation

    Directory of Open Access Journals (Sweden)

    H.Y. Wang

    2012-03-01

    Full Text Available The density-functional theory (DFT and density-functional perturbation theory (DFPT are employed to study the pressure dependence of elastic and dynamical properties of zinc-blende ZnS and ZnSe. The calculated elastic constants and phonon spectra from 0 GPa to 15 GPa are compared with the available experimental data. Generally, our calculated values are overestimated with experimental data, but agree well with recent other theoretical values. The discrepancies with experimental data are due to the use of local density approximation (LDA and effect of temperature. In this work, in order to compare with experimental data, we calculated and discussed the pressure derivatives of elastic constants, the pressure dependence of dynamical effect charge, and mode Grüneisen parameter at Γ.

  12. K3 surfaces and their moduli

    CERN Document Server

    Farkas, Gavril; Geer, Gerard

    2016-01-01

    This book provides an overview of the latest developments concerning the moduli of K3 surfaces. It is aimed at algebraic geometers, but is also of interest to number theorists and theoretical physicists, and continues the tradition of related volumes like “The Moduli Space of Curves” and “Moduli of Abelian Varieties,” which originated from conferences on the islands Texel and Schiermonnikoog and which have become classics. K3 surfaces and their moduli form a central topic in algebraic geometry and arithmetic geometry, and have recently attracted a lot of attention from both mathematicians and theoretical physicists. Advances in this field often result from mixing sophisticated techniques from algebraic geometry, lattice theory, number theory, and dynamical systems. The topic has received significant impetus due to recent breakthroughs on the Tate conjecture, the study of stability conditions and derived categories, and links with mirror symmetry and string theory. At the same time, the theory of irred...

  13. Molecular dynamics simulations to calculate glass transition temperature and elastic constants of novel polyethers.

    Science.gov (United States)

    Sarangapani, Radhakrishnan; Reddy, Sreekantha T; Sikder, Arun K

    2015-04-01

    Molecular dynamics simulations studies are carried out on hydroxyl terminated polyethers that are useful in energetic polymeric binder applications. Energetic polymers derived from oxetanes with heterocyclic side chains with different energetic substituents are designed and simulated under the ensembles of constant particle number, pressure, temperature (NPT) and constant particle number, volume, temperature (NVT). Specific volume of different amorphous polymeric models is predicted using NPT-MD simulations as a function of temperature. Plots of specific volume versus temperature exhibited a characteristic change in slope when amorphous systems change from glassy to rubbery state. Several material properties such as Young's, shear, and bulk modulus, Poisson's ratio, etc. are predicted from equilibrated structures and established the structure-property relations among designed polymers. Energetic performance parameters of these polymers are calculated and results reveal that the performance of the designed polymers is comparable to the benchmark energetic polymers like polyNIMMO, polyAMMO and polyBAMO. Overall, it is worthy remark that this molecular simulations study on novel energetic polyethers provides a good guidance on mastering the design principles and allows us to design novel polymers of tailored properties. Copyright © 2015 Elsevier Inc. All rights reserved.

  14. Anisotropic kernel p(μ → μ') for transport calculations of elastically scattered neutrons

    International Nuclear Information System (INIS)

    Stevenson, B.

    1985-01-01

    Literature in the area of anisotropic neutron scattering is by no means lacking. Attention, however, is usually devoted to solution of some particular neutron transport problem and the model employed is at best approximate. The present approach to the problem in general is classically exact and may be of some particular value to individuals seeking exact numerical results in transport calculations. For attempts neutrons originally directed toward the unit vector Omega, it attempts the evaluation of p(theta'), defined such that p(theta') d theta' is that fraction of scattered neutrons that emerges in the vicinity of a cone i.e., having been scattered to between angles theta' and theta' + d theta' with the axis of preferred orientation i; Omega makes an angle theta with i. The relative simplicity of the final form of the solution for hydrogen, in spite of the complicated nature of the limits involved, is a trade-off that truly is not necessary. The exact general solution presented here in integral form, has exceedingly simple limits, i.e., 0 ≤ theta' ≤ π regardless of the material involved; but the form of the final solution is extraordinarily complicated

  15. Probing the moduli dependence of refined topological amplitudes

    Directory of Open Access Journals (Sweden)

    I. Antoniadis

    2015-12-01

    Full Text Available With the aim of providing a worldsheet description of the refined topological string, we continue the study of a particular class of higher derivative couplings Fg,n in the type II string effective action compactified on a Calabi–Yau threefold. We analyse first order differential equations in the anti-holomorphic moduli of the theory, which relate the Fg,n to other component couplings. From the point of view of the topological theory, these equations describe the contribution of non-physical states to twisted correlation functions and encode an obstruction for interpreting the Fg,n as the free energy of the refined topological string theory. We investigate possibilities of lifting this obstruction by formulating conditions on the moduli dependence under which the differential equations simplify and take the form of generalised holomorphic anomaly equations. We further test this approach against explicit calculations in the dual heterotic theory.

  16. Geometry and quantization of moduli spaces

    CERN Document Server

    Andersen, Jørgen; Riera, Ignasi

    2016-01-01

    This volume is based on four advanced courses held at the Centre de Recerca Matemàtica (CRM), Barcelona. It presents both background information and recent developments on selected topics that are experiencing extraordinary growth within the broad research area of geometry and quantization of moduli spaces. The lectures focus on the geometry of moduli spaces which are mostly associated to compact Riemann surfaces, and are presented from both classical and quantum perspectives.

  17. Internal strain estimation for quantification of human heel pad elastic modulus: A phantom study.

    Science.gov (United States)

    Holst, Karen; Liebgott, Hervé; Wilhjelm, Jens E; Nikolov, Svetoslav; Torp-Pedersen, Søren T; Delachartre, Philippe; Jensen, Jørgen A

    2013-02-01

    Shock absorption is the most important function of the human heel pad. However, changes in heel pad elasticity, as seen in e.g. long-distance runners, diabetes patients, and victims of Falanga torture are affecting this function, often in a painful manner. Assessment of heel pad elasticity is usually based on one or a few strain measurements obtained by an external load-deformation system. The aim of this study was to develop a technique for quantitative measurements of heel pad elastic modulus based on several internal strain measures from within the heel pad by use of ultrasound images. Nine heel phantoms were manufactured featuring a combination of three heel pad stiffnesses and three heel pad thicknesses to model the normal human variation. Each phantom was tested in an indentation system comprising a 7MHz linear array ultrasound transducer, working as the indentor, and a connected load cell. Load-compression data and ultrasound B-mode images were simultaneously acquired in 19 compression steps of 0.1mm each. The internal tissue displacement was for each step calculated by a phase-based cross-correlation technique and internal strain maps were derived from these displacement maps. Elastic moduli were found from the resulting stress-strain curves. The elastic moduli made it possible to distinguish eight of nine phantoms from each other according to the manufactured stiffness and showed very little dependence of the thickness. Mean elastic moduli for the three soft, the three medium, and the three hard phantoms were 89kPa, 153kPa, and 168kPa, respectively. The combination of ultrasound images and force measurements provided an effective way of assessing the elastic properties of the heel pad due to the internal strain estimation. Copyright © 2012 Elsevier B.V. All rights reserved.

  18. The structural, elastic, electronic and dynamical properties of chalcopyrite semiconductor BeGeAs{sub 2} from first-principles calculations

    Energy Technology Data Exchange (ETDEWEB)

    Ciftci, Yasemin Oe. [Gazi University Teknikokullar, Department of Physics, Faculty of Sciences, Ankara (Turkey); Evecen, Meryem; Aldirmaz, Emine [Amasya University, Department of Physics, Faculty of Arts and Sciences, Amasya (Turkey)

    2017-01-15

    First-principles calculations for the structural, elastic, electronic and vibrational properties of BeGeAs{sub 2} with chalcopyrite structure have been reported in the frame work of the density functional theory. The calculated ground state properties are in good agreement with the available data. By considering the electronic band structure and electronic density of states calculation, it is found that this compound is a semiconductor which confirmed the previous work. Single-crystal elastic constants and related properties such as Young's modulus, Poisson ratio, shear modulus and bulk modulus have been predicted using the stress-finite strain technique. It can be seen from the calculated elastic constants that this compound is mechanically stable in the chalcopyrite structure. Pressure dependences of elastic constants and band gap are also reported. Finally, the phonon dispersion curves and total and partial density of states were calculated and discussed. The calculated phonon frequencies BeGeAs{sub 2} are positive, indicating the dynamical stability of the studied compound. (orig.)

  19. Crystal structures, stability, electronic and elastic properties of 4d and 5d transition metal monoborides: First-principles calculations

    International Nuclear Information System (INIS)

    Wang, Y.; Chen, W.; Chen, X.; Liu, H.Y.; Ding, Z.H.; Ma, Y.M.; Wang, X.D.; Cao, Q.P.; Jiang, J.Z.

    2012-01-01

    Highlights: ► Changes from NaCl-, WC- to anti-NiAs-type structures are for 4d and 5d metal monoborides. ► Vickers hardnesses of monoborides are relatively low. ► B-vacancies cause the difference in lattice parameters for IrB and PtB. ► Nonstoichiometric IrB and PtB phases synthesized. - Abstract: The crystal structures, stability, electronic and elastic properties of 4d and 5d transition metal monoborides have been studied by first principles calculations. It is found that NaCl-type ZrB, NbB, MoB, HfB, TaB and WB, WC-type TcB, RuB, ReB, OsB and IrB, and anti-NiAs-type RhB and PdB are thermodynamically stable at zero pressure. They all are metallic. The Vickers hardnesses of these monoborides are relatively low as compared with monocarbides and mononitrides. It is clarified that the presence of B-vacancies is the origin for the difference of lattice parameters between theoretical and experimental results for WC-type IrB and anti-NiAs-type PtB while IrB and PtB with stoichiometry from calculations are revealed to be mechanically unstable and dynamically unstable, respectively.

  20. Crystal structures, stability, electronic and elastic properties of 4d and 5d transition metal monoborides: First-principles calculations

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Y.; Chen, W. [International Center for New-Structured Materials (ICNSM), Zhejiang University, and Laboratory of New-Structured Materials, State Key Laboratory of Silicon Materials, Department of Materials Science and Engineering, Zhejiang University, Hangzhou 310027 (China); Chen, X.; Liu, H.Y. [State Key Laboratory of Superhard Materials, Jilin University, Changchun 130012 (China); Ding, Z.H.; Ma, Y.M. [State Key Laboratory of Inorganic Synthesis and Preparative Chemistry, Jilin University, Changchun 130012 (China); Wang, X.D.; Cao, Q.P. [International Center for New-Structured Materials (ICNSM), Zhejiang University, and Laboratory of New-Structured Materials, State Key Laboratory of Silicon Materials, Department of Materials Science and Engineering, Zhejiang University, Hangzhou 310027 (China); Jiang, J.Z., E-mail: jiangjz@zju.edu.cn [International Center for New-Structured Materials (ICNSM), Zhejiang University, and Laboratory of New-Structured Materials, State Key Laboratory of Silicon Materials, Department of Materials Science and Engineering, Zhejiang University, Hangzhou 310027 (China)

    2012-10-15

    Highlights: Black-Right-Pointing-Pointer Changes from NaCl-, WC- to anti-NiAs-type structures are for 4d and 5d metal monoborides. Black-Right-Pointing-Pointer Vickers hardnesses of monoborides are relatively low. Black-Right-Pointing-Pointer B-vacancies cause the difference in lattice parameters for IrB and PtB. Black-Right-Pointing-Pointer Nonstoichiometric IrB and PtB phases synthesized. - Abstract: The crystal structures, stability, electronic and elastic properties of 4d and 5d transition metal monoborides have been studied by first principles calculations. It is found that NaCl-type ZrB, NbB, MoB, HfB, TaB and WB, WC-type TcB, RuB, ReB, OsB and IrB, and anti-NiAs-type RhB and PdB are thermodynamically stable at zero pressure. They all are metallic. The Vickers hardnesses of these monoborides are relatively low as compared with monocarbides and mononitrides. It is clarified that the presence of B-vacancies is the origin for the difference of lattice parameters between theoretical and experimental results for WC-type IrB and anti-NiAs-type PtB while IrB and PtB with stoichiometry from calculations are revealed to be mechanically unstable and dynamically unstable, respectively.

  1. Calculations of elastic, ionization and total cross sections for inert gases upon electron impact: threshold to 2 keV

    Energy Technology Data Exchange (ETDEWEB)

    Vinodkumar, Minaxi [V P and R P T P Science College, Vallabh Vidyanagar 388 120, Gujarat (India); Limbachiya, Chetan [P S Science College, Kadi 382 715, Gujarat (India); Antony, Bobby [Department of Environmental, Earth and Atmospheric Sciences, University of Massachusetts Lowell, 265 Riverside Street, Lowell, MA 01854-5045 (United States); Joshipura, K N [Department of Physics, Sardar Patel University, Vallabh Vidyanagar 388 120, Gujarat (India)

    2007-08-28

    In this paper we report comprehensive calculations of total elastic (Q{sub el}), total ionization (Q{sub ion}) and total (complete) cross sections (Q{sub T}) for the impact of electrons on inert gases (He, Ne, Ar, Kr and Xe) at energies from about threshold to 2000 eV. We have employed the spherical complex optical potential (SCOP) formalism to evaluate Q{sub el} and Q{sub T} and used the complex spherical potential-ionization contribution (CSP-ic) method to derive Q{sub ion}. The dependence of Q{sub T} on polarizability and incident energy is presented for these targets through an analytical formula. Mutual comparison of various cross sections is provided to show their relative contribution to the total cross sections Q{sub T}. Comparison of Q{sub T} for all these targets is carried out to present a general theoretical picture of collision processes. The present calculations also provide information, hitherto sparse, on the excitation processes of these atomic targets. These results are compared with available experimental and other theoretical data and overall good agreement is observed.

  2. A comparison of three time-dependent wave packet methods for calculating electron--atom elastic scattering cross sections

    International Nuclear Information System (INIS)

    Judson, R.S.; McGarrah, D.B.; Sharafeddin, O.A.; Kouri, D.J.; Hoffman, D.K.

    1991-01-01

    We compare three time-dependent wave packet methods for performing elastic scattering calculations from screened Coulomb potentials. The three methods are the time-dependent amplitude density method (TDADM), what we term a Cayley-transform method (CTM), and the Chebyshev propagation method of Tal-Ezer and Kosloff. Both the TDADM and the CTM are based on a time-dependent integral equation for the wave function. In the first, we propagate the time-dependent amplitude density, |ζ(t)right-angle=U|ψ(t)right-angle, where U is the interaction potential and |ψ(t)right-angle is the usual time-dependent wave function. In the other two, the wave function is propagated. As a numerical example, we calculate phase shifts and cross sections using a screened Coulomb, Yukawa type potential over the range 200--1000 eV. One of the major advantages of time-dependent methods such as these is that we get scattering information over this entire range of energies from one propagation. We find that in most cases, all three methods yield comparable accuracy and are about equally efficient computationally. However for l=0, where the Coulomb well is not screened by the centrifugal potential, the TDADM requires smaller grid spacings to maintain accuracy

  3. Elastic properties of fcc Fe–Mn–X (X = Cr, Co, Ni, Cu) alloys studied by the combinatorial thin film approach and ab initio calculations

    International Nuclear Information System (INIS)

    Reeh, S; Kasprzak, M; Klusmann, C D; Stalf, F; Music, D; Schneider, J M; Ekholm, M; Abrikosov, I A

    2013-01-01

    The elastic properties of fcc Fe–Mn–X (X = Cr, Co, Ni, Cu) alloys with additions of up to 8 at.% X were studied by combinatorial thin film growth and characterization and by ab initio calculations using the disordered local moments (DLM) approach. The lattice parameter and Young’s modulus values change only marginally with X. The calculations and experiments are in good agreement. We demonstrate that the elastic properties of transition metal alloyed Fe–Mn can be predicted by the DLM model. (paper)

  4. Elastic properties of fcc Fe-Mn-X (X = Cr, Co, Ni, Cu) alloys studied by the combinatorial thin film approach and ab initio calculations.

    Science.gov (United States)

    Reeh, S; Kasprzak, M; Klusmann, C D; Stalf, F; Music, D; Ekholm, M; Abrikosov, I A; Schneider, J M

    2013-06-19

    The elastic properties of fcc Fe-Mn-X (X = Cr, Co, Ni, Cu) alloys with additions of up to 8 at.% X were studied by combinatorial thin film growth and characterization and by ab initio calculations using the disordered local moments (DLM) approach. The lattice parameter and Young's modulus values change only marginally with X. The calculations and experiments are in good agreement. We demonstrate that the elastic properties of transition metal alloyed Fe-Mn can be predicted by the DLM model.

  5. Elasticity of fluorite at high temperatures

    Science.gov (United States)

    Eke, J.; Tennakoon, S.; Mookherjee, M.

    2017-12-01

    Fluorite (CaF2) is a simple halide with cubic space group symmetry (Fm-3m) and is often used as an internal pressure calibrant in moderate high-pressure/high-temperature experiments [1]. In order to gain insight into the elastic behavior of fluorite, we have conducted Resonant Ultrasound Spectroscopy (RUS) on a single crystal of fluorite with rectangular parallelepiped geometry. Using single crystal X-ray diffraction, we aligned the edges of the rectangular parallelepiped with [-1 1 1], [-1 1 -2], and [-1 -1 0] crystallographic directions. We conducted the RUS measurements up to 620 K. RUS spectra are influenced by the geometry, density, and the full elastic moduli tensor of the material. In our high-temperature RUS experiments, the geometry and density were constrained using thermal expansion from previous studies [2]. We determined the elasticity by minimizing the difference between observed resonance and calculated Eigen frequency using Rayleigh-Ritz method [3]. We found that at room temperature, the single crystal elastic moduli for fluorite are 170, 49, and 33 GPa for C11, C12, and C44 respectively. At room temperatures, the aggregate bulk modulus (K) is 90 GPa and the shear modulus (G) is 43 GPa. We note that the elastic moduli and sound wave velocities decrease linearly as a function of temperature with dVP /dT and dVS /dT being -9.6 ×10-4 and -5.0 ×10-4 km/s/K respectively. Our high-temperature RUS results are in good agreement with previous studies on fluorite using both Ultrasonic methods and Brillouin scattering [4,5]. Acknowledgement: This study is supported by US NSF awards EAR-1639552 and EAR-1634422. References: [1] Speziale, S., Duffy, T. S. 2002, Phys. Chem. Miner., 29, 465-472; [2] Roberts, R. B., White, G. K., 1986, J. Phys. C: Solid State Phys., 19, 7167-7172. [3] Migliori, A., Maynard, J. D., 2005, Rev. Sci. Instrum., 76, 121301. [4] Catlow, C. R. A., Comins, J. D., Germano, F. A., Harley, R. T., Hayes, W., 1978, J. Phys. C Solid State Phys

  6. Modeling Pseudo-elastic Behavior of Springback

    International Nuclear Information System (INIS)

    Xia, Z. Cedric

    2005-01-01

    One of the principal foundations of mathematical theory of conventional plasticity for rate-independent metals is that there exists a well-defined yield surface in stress space for any material point under deformation. A material point can undergo further plastic deformation if the applied stresses are beyond current yield surface which is generally referred as 'plastic loading'. On the other hand, if the applied stress state falls within or on the yield surface, the metal will deform elastically only and is said to be undergoing 'elastic unloading'. Although it has been always recognized throughout the history of development of plasticity theory that there is indeed inelastic deformation accompanying elastic unloading, which leads to metal's hysteresis behavior, its effects were thought to be negligible and were largely ignored in the mathematical treatment.Recently there have been renewed interests in the study of unloading behavior of sheet metals upon large plastic deformation and its implications on springback prediction. Springback is essentially an elastic recovery process of a formed sheet metal blank when it is released from the forming dies. Its magnitude depends on the stress states and compliances of the deformed sheet metal if no further plastic loading occurs during the relaxation process. Therefore the accurate determination of material compliances during springback and its effective incorporation into simulation software are important aspects for springback calculation. Some of the studies suggest that the unloading curve might deviate from linearity, and suggestions were made that a reduced elastic modulus be used for springback simulation.The aim of this study is NOT to take a position on the debate of whether elastic moduli are changed during sheet metal forming process. Instead we propose an approach of modeling observed psuedoelastic behavior within the context of mathematical theory of plasticity, where elastic moduli are treated to be

  7. Hydrostatic pressure dependence of elastic constants for lead fluoride crystal

    International Nuclear Information System (INIS)

    Singh, R.K.; Rao, C.N.

    1988-10-01

    The variations of the second order elastic constants (SOEC) and longitudinal and shear moduli with hydrostatic pressure for the lead fluoride have been investigated theoretically, for the first time, by means of a three-body force potential (TBP) model. The significance of three-body interactions (TBI) has been clearly demonstrated in these investigations. The present TBP model has reproduced the pressure derivatives of the SOEC of PbF more satisfactorily than the shell model and other model calculations. (author). 24 refs, 3 figs, 2 tabs

  8. Uniqueness theorems in linear elasticity

    CERN Document Server

    Knops, Robin John

    1971-01-01

    The classical result for uniqueness in elasticity theory is due to Kirchhoff. It states that the standard mixed boundary value problem for a homogeneous isotropic linear elastic material in equilibrium and occupying a bounded three-dimensional region of space possesses at most one solution in the classical sense, provided the Lame and shear moduli, A and J1 respectively, obey the inequalities (3 A + 2 J1) > 0 and J1>O. In linear elastodynamics the analogous result, due to Neumann, is that the initial-mixed boundary value problem possesses at most one solution provided the elastic moduli satisfy the same set of inequalities as in Kirchhoffs theorem. Most standard textbooks on the linear theory of elasticity mention only these two classical criteria for uniqueness and neglect altogether the abundant literature which has appeared since the original publications of Kirchhoff. To remedy this deficiency it seems appropriate to attempt a coherent description ofthe various contributions made to the study of uniquenes...

  9. Elasticity of stishovite at high pressure

    Science.gov (United States)

    Li, Baosheng; Rigden, Sally M.; Liebermann, Robert C.

    1996-08-01

    The elastic-wave velocities of stishovite, the rutile-structured polymorph of SiO 2, were measured to 3 GPa at room temperature in a piston cylinder apparatus using ultrasonic interferometry on polycrystalline samples. These polycrystalline samples (2-3 mm in length and diameter) were hot-pressed at 14 GPa and 1050°C in a 2000 ton uniaxial split-sphere apparatus (USSA-2000) using fused silica rods as starting material. They were characterized as low porosity (less than 1%), single phase, fine grained, free of cracks and preferred orientation, and acoustically isotropic by using density measurement, X-ray diffraction, scanning electron microscopy, and bench-top velocity measurements. On the basis of subsequent in situ X-ray diffraction study at high P and T on peak broadening on similar specimens, it is evident that the single crystal grains within these polycrystalline aggregates are well equilibrated and that these specimens are free of residual strain. P- and S-wave velocities measured at 1 atm are within 1.5% of the Hashin-Shtrikman bounds calculated from single-crystal elastic moduli. Measured pressure derivatives of the bulk and shear moduli, K' 0 = 5.3 ± 0.1 and G' 0 = 1.8 ± 0.1, are not unusual compared with values measured for other transition zone phases such as silicate spinel and majorite garnet. Isothermal compression curves calculated with the measured values of K0 and K' 0 agree well with experimental P-V data to 16 GPa. The experimental value of dG /dP is in excellent agreement with predictions based on elasticity systematics. Theoretical models are not yet able to replicate the measured values of K' 0 and G' 0.

  10. Neutron Elastic Scattering Cross Sections Experimental Data and Optical Model Cross Section Calculations. A Compilation of Neutron Data from the Studsvik Neutron Physics Laboratory

    Energy Technology Data Exchange (ETDEWEB)

    Holmqvist, B; Wiedling, T

    1969-06-15

    Neutron elastic scattering cross section measurements have been going on for a long period at the Studsvik Van de Graaff laboratory. The cross sections of a range of elements have been investigated in the energy interval 1.5 to 8 MeV. The experimental data have been compared with cross sections calculated with the optical model when using a local nuclear potential.

  11. Influence of cross-anisotropy material behavior on back-calculation analysis of multi-layered systems

    CSIR Research Space (South Africa)

    Maina, JW

    2008-07-01

    Full Text Available to be cross-anisotropic and by assuming a variety of horizontal and vertical elastic moduli, surface deflections were computed. These deflections were used to backcalculate equivalent layer moduli assuming isotropic material property. Finally, by using...

  12. Moduli stabilization in type IIB orientifolds

    International Nuclear Information System (INIS)

    Schulgin, W.

    2007-01-01

    This thesis deals with the stabilization of the moduli fields in the compactifications of the type IIB string theory on orientifolds. A concrete procedure for the construction of solutions, in which all moduli fields are fixed, yields the KKLT scenario. We study, on which models the scenario can be applied, if approximations of the original KKLT work are abandoned. We find that in a series of models, namely such without complex-structure moduli the construction of the consistent solutions in the framework of the KKLT scenario is not possible. The nonperturbative effects, like D3 instantons and gaugino condensates are a further component of the KKLT scenario. They lead to the stabilization of the Kaehler moduli. We present criteria for the generation of the superpotential due to the D3 instantons at a Calaby-Yau manifold in presence of fluxes. Furthermore we show that although the presence of the nonperturbative superpotential in the equations of motions is correlated with the switching on of all ISD and IASD fluxes, the deciding criterium for the generation of the nonperturbative superpotential depends only on the fluxes of the type (2,1). Thereafter we discuss two models, in which we stabilize all moduli fields. Thereby it deals with Calabi-Yau orientifolds which have been obtained by a blow-up procedure from the Z 6-II and Z 2 x Z 4 orientifolds

  13. Chirality-dependent anisotropic elastic properties of a monolayer graphene nanosheet.

    Science.gov (United States)

    Guo, Jian-Gang; Zhou, Li-Jun; Kang, Yi-Lan

    2012-04-01

    An analytical approach is presented to predict the elastic properties of a monolayer graphene nanosheet based on interatomic potential energy and continuum mechanics. The elastic extension and torsional springs are utilized to simulate the stretching and angle variation of carbon-carbon bond, respectively. The constitutive equation of the graphene nanosheet is derived by using the strain energy density, and the analytical formulations for nonzero elastic constants are obtained. The in-plane elastic properties of the monolayer graphene nanosheet are proved to be anisotropic. In addition, Young's moduli, Poisson's ratios and shear modulus of the monolayer graphene nanosheet are calculated according to the force constants derived from Morse potential and AMBER force field, respectively, and they were proved to be chirality-dependent. The comparison with experimental results shows a very agreement.

  14. Full-potential calculations of structural, elastic and electronic properties of MgAl2O4 and ZnAl2O4 compounds

    International Nuclear Information System (INIS)

    Khenata, R.; Sahnoun, M.; Baltache, H.; Rerat, M.; Reshak, Ali H.; Al-Douri, Y.; Bouhafs, B.

    2005-01-01

    Theoretical studies of structural, elastic and electronic properties of spinel MgAl 2 O 4 and ZnAl 2 O 4 oxides are presented, using the full-potential linear augmented plane wave (FP-LAPW) method as implemented in the WIEN97 code. In this approach the local density approximation (LDA) is used for the exchange-correlation (XC) potential. Results are given for lattice constant, bulk modulus, and its pressure derivative. The band structure, density of states, pressure coefficients of energy gaps and elastic constants are also given. We present a detailed comparison with available experimental data and previous calculations. Good agreement is found

  15. Determination of elastic modulus for hollow spherical shells via resonant ultrasound spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    Ma, Xiaojun [Institute of Modern Physics, Fudan University, Shanghai 200433 (China); Research Center of Laser Fusion, CAEP, Mianyang 621900 (China); Tang, Xing; Wang, Zongwei [Research Center of Laser Fusion, CAEP, Mianyang 621900 (China); Chen, Qian; Qian, Menglu [Institute of Acoustic, Tongji University, Shanghai 200092 (China); Meng, Jie [Research Center of Laser Fusion, CAEP, Mianyang 621900 (China); Tang, Yongjian [Institute of Modern Physics, Fudan University, Shanghai 200433 (China); Research Center of Laser Fusion, CAEP, Mianyang 621900 (China); Shen, Hao [Institute of Modern Physics, Fudan University, Shanghai 200433 (China); Gao, Dangzhong, E-mail: dgaocn@163.com [Research Center of Laser Fusion, CAEP, Mianyang 621900 (China)

    2017-04-15

    Highlights: • The axisymmetric frequency equation of an isotropic hollow two-layer sphere is deduced by three dimension elasticity theory and global matrix method. • The simulated results demonstrate that the natural frequencies of a hollow sphere are more strongly dependent on Young’s modulus than Poisson's ratio. • The Young’s moduli of polymer capsules with an sub-millimeter inner radius are measured accurately with an uncertainty of ∼10%. - Abstract: The elastic property of a capsule is one of the essential parameters both in engineering applications and scientific understanding of material nature in inertial confinement fusion (ICF) experiments. The axisymmetric frequency equation of an isotropic hollow two-layer sphere is deduced by three dimension elasticity theory and global matrix method, and a combined resonant ultrasound spectroscopy(RUS), which consists of a piezoelectric-based resonant ultrasound spectroscopy(PZT-RUS) and a laser-based resonant ultrasound spectroscopy(LRUS), is developed for determining the elastic modulus of capsule. To understand the behavior of natural frequencies varying with elastic properties, the dependence of natural frequencies on Young’s modulus and Poisson’s ratio are calculated numerically. Some representative polymer capsules are measured using PZT-RUS and LRUS. Based on the theoretical and experimental results, the Young’s moduli of these capsules are measured accurately with an uncertainty of ∼10%.

  16. Accidental Kähler moduli inflation

    International Nuclear Information System (INIS)

    Maharana, Anshuman; Rummel, Markus; Sumitomo, Yoske

    2015-01-01

    We study a model of accidental inflation in type IIB string theory where inflation occurs near the inflection point of a small Kähler modulus. A racetrack structure helps to alleviate the known concern that string-loop corrections may spoil Kähler Moduli Inflation unless having a significant suppression via the string coupling or a special brane setup. Also, the hierarchy of gauge group ranks required for the separation between moduli stabilization and inflationary dynamics is relaxed. The relaxation becomes more significant when we use the recently proposed D-term generated racetrack model

  17. Charge-density-shear-moduli relationships in aluminum-lithium alloys.

    Science.gov (United States)

    Eberhart, M

    2001-11-12

    Using the first principles full-potential linear-augmented-Slater-type orbital technique, the energies and charge densities of aluminum and aluminum-lithium supercells have been computed. The experimentally observed increase in aluminum's shear moduli upon alloying with lithium is argued to be the result of predictable changes to aluminum's total charge density, suggesting that simple rules may allow the alloy designer to predict the effects of dilute substitutional elements on alloy elastic response.

  18. Tangent moduli of the Hencky material model derived from the stored energy function at finite strains

    Czech Academy of Sciences Publication Activity Database

    Poživilová, Alena; Plešek, Jiří

    2005-01-01

    Roč. 482, č. 482 (2005), s. 327-330 ISSN 0255-5476 R&D Projects: GA ČR(CZ) GA101/03/0331; GA ČR(CZ) GP106/03/D038 Institutional research plan: CEZ:AV0Z20760514 Keywords : acoustoelasticity * large strains * third order elastic moduli Subject RIV: JG - Metallurgy Impact factor: 0.399, year: 2005

  19. Structural, electronic, elastic, and thermodynamic properties of CaSi, Ca2Si, and CaSi2 phases from first-principles calculations

    Science.gov (United States)

    Li, X. D.; Li, K.; Wei, C. H.; Han, W. D.; Zhou, N. G.

    2018-06-01

    The structural, electronic, elastic, and thermodynamic properties of CaSi, Ca2Si, and CaSi2 are systematically investigated by using first-principles calculations method based on density functional theory (DFT). The calculated formation enthalpies and cohesive energies show that CaSi2 possesses the greatest structural stability and CaSi has the strongest alloying ability. The structural stability of the three phases is compared according to electronic structures. Further analysis on electronic structures indicates that the bonding of these phases exhibits the combinations of metallic, covalent, and ionic bonds. The elastic constants are calculated, and the bulk modulus, shear modulus, Young's modulus, Poisson's ratio, and anisotropy factor of polycrystalline materials are deduced. Additionally, the thermodynamic properties were theoretically predicted and discussed.

  20. A minicourse on moduli of curves

    International Nuclear Information System (INIS)

    Looijenga, E.

    2000-01-01

    These are notes that accompany a short course given at the School on Algebraic Geometry 1999 at the ICTP, Trieste. A major goal is to outline various approaches to moduli spaces of curves. In the last part I discuss the algebraic classes that naturally live on these spaces; these can be thought of as the characteristic classes for bundles of curves. (author)

  1. CLASSICAL AREAS OF PHENOMENOLOGY: First-principles calculations for the elastic properties of Ni-base model superalloys: Ni/Ni3Al multilayers

    Science.gov (United States)

    Wang, Yun-Jiang; Wang, Chong-Yu

    2009-10-01

    A model system consisting of Ni[001](100)/Ni3Al[001](100) multi-layers are studied using the density functional theory in order to explore the elastic properties of single crystal Ni-based superalloys. Simulation results are consistent with the experimental observation that rafted Ni-base superalloys virtually possess a cubic symmetry. The convergence of the elastic properties with respect to the thickness of the multilayers are tested by a series of multilayers from 2γ'+2γ to 10γ'+10γ atomic layers. The elastic properties are found to vary little with the increase of the multilayer's thickness. A Ni/Ni3Al multilayer with 10γ'+10γ atomic layers (3.54 nm) can be used to simulate the mechanical properties of Ni-base model superalloys. Our calculated elastic constants, bulk modulus, orientation-dependent shear modulus and Young's modulus, as well as the Zener anisotropy factor are all compatible with the measured results of Ni-base model superalloys R1 and the advanced commercial superalloys TMS-26, CMSX-4 at a low temperature. The mechanical properties as a function of the γ' phase volume fraction are calculated by varying the proportion of the γ and γ' phase in the multilayers. Besides, the mechanical properties of two-phase Ni/Ni3Al multilayer can be well predicted by the Voigt-Reuss-Hill rule of mixtures.

  2. First-principle calculations of the structural, elastic and bonding properties of Cs{sub 2}NaLnCl{sub 6} (Ln=La–Lu) cubic elpasolites

    Energy Technology Data Exchange (ETDEWEB)

    Ma, C.G.; Liu, D.X.; Feng, B.; Tian, Y.; Li, L. [College of Sciences, Chongqing University of Posts and Telecommunications, Chongqing 400065 (China); Brik, M.G., E-mail: mikhail.brik@ut.ee [College of Sciences, Chongqing University of Posts and Telecommunications, Chongqing 400065 (China); Institute of Physics, University of Tartu, Ravila 14C, Tartu 50411 (Estonia); Institute of Physics, Jan Dlugosz University, Armii Krajowej 13/15, PL-42200 Czestochowa (Poland)

    2016-01-15

    For the first time the structural, elastic and bonding properties of 15 elpasolite crystals Cs{sub 2}NaLnCl{sub 6} (Ln denotes all lanthanides from La to Lu) were calculated systematically using the CRYSTAL09 program. Several trends in the variation of these properties in relation to the atomic number Z of the Ln ions were found; in particular, the lattice parameter of these compounds decreases with Z (which can lead to the increased crystal field splittings of the 5d states for the heavier Ln ions), whereas the elastic constants and Debye temperature increase. The degree of covalency of the Ln–Cl chemical bonds is increased toward the end of the lanthanide series. - Highlights: • Structural, elastic and bonding properties of 15 cubic elpasolites Cs{sub 2}NaLnCl{sub 6} (Ln=La,…,Lu) are calculated. • Relations between these quantities and Ln atomic number were found. • Possible correlation between the elastic properties and Stokes shift is proposed.

  3. FP-LAPW calculations of the elastic, electronic and thermoelectric properties of the filled skutterudite CeRu4Sb12

    International Nuclear Information System (INIS)

    Shankar, A.; Rai, D.P.; Chettri, Sandeep; Khenata, R.; Thapa, R.K.

    2016-01-01

    We have investigated the electronic structure, elastic and thermoelectric properties of the filled skutterudite CeRu 4 Sb 12 using the density functional theory (DFT). The full potential linearized augmented plane wave (FP-LAPW) method within a framework of the generalized gradient approximation (GGA) approach is used to perform the calculations presented here. The electronic structure calculation suggests an indirect band gap semiconducting nature of the material with energy band gap of 0.08 eV. The analysis of the elastic constants at relaxed positions reveals the ductile nature of the sample material with covalent contribution in the inter-atomic bonding. The narrow band gap semiconducting nature with high value of Seebeck coefficient suggests the possibility of the thermoelectric application of the material. The analysis of the thermal transport properties confirms the result obtained from the energy band structure of the material with high thermopower and dimensionless figure of merit 0.19 at room temperature.

  4. Intermixing in heteroepitaxial islands: fast, self-consistent calculation of the concentration profile minimizing the elastic energy

    International Nuclear Information System (INIS)

    Gatti, R; UhlIk, F; Montalenti, F

    2008-01-01

    We present a novel computational method for finding the concentration profile which minimizes the elastic energy stored in heteroepitaxial islands. Based on a suitable combination of continuum elasticity theory and configurational Monte Carlo, we show that such profiles can be readily found by a simple, yet fully self-consistent, iterative procedure. We apply the method to SiGe/Si islands, considering realistic three-dimensional shapes (pyramids, domes and barns), finding strongly non-uniform distributions of Si and Ge atoms, in qualitative agreement with several experiments. Moreover, our simulated selective-etching profiles display, in some cases, a remarkable resemblance to the experimental ones, opening intriguing questions on the interplay between kinetic, entropic and elastic effects

  5. Moduli spaces of convex projective structures on surfaces

    DEFF Research Database (Denmark)

    Fock, V. V.; Goncharov, A. B.

    2007-01-01

    We introduce explicit parametrisations of the moduli space of convex projective structures on surfaces, and show that the latter moduli space is identified with the higher Teichmüller space for defined in [V.V. Fock, A.B. Goncharov, Moduli spaces of local systems and higher Teichmüller theory, math.......AG/0311149]. We investigate the cluster structure of this moduli space, and define its quantum version....

  6. Quantum scattering in two black hole moduli space

    International Nuclear Information System (INIS)

    Sakamoto, Kenji; Shiraishi, Kiyoshi

    2003-01-01

    We discuss the quantum scattering process in a moduli space consisting of two maximally charged dilaton black holes. The black hole moduli space geometry has different structures for arbitrary dimensions and various values of the dilaton coupling. We study the quantum effects of the different moduli space geometries with scattering process. Then, it is found that there is a resonance state on certain moduli spaces

  7. Coupled-channel optical calculation of electron-hydrogen scattering: elastic scattering from 0.5 to 30 eV

    International Nuclear Information System (INIS)

    Bray, I.; Konovalov, D.A.; McCarthy, I.E.

    1991-01-01

    A coupled-channel optical method for electron-atomic hydrogen scattering is presented in a form that treats both the projectile and the target electrons symmetrically. Elastic differential cross sections are calculated at a range of energies from 0.5 to 30 eV and are found to be in complete agreement with the absolute measurements, previously reported. Total and total ionization cross sections are also presented. 13 refs., 2 tabs., 2 figs

  8. Structural, elastic and electronic Properties of isotropic cubic crystals of carbon and silicon nanotubes : Density functional based tight binding calculations.

    Directory of Open Access Journals (Sweden)

    Alexander L. Ivanovskii

    2008-01-01

    Full Text Available Atomic models of cubic crystals (CC of carbon and graphene-like Si nanotubes are offered and their structural, cohesive, elastic and electronic properties are predicted by means of the DFTB method. Our main findings are that the isotropic crystals of carbon nanotubes adopt a very high elastic modulus B and low compressibility β, namely B = 650 GPa, β = 0.0015 1/GPa. In addition, these crystals preserve the initial conductivity type of their “building blocks”, i.e. isolated carbon and Si nanotubes. This feature may be important for design of materials with the selected conductivity type.

  9. Consistent Orientation of Moduli Spaces

    Science.gov (United States)

    Freed, Daniel S.; Hopkins, Michael J.; Teleman, Constantin

    In a series of papers by Freed, Hopkins, and Teleman (2003, 2005, 2007a) the relationship between positive energy representations of the loop group of a compact Lie group G and the twisted equivariant K-theory Kτ+dimGG (G) was developed. Here G acts on itself by conjugation. The loop group representations depend on a choice of ‘level’, and the twisting τ is derived from the level. For all levels the main theorem is an isomorphism of abelian groups, and for special transgressed levels it is an isomorphism of rings: the fusion ring of the loop group andKτ+dimGG (G) as a ring. For G connected with π1G torsionfree, it has been proven that the ring Kτ+dimGG (G) is a quotient of the representation ring of G and can be calculated explicitly. In these cases it agrees with the fusion ring of the corresponding centrally extended loop group. This chapter explicates the multiplication on the twisted equivariant K-theory for an arbitrary compact Lie group G. It constructs a Frobenius ring structure on Kτ+dimGG (G). This is best expressed in the language of topological quantum field theory: a two-dimensional topological quantum field theory (TQFT) is constructed over the integers in which the abelian group attached to the circle is Kτ+dimGG (G).

  10. Theoretical studies of the pressure-induced phase transition and elastic properties of BeS

    Energy Technology Data Exchange (ETDEWEB)

    Ji, Xu [College of Polymer Science and Engineering, Sichuan University, Chengdu 610065 (China); College of Chemical Engineering, Sichuan University, Chengdu 610065 (China); Yu, Yang, E-mail: yuyang@scu.edu.cn [Department of Logistics Management, Sichuan University, Chengdu 610065 (China); Ji, Junyi [College of Chemical Engineering, Sichuan University, Chengdu 610065 (China); Long, Jianping [College of Materials and Chemistry and Chemical Engineering, Chengdu University of Technology, Chengdu 610059 (China); Chen, Jianjun; Liu, Daijun [College of Chemical Engineering, Sichuan University, Chengdu 610065 (China)

    2015-02-25

    Highlights: • Transition pressure from B3 to B8 of BeS is 58.86 GPa. • Elastic properties of BeS under pressure are predicted for the first time. • Elastic moduli of BeS increase monotonically with increasing pressure. • Elastic anisotropy of BeS has been investigated. - Abstract: First-principles calculations were performed to investigate the structural, electronic and elastic properties of BeS in both B3 and B8 structures. The structural phase transition from B3 to B8 occurs at 58.86 GPa with a volume decrease of 10.74%. The results of the electronic band structure show that the energy gap is indirect for B3 and B8 phases. The pressure dependence of the direct and indirect band gaps for BeS has been investigated. Especially, the elastic constants of B8 BeS under high pressure have been studied for the first time. The mechanical stability of the two phases has been discussed based on the pressure dependence of the elastic constants. In addition, the pressure dependence of bulk modulus, shear modulus, Young’s modulus, elastic wave velocities and brittle–ductile behavior of BeS are all successfully obtained. Finally, the elastic anisotropy has been investigated by using two different methods.

  11. Structural, elastic, and electronic properties of new 211 MAX phase Nb{sub 2}GeC from first-principles calculations

    Energy Technology Data Exchange (ETDEWEB)

    Shein, I.R. [Institute of Solid State Chemistry, Ural Branch of the Russian Academy of Sciences, Ekaterinburg 620990 (Russian Federation); Ivanovskii, A.L., E-mail: ivanovskii@ihim.uran.ru [Institute of Solid State Chemistry, Ural Branch of the Russian Academy of Sciences, Ekaterinburg 620990 (Russian Federation)

    2013-02-01

    Very recently (2012, Phys. Rev Lett., 109, 035502) a new hexagonal (s.g. P63/mmc, Music-Sharp-Sign 194) ternary phase Nb{sub 2}GeC, which belongs to so-called 211-like MAX phases, was discovered. In order to get a systematic insight into the structural, elastic, and electronic properties of Nb{sub 2}GeC, we used two complementary DFT-based first-principles approaches (as implemented in the VASP and Wien2k packages) to calculate the optimized structural parameters, band structure, densities of state, Fermi surface, and a set of elastic parameters: elastic constants (C{sub ij}), bulk modulus (B), compressibility ({beta}), shear modulus (G), Young's modulus (Y), and elastic anisotropy indexes, which were discussed in comparison with available data. Besides, the inter-atomic bonding picture for Nb{sub 2}GeC was discussed using electron density maps and Bader's charge analysis.

  12. Development and validation of an elastic and inelastic calculation method for tubes, based on beam models and taking into account the thermal stresses on the wall

    International Nuclear Information System (INIS)

    Krakowiak, C.

    1989-11-01

    A simplified model for the elastic-plastic calculations of thin and flexible tubes submitted to thermal stresses is presented. The method is based on beam models and provides satisfactory results concerning the displacement of the whole tube system. These results can be justified by the fact that the modifications of the tube cross sections (from circular to elliptical), the flexibility of the elbow joints and the radial temperature profile are included in the calculations. The thermoplasticity analysis is performed by defining independent and general flow directions and determining the corresponding behavior laws. The model is limited to proportional monotonous charging, however the obtained results are promissing [fr

  13. Special geometry on the moduli space for the two-moduli non-Fermat Calabi–Yau

    Directory of Open Access Journals (Sweden)

    Konstantin Aleshkin

    2018-01-01

    Full Text Available We clarify the recently proposed method for computing a special Kähler metric on a Calabi–Yau complex structure moduli space using the fact that the moduli space is a subspace of a particular Frobenius manifold. We use this method to compute a previously unknown special Kähler metric in a two-moduli non-Fermat model.

  14. Special geometry on the moduli space for the two-moduli non-Fermat Calabi-Yau

    Science.gov (United States)

    Aleshkin, Konstantin; Belavin, Alexander

    2018-01-01

    We clarify the recently proposed method for computing a special Kähler metric on a Calabi-Yau complex structure moduli space using the fact that the moduli space is a subspace of a particular Frobenius manifold. We use this method to compute a previously unknown special Kähler metric in a two-moduli non-Fermat model.

  15. BCFT moduli space in level truncation

    Czech Academy of Sciences Publication Activity Database

    Kudrna, Matěj; Maccaferri, C.

    2016-01-01

    Roč. 2016, č. 4 (2016), 1-33, č. článku 057. ISSN 1029-8479 R&D Projects: GA ČR(CZ) GA14-31689S Institutional support: RVO:68378271 Keywords : deformation: marginal * field theory: string * tachyon: potential * string: open * moduli space * effective potential * nonperturbative * toy model Subject RIV: BF - Elementary Particles and High Energy Physics Impact factor: 6.063, year: 2016

  16. Supersymmetric SU(5) GUT with Stabilized Moduli

    CERN Document Server

    Antoniadis, Ignatios; Panda, Binata

    2008-01-01

    We construct a minimal example of a supersymmetric grand unified model in a toroidal compactification of type I string theory with magnetized D9-branes. All geometric moduli are stabilized in terms of the background internal magnetic fluxes which are of "oblique" type (mutually non-commuting). The gauge symmetry is just SU(5) and the gauge non-singlet chiral spectrum contains only three families of quarks and leptons transforming in the $10+{\\bar 5}$ representations.

  17. Supersymmetric moduli stabilization and high-scale inflation

    International Nuclear Information System (INIS)

    Buchmueller, Wilfried; Wieck, Clemens; Winkler, Martin Wolfgang

    2014-04-01

    We study the back-reaction of moduli fields on the inflaton potential in generic models of F-term inflation. We derive the moduli corrections as a power series in the ratio of Hubble scale and modulus mass. The general result is illustrated with two examples, hybrid inflation and chaotic inflation. We find that in both cases the decoupling of moduli dynamics and inflation requires moduli masses close to the scale of grand unification. For smaller moduli masses the CMB observables are strongly affected.

  18. Braneworld gravity: Influence of the moduli fields

    International Nuclear Information System (INIS)

    Barcelo, Carlos; Visser, Matt

    2000-01-01

    We consider the case of a generic braneworld geometry in the presence of one or more moduli fields (e.g., the dilaton) that vary throughout the bulk spacetime. Working in an arbitrary conformal frame, using the generalized junction conditions of gr-qc/0008008 and the Gauss-Codazzi equations, we derive the effective ''induced'' on-brane gravitational equations. As usual in braneworld scenarios, these equations do not form a closed system in that the bulk can exchange both information and stress-energy with the braneworld. We work with an arbitrary number of moduli fields described by an arbitrary sigma model, with arbitrary curvature couplings, arbitrary self interactions, and arbitrary dimension for the bulk. (The braneworld is always codimension one.) Among the novelties we encounter are modifications of the on-brane stress-energy conservation law, anomalous couplings between on-brane gravity and the trace of the on-brane stress-energy tensor, and additional possibilities for modifying the on-brane effective cosmological constant. After obtaining the general stress-energy ''conservation'' law and the ''induced Einstein equations'' we particularize the discussion to two particularly attractive cases: for a (n-2)-brane in ([n-1]+1) dimensions we discuss both the effect of (1) generic variable moduli fields in the Einstein frame, and (2) the effect of a varying dilaton in the string frame. (author)

  19. Structural, Mechanical and Thermodynamic Properties under Pressure Effect of Rubidium Telluride: First Principle Calculations

    Directory of Open Access Journals (Sweden)

    Bidai K.

    2017-06-01

    Full Text Available First-principles density functional theory calculations have been performed to investigate the structural, elastic and thermodynamic properties of rubidium telluride in cubic anti-fluorite (anti-CaF2-type structure. The calculated ground-state properties of Rb2Te compound such as equilibrium lattice parameter and bulk moduli are investigated by generalized gradient approximation (GGA-PBE that are based on the optimization of total energy. The elastic constants, Young’s and shear modulus, Poisson ratio, have also been calculated. Our results are in reasonable agreement with the available theoretical and experimental data. The pressure dependence of elastic constant and thermodynamic quantities under high pressure are also calculated and discussed.

  20. Note on moduli stabilization, supersymmetry breaking and axiverse

    Energy Technology Data Exchange (ETDEWEB)

    Higaki, Tetsutaro [Deutsches Elektronen-Synchrotron (DESY), Hamburg (Germany); Kobayashi, Tatsuo [Kyoto Univ. (Japan). Dept. of Physics

    2011-06-15

    We study properties of moduli stabilization in the four dimensional N=1 supergravity theory with heavy moduli and would-be saxion-axion multiplets including light string-theoretic axions. We give general formulation for the scenario that heavy moduli and saxions are stabilized while axions remain light, assuming that moduli are stabilized near the supersymmetric solution. One can find stable vacuum, i.e. nontachyonic saxions, in the non-supersymmetric Minkowski vacua. We also discuss the cases, where the moduli are coupled to the supersymmetry breaking sector and/or moduli have contributions to supersymmetry breaking. Furthermore we study the models with axions originating from matter-like fields. Our analysis on moduli stabilization is applicable even if there are not light axion multiplets. (orig.)

  1. From Process Modeling to Elastic Property Prediction for Long-Fiber Injection-Molded Thermoplastics

    International Nuclear Information System (INIS)

    Nguyen, Ba Nghiep; Kunc, Vlastimil; Frame, Barbara J.; Phelps, Jay; Tucker III, Charles L.; Bapanapalli, Satish K.; Holbery, James D.; Smith, Mark T.

    2007-01-01

    This paper presents an experimental-modeling approach to predict the elastic properties of long-fiber injection-molded thermoplastics (LFTs). The approach accounts for fiber length and orientation distributions in LFTs. LFT samples were injection-molded for the study, and fiber length and orientation distributions were measured at different locations for use in the computation of the composite properties. The current fiber orientation model was assessed to determine its capability to predict fiber orientation in LFTs. Predicted fiber orientations for the studied LFT samples were also used in the calculation of the elastic properties of these samples, and the predicted overall moduli were then compared with the experimental results. The elastic property prediction was based on the Eshelby-Mori-Tanaka method combined with the orientation averaging technique. The predictions reasonably agree with the experimental LFT data

  2. Foundation calculation for buildings and structures with two elastic characteristics of the foundation using features of Fourier transformsfor finite functions

    Directory of Open Access Journals (Sweden)

    Kurbatskiy Evgeniy Nikolaevich

    2014-01-01

    Full Text Available The problem of a beam resting on elastic foundation often occurs in the analysis of building, geotechnical, highway, and railroad structures. Its solution demands modeling of the mechanical behavior of the beam, the mechanical behavior of the soil as elastic subgrade and the form of interaction between the beam and the soil. The oldest, most famous and most frequently used mechanical model is the one devised by Winkler (1867, in which the beam-supporting soil is modeled as a series of closely spaced, mutually independent, linear elastic vertical springs, which, evidently, provide resistance in direct proportion to the deflection of the beam.The solution is presented for the problem of an Euler–Bernoulli beam supported by an infinite two-parameter Pasternak foundation. The beam is subjected to arbitrarily distributed or concentrated vertical loading along its length. Static response of a beam on an elastic foundation characterized by two parameters is investigated assuming, that the beam is subjected to external loads and two concentrated edge load. The governing equations of the problem are obtained and solved by pointing out that there is a concentrated edge foundation reaction in addition to a continuous foundation reaction along the beam axis in the case of complete contact in the foundation reactions of the two-parameter foundation model. The proposed method is based on the properties of Fourier transforms of the finite functions. Particular attention is paid to the problem, taking into account the deformation of soil areas outside the beam. The beam model with two foundation coefficients more realistically describes the behavior of strip footings under loading.

  3. Electronic, elastic, thermodynamic properties and structure disorder of {gamma}-AlON solid solution from ab initio calculations

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Yuezhong, E-mail: wyzphysics@163.com [Department of Physics and Key Laboratory for Radiation Physics and Technology of Ministry of Education, Sichuan University, Chengdu 610064 (China); Tianjin Jinhang Institute of Technical Physics, Tianjin 300192 (China); Lu, Tiecheng, E-mail: lutiecheng@scu.edu.cn [Department of Physics and Key Laboratory for Radiation Physics and Technology of Ministry of Education, Sichuan University, Chengdu 610064 (China); International Center for Material Physics, Chinese Academy of Sciences, Shenyang 110015 (China); Zhang, Rongshi [Tianjin Jinhang Institute of Technical Physics, Tianjin 300192 (China); Jiang, Shengli; Qi, Jianqi; Wang, Ying [Department of Physics and Key Laboratory for Radiation Physics and Technology of Ministry of Education, Sichuan University, Chengdu 610064 (China); Chen, Qingyun [Department of Physics and Key Laboratory for Radiation Physics and Technology of Ministry of Education, Sichuan University, Chengdu 610064 (China); National Defense Key Discipline Laboratory of Nuclear Waste and Environmental Safety, Southwest University of Science and Technology, Mianyang 621010 (China); Miao, Naihua [Physique Theorique des Materiaux, Universite de Liege, Sart Tilman B-4000 (Belgium); He, Duanwei [Institute of Atomic and Molecular Physics, Sichuan University, Chengdu 610064 (China)

    2013-01-25

    Highlights: Black-Right-Pointing-Pointer We reassess the chemical bonding character of {gamma}-AlON which shows strong ionicity. Black-Right-Pointing-Pointer {gamma}-AlON single-crystals exhibit highly elastic anisotropy. Black-Right-Pointing-Pointer The thermodynamic properties are investigated in a wider temperature/pressure range. Black-Right-Pointing-Pointer {gamma}-AlON is an O/N partially disordered structure. - Abstract: Spinel aluminium oxynitride ({gamma}-AlON), as a kind of transparent ceramic material expectable, is studied using the ab initio density functional method, in terms of electronic, elastic, thermodynamic properties and structure disorder. The results show that {gamma}-AlON exhibits strong ionicity, as quantitatively expressed by (Al{sub O}{sup 2.43+}){sub 15}(Al{sub T}{sup 2.41+}){sub 8}(O{sup 1.64-}){sub 27}(N{sup 2.27-}){sub 5} from our reassessment of the ionic character. We summarize and speculate that the considered oxynitride single-crystals exhibit highly elastic anisotropy. The interpretation of the thermodynamic properties of {gamma}-AlON according to quasi-harmonic Debye model confirm the available experiments and are extended to a wider temperature/pressure range. This material holds high elastic strength under extreme environments, where dB/dT absolute value is less than 0.03 GPa/K, independent of the pressure. Finally, we study the O/N structure disorder character of {gamma}-AlON solid solution by investigating nine possible crystal structures. It is found that {gamma}-AlON should be partially disordered, and in fact, the O/N ordering has a significant effect on the properties.

  4. Electronic, elastic, thermodynamic properties and structure disorder of γ-AlON solid solution from ab initio calculations

    International Nuclear Information System (INIS)

    Wang, Yuezhong; Lu, Tiecheng; Zhang, Rongshi; Jiang, Shengli; Qi, Jianqi; Wang, Ying; Chen, Qingyun; Miao, Naihua; He, Duanwei

    2013-01-01

    Highlights: ► We reassess the chemical bonding character of γ-AlON which shows strong ionicity. ► γ-AlON single-crystals exhibit highly elastic anisotropy. ► The thermodynamic properties are investigated in a wider temperature/pressure range. ► γ-AlON is an O/N partially disordered structure. - Abstract: Spinel aluminium oxynitride (γ-AlON), as a kind of transparent ceramic material expectable, is studied using the ab initio density functional method, in terms of electronic, elastic, thermodynamic properties and structure disorder. The results show that γ-AlON exhibits strong ionicity, as quantitatively expressed by (Al O 2.43+ ) 15 (Al T 2.41+ ) 8 (O 1.64- ) 27 (N 2.27- ) 5 from our reassessment of the ionic character. We summarize and speculate that the considered oxynitride single-crystals exhibit highly elastic anisotropy. The interpretation of the thermodynamic properties of γ-AlON according to quasi-harmonic Debye model confirm the available experiments and are extended to a wider temperature/pressure range. This material holds high elastic strength under extreme environments, where dB/dT absolute value is less than 0.03 GPa/K, independent of the pressure. Finally, we study the O/N structure disorder character of γ-AlON solid solution by investigating nine possible crystal structures. It is found that γ-AlON should be partially disordered, and in fact, the O/N ordering has a significant effect on the properties.

  5. Structural, electronic and elastic properties of the cubic CaTiO{sub 3} under pressure: A DFT study

    Energy Technology Data Exchange (ETDEWEB)

    Tariq, Saad, E-mail: saadigi@hotmail.com; Ahmed, Afaq; Tariq, Samar [Centre of Excellence in Solid State Physics, University of Punjab, Lahore, 54000 (Pakistan); Saad, Saher [Centre for High Energy Physics, University of the Punjab, Lahore (Pakistan)

    2015-07-15

    Using highly accurate FP-LAPW method with GGA approximation structural, electronic and elastic properties of cubic CaTiO{sub 3} have been calculated from 0-120 GPa range of pressure. It is observed that lattice constant, bond length and anisotropy factor decrease with increase in pressure. Also the brittle nature and indirect band-gap of the compound become ductile and direct band-gap respectively at 120 GPa. Moduli of elasticity, density of the material, Debye temperature and wave elastic wave velocities increase with increase in pressure. Spin dependent DOS’s plots show invariant anti-ferromagnetic nature of the compound under pressure. Our calculated results are in good agreement with available theoretical and experimental results.

  6. Structural, electronic and elastic properties of the cubic CaTiO3 under pressure: A DFT study

    Directory of Open Access Journals (Sweden)

    Saad Tariq

    2015-07-01

    Full Text Available Using highly accurate FP-LAPW method with GGA approximation structural, electronic and elastic properties of cubic CaTiO3 have been calculated from 0-120 GPa range of pressure. It is observed that lattice constant, bond length and anisotropy factor decrease with increase in pressure. Also the brittle nature and indirect band-gap of the compound become ductile and direct band-gap respectively at 120 GPa. Moduli of elasticity, density of the material, Debye temperature and wave elastic wave velocities increase with increase in pressure. Spin dependent DOS’s plots show invariant anti-ferromagnetic nature of the compound under pressure. Our calculated results are in good agreement with available theoretical and experimental results.

  7. First-principles study of structural and elastic properties of monoclinic and orthorhombic BiMnO3

    International Nuclear Information System (INIS)

    Mei Zhigang; Shang Shunli; Wang Yi; Liu Zikui

    2010-01-01

    The structural and elastic properties of BiMnO 3 with monoclinic (C 2/c) and orthorhombic (Pnma) ferromagnetic (FM) structures have been studied by first-principles calculations within LDA + U and GGA + U approaches. The equilibrium volumes and bulk moduli of BiMnO 3 phases are evaluated by equation of state (EOS) fittings, and the bulk properties predicted by LDA + U calculations are in better agreement with experiment. The orthorhombic phase is found to be more stable than the monoclinic phase at ambient pressure. A monoclinic to monoclinic phase transition is predicted to occur at a pressure of about 10 GPa, which is ascribed to magnetism versus volume instability of monoclinic BiMnO 3 . The single-crystal elastic stiffness constants c ij s of the monoclinic and orthorhombic phases are investigated using the stress-strain method. The c 46 of the monoclinic phase is predicted to be negative. In addition, the polycrystalline elastic properties including bulk modulus, shear modulus, Young's modulus, bulk modulus-shear modulus ratio, Poisson's ratio, and elastic anisotropy ratio are determined based on the calculated elastic constants. The presently predicted phase transition and elastic properties open new directions for investigation of the phase transitions in BiMnO 3 , and provide helpful guidance for the future elastic constant measurements.

  8. Mechanical Properties and Elastic Constants Due to Damage Accumulation and Amorphization in SiC

    International Nuclear Information System (INIS)

    Gao, Fei; Weber, William J.

    2004-01-01

    Damage accumulation due to cascade overlap, which was simulated previously, has been used to study the changes of elastic constants, bulk and elastic moduli as a function of dose. These mechanical properties generally decrease with increasing dose, and the rapid decrease at low-dose level indicates that point defects and small clusters play an important role in the changes of elastic constants rather than topological disorder. The internal strain relaxation has no effect on the elastic constants, C11 and C12, in perfect SiC, but it has a significant influence on all elastic constants calculated in damaged SiC. The elastic constants in the cascade-amorphized (CA) SiC decrease about 19%, 29% and 46% for C11, C12 and C44, respectively. The bulk modulus decrease 23% and the elastic modulus decreases 29%, which is consistent with experimental measurements. The stability of both the perfect SiC and CA-SiC under hydrostatic tension has been also investigated. All mechanical properties in the CA-SiC exhibit behavior similar to that in perfect SiC, but the critical stress at which the CA-SiC becomes structurally unstable is one order of magnitude smaller than that for perfect SiC

  9. Device to measure elastic modulus of superconducting windings

    CERN Multimedia

    CERN PhotoLab

    1979-01-01

    This device was made to measure elastic modulus of the Po dipole superconducting coils. More elaborated devices, but based on the same concept, were later used to measure the apparent elastic moduli of the LHC superconducting magnet coils. See also 7903547X, 7901386.

  10. Arithmetic fundamental groups and moduli of curves

    International Nuclear Information System (INIS)

    Makoto Matsumoto

    2000-01-01

    This is a short note on the algebraic (or sometimes called arithmetic) fundamental groups of an algebraic variety, which connects classical fundamental groups with Galois groups of fields. A large part of this note describes the algebraic fundamental groups in a concrete manner. This note gives only a sketch of the fundamental groups of the algebraic stack of moduli of curves. Some application to a purely topological statement, i.e., an obstruction to the subjectivity of Johnson homomorphisms in the mapping class groups, which comes from Galois group of Q, is explained. (author)

  11. Structural, elastic, optoelectronic and magnetic properties of ...

    Indian Academy of Sciences (India)

    2017-09-22

    Sep 22, 2017 ... 1Laboratoire de Physique Quantique de la Matière et de la ... 5Department of Physics and Astronomy, College of Science, King Saud ... elastic moduli, CdHo2S4 is mechanically stable with a ductile nature and a noticeable.

  12. Hardrock Elastic Physical Properties: Birch's Seismic Parameter Revisited

    Science.gov (United States)

    Wu, M.; Milkereit, B.

    2014-12-01

    Identifying rock composition and properties is imperative in a variety of fields including geotechnical engineering, mining, and petroleum exploration, in order to accurately make any petrophysical calculations. Density is, in particular, an important parameter that allows us to differentiate between lithologies and estimate or calculate other petrophysical properties. It is well established that compressional and shear wave velocities of common crystalline rocks increase with increasing densities (i.e. the Birch and Nafe-Drake relationships). Conventional empirical relations do not take into account S-wave velocity. Physical properties of Fe-oxides and massive sulfides, however, differ significantly from the empirical velocity-density relationships. Currently, acquiring in-situ density data is challenging and problematic, and therefore, developing an approximation for density based on seismic wave velocity and elastic moduli would be beneficial. With the goal of finding other possible or better relationships between density and the elastic moduli, a database of density, P-wave velocity, S-wave velocity, bulk modulus, shear modulus, Young's modulus, and Poisson's ratio was compiled based on a multitude of lab samples. The database is comprised of isotropic, non-porous metamorphic rock. Multi-parameter cross plots of the various elastic parameters have been analyzed in order to find a suitable parameter combination that reduces high density outliers. As expected, the P-wave velocity to S-wave velocity ratios show no correlation with density. However, Birch's seismic parameter, along with the bulk modulus, shows promise in providing a link between observed compressional and shear wave velocities and rock densities, including massive sulfides and Fe-oxides.

  13. On moduli spaces in AdS{sub 4} supergravity

    Energy Technology Data Exchange (ETDEWEB)

    Alwis, Senarath de [Colorado Univ., Boulder, CO (United States). Dept. of Physics; Louis, Jan [Hamburg Univ. (Germany). Fachbereich 12 - Physik; Hamburg Univ. (Germany). Zentrum fuer Mathematische Physik; McAllister, Liam [Cornell Univ., Ithaca, NY (United States). Dept. of Physics; Triendl, Hagen [CERN, Geneva (Switzerland). Theory Division, Physics Dept.; Westphal, Alexander [Deutsches Elektronen-Synchrotron (DESY), Hamburg (Germany). Gruppe Theorie

    2013-12-15

    We study the structure of the supersymmetric moduli spaces of N=1 and N=2 supergravity theories in AdS{sub 4} backgrounds. In the N=1 case, the moduli space cannot be a complex submanifold of the Kaehler field space, but is instead real with respect to the inherited complex structure. In N=2 supergravity the same result holds for the vector multiplet moduli space, while the hypermultiplet moduli space is a Kaehler submanifold of the quaternionic-Kaehler field space. These findings are in agreement with AdS/CFT considerations.

  14. The topology of moduli space and quantum field theory

    International Nuclear Information System (INIS)

    Montano, D.; Sonnenschein, J.

    1989-01-01

    We show how an SO(2,1) gauge theory with a fermionic symmetry may be used to describe the topology of the moduli space of curves. The observables of the theory correspond to the generators of the cohomology of moduli space. This is an extension of the topological quantum field theory introduced by Witten to investigate the cohomology of Yang-Mills instanton moduli space. We explore the basic structure of topological quantum field theories, examine a toy U(1) model, and then realize a full theory of moduli space topology. We also discuss why a pure gravity theory, as attempted in previous work, could not succeed. (orig.)

  15. Singular points in moduli spaces of Yang-Mills fields

    International Nuclear Information System (INIS)

    Ticciati, R.

    1984-01-01

    This thesis investigates the metric dependence of the moduli spaces of Yang-Mills fields of an SU(2) principal bundle P with chern number -1 over a four-dimensional, simply-connected, oriented, compact smooth manifold M with positive definite intersection form. The purpose of this investigation is to suggest that the surgery class of the moduli space of irreducible connections is, for a generic metric, a Z 2 topological invariant of the smooth structure on M. There are three main parts. The first two parts are local analysis of singular points in the moduli spaces. The last part is global. The first part shows that the set of metrics for which the moduli space of irreducible connections has only non-degenerate singularities has codimension at least one in the space of all metrics. The second part shows that, for a one-parameter family of moduli spaces in a direction transverse to the set of metrics for which the moduli spaces have singularities, passing through a non-degenerate singularity of the simplest type changes the moduli space by a cobordism. The third part shows that generic one-parameter families of metrics give rise to six-dimensional manifolds, the corresponding family of moduli spaces of irreducible connections. It is shown that when M is homeomorphic to S 4 the six-dimensional manifold is a proper cobordism, thus establishing the independence of the surgery class of the moduli space on the metric on M

  16. Moduli stabilization and the pattern of sparticle spectra

    International Nuclear Information System (INIS)

    Choi, Kiwoon

    2008-01-01

    We discuss the pattern of low energy sparticle spectra which appears in some class of moduli stabilization scenario. In case that light moduli are stabilized by non-perturbative effects encoded in the superpotential and a phenomenologically viable de Sitter vacuum is obtained by a sequestered supersymmetry breaking sector, the anomaly-mediated soft terms become comparable to the moduli-mediated ones, leading to a quite distinctive pattern of low energy spacticle masses dubbed the mirage mediation pattern. We also discuss low energy sparticle masses in more general mixed-mediation scenario which includes a comparable size of gauge mediation in addition to the moduli and anomaly mediations.

  17. First-principles calculation of the elastic constants, the electronic density of states and the ductility mechanism of the intermetallic compounds: YAg, YCu and YRh

    Energy Technology Data Exchange (ETDEWEB)

    Wu Yurong [College of Electromechanical Engineering, Hunan University of Science and Technology, Xiantang 411201 (China); Hu Wangyu [Department of Applied Physics, Hunan University, Changsha 410082 (China)], E-mail: wangyuhu2001cn@yahoo.com.cn; Han Shaochang [Department of Applied Physics, Hunan University, Changsha 410082 (China)

    2008-10-01

    First-principles calculations have been used to study the elastic and electronic properties of ductility rare-earth alloy YM (M=Ag, Cu, Rh) systems. The ductility mechanism for these alloys is studied from microscopic aspect, via electronic density of states (DOS). The Fermi energy lies near a local minimum, and the hybridization is stronger than that of the common NiAl alloy, demonstrating that the ductility of these alloys is much better than that of NiAl alloy. Elastic modulus, namely, shear modulus C'=(C{sub 11}-C{sub 12})/2, bulk modulus B and C{sub 44} are calculated by volume-conserving orthorhombic, hydrostatic pressure and tri-axial shear strain, respectively. Moreover, lattice parameters, antiphase boundary (APB) energies and unstable stacking fault energies of these alloys are also studied. The APB energies are greater than the unstable stacking fault energies for these alloy systems, and this is a characteristic of the ductility rare-earth alloy. The APB energies of YRh are the highest ones in these three YM alloys, which make dislocation dissociation difficult. The DOS and APB energy results show that the ductility of YRh may be worst in these three YM systems.

  18. Comparisons of vector analyzing-power data and calculations for neutron-deuteron elastic scattering from 10 to 14 MeV

    International Nuclear Information System (INIS)

    Howell, C.R.; Tornow, W.; Murphy, K.; Pfuetzner, H.G.; Roberts, M.L.; Li, A.; Felsher, P.D.; Walter, R.L.; Slaus, I.; Treado, P.A.; Koike, Y.

    1987-01-01

    High-accuracy analyzing-power A y (θ) data for n-d elastic scattering at 12 MeV have been measured using the polarized-neutron facilities at the Triangle Universities Nuclear Laboratory (TUNL). The present data have been combined with previous n-d measurements at 10, 12, and 14.1 MeV to form the highest-accuracy A y (θ) data set for n-d elastic scattering below 20 MeV. These data are compared to recent Faddeev-based neutron-deuteron (n-d) calculations which use the Paris and Bonn equivalent separable potentials PEST and BEST, as well as Doleschall's representation of the P- and D-wave nucleon-nucleon interactions. None of these models adequately describe the data in the angular region around the maximum of A y (θ). Possible reasons for the discrepancies are discussed. The sensitivity of the present Faddeev-based calculations to various angular momentum components of the nucleon-nucleon interaction are examined. (Auth.)

  19. FP-LAPW calculations of the elastic, electronic and thermoelectric properties of the filled skutterudite CeRu{sub 4}Sb{sub 12}

    Energy Technology Data Exchange (ETDEWEB)

    Shankar, A., E-mail: amitshan2009@gmail.com [Condensed Matter Theory Group, Department of Physics, Mizoram University, 796004 (India); Rai, D.P. [Department of Physics, Pachhunga University College, Aizawl 796001 (India); Chettri, Sandeep [Condensed Matter Theory Group, Department of Physics, Mizoram University, 796004 (India); Khenata, R. [Laboratoire de Physique Quantique et de Modélisation Mathématique (LPQ3M), Département de Technologie, Université de Mascara, 29000 (Algeria); Thapa, R.K. [Condensed Matter Theory Group, Department of Physics, Mizoram University, 796004 (India)

    2016-08-15

    We have investigated the electronic structure, elastic and thermoelectric properties of the filled skutterudite CeRu{sub 4}Sb{sub 12} using the density functional theory (DFT). The full potential linearized augmented plane wave (FP-LAPW) method within a framework of the generalized gradient approximation (GGA) approach is used to perform the calculations presented here. The electronic structure calculation suggests an indirect band gap semiconducting nature of the material with energy band gap of 0.08 eV. The analysis of the elastic constants at relaxed positions reveals the ductile nature of the sample material with covalent contribution in the inter-atomic bonding. The narrow band gap semiconducting nature with high value of Seebeck coefficient suggests the possibility of the thermoelectric application of the material. The analysis of the thermal transport properties confirms the result obtained from the energy band structure of the material with high thermopower and dimensionless figure of merit 0.19 at room temperature.

  20. First-principles calculation of the elastic constants, the electronic density of states and the ductility mechanism of the intermetallic compounds: YAg, YCu and YRh

    International Nuclear Information System (INIS)

    Wu Yurong; Hu Wangyu; Han Shaochang

    2008-01-01

    First-principles calculations have been used to study the elastic and electronic properties of ductility rare-earth alloy YM (M=Ag, Cu, Rh) systems. The ductility mechanism for these alloys is studied from microscopic aspect, via electronic density of states (DOS). The Fermi energy lies near a local minimum, and the hybridization is stronger than that of the common NiAl alloy, demonstrating that the ductility of these alloys is much better than that of NiAl alloy. Elastic modulus, namely, shear modulus C'=(C 11 -C 12 )/2, bulk modulus B and C 44 are calculated by volume-conserving orthorhombic, hydrostatic pressure and tri-axial shear strain, respectively. Moreover, lattice parameters, antiphase boundary (APB) energies and unstable stacking fault energies of these alloys are also studied. The APB energies are greater than the unstable stacking fault energies for these alloy systems, and this is a characteristic of the ductility rare-earth alloy. The APB energies of YRh are the highest ones in these three YM alloys, which make dislocation dissociation difficult. The DOS and APB energy results show that the ductility of YRh may be worst in these three YM systems

  1. High Temperature Magneto-Elastic Instability of Dislocations in bcc Iron

    International Nuclear Information System (INIS)

    Dudarev, S.; Bullough, R.; Gilbert, M.; Derlet, P.

    2007-01-01

    Full text of publication follows: Density functional calculations show that the low temperature structure of self-interstitial defects in iron is fundamentally different from the structure of self-interstitial defects in all the other bcc metals. The origin of this anomaly is associated with the magnetic part of the cohesive energy of iron, where the Stoner exchange term stabilizes the body centred cubic phase, and where the magnetic part of energy is strongly affected by the large strain associated with the core region of an interstitial defect. At elevated temperatures magnetic excitations erode the stability of the bcc phase, giving rise to the gradual softening of the 110 transverse acoustic phonon modes and to the α-γ bcc-fcc martensitic phase transition occurring at 912 deg. C at normal pressure. Elastic moduli of bcc iron vary as a function of temperature with c' = (C 11 - c 12 )/2 vanishing at the α-γ transition point. This has significant effects on the magnitude of both the elastic interactions between dislocations and other defects in the material and on the intrinsic structural stability of the dislocations and other defects themselves. To evaluate structural stability of defects at elevated temperatures we investigate elastic self-energies of dislocations in the continuum anisotropic elasticity approximation. We also develop atomistic models of dislocations and point defects based on a generalised form of the magnetic potential. By varying the magnetic part of the potential we are able to reproduce the experimentally observed variation of elastic moduli as a function of temperature, and assess relative stability of various types of defect structures. Our analysis shows that, in complete contrast to other straight dislocations, the elastic self-energy of straight 100 edge dislocations actually sharply decreases as we approach the α-γ transition, indicating that this surprising fact is a probable explanation of the frequent observation of the 100

  2. Elastic properties of sub-stoichiometric nitrogen ion implanted silicon

    Energy Technology Data Exchange (ETDEWEB)

    Sarmanova, M.F., E-mail: marina.sarmanova@iom-leipzig.de [Leibniz Institute of Surface Modification, D-04318 Leipzig (Germany); Karl, H. [University Augsburg, Institute of Physics, D-86135 Augsburg (Germany); Mändl, S.; Hirsch, D. [Leibniz Institute of Surface Modification, D-04318 Leipzig (Germany); Mayr, S.G.; Rauschenbach, B. [Leibniz Institute of Surface Modification, D-04318 Leipzig (Germany); University Leipzig, Institute for Experimental Physics II, D-04103 Leipzig (Germany)

    2015-04-15

    Elastic properties of sub-stoichiometric nitrogen implanted silicon were measured with nanometer-resolution using contact resonance atomic force microscopy (CR-AFM) as function of ion fluence and post-annealing conditions. The determined range of indentation moduli was between 100 and 180 GPa depending on the annealing duration and nitrogen content. The high indentation moduli can be explained by formation of Si–N bonds, as verified by X-ray photoelectron spectroscopy.

  3. First-principles investigation of elastic anomalies in niobium at high pressure and temperature

    Science.gov (United States)

    Wang, Yi X.; Geng, Hua Y.; Wu, Q.; Chen, Xiang R.; Sun, Y.

    2017-12-01

    Niobium does not show any structure transition up to very high pressures. Nonetheless, by using density functional theory, we demonstrate in this work that it exhibits striking softening in elastic moduli C44 and C' at a pressure from 20 to 150 GPa. A novel anomaly softening in C44 from 275 to 400 GPa is also predicted. The physics behind these two anomalies is elaborated by electronic structure calculations, which revealed that they are actually different—first one directly relates to an underlying rhombohedral distortion whereas the latter originates in an electronic topological transition. The large magnitude of the softening leads to a remarkable elastic anisotropy in both the shear and the Young's moduli of Nb. Further investigation shows that thermo-electrons have an important role in these anomalies. This effect has not been noticed before. With increased electronic temperature, it is found that all anomalies (both the elastic softening and anisotropy) in Nb are gradually diminished, effectively giving rise to a temperature-induced hardening phenomenon.

  4. Molecular Modeling for Calculation of Mechanical Properties of Epoxies with Moisture Ingress

    Science.gov (United States)

    Clancy, Thomas C.; Frankland, Sarah J.; Hinkley, J. A.; Gates, T. S.

    2009-01-01

    Atomistic models of epoxy structures were built in order to assess the effect of crosslink degree, moisture content and temperature on the calculated properties of a typical representative generic epoxy. Each atomistic model had approximately 7000 atoms and was contained within a periodic boundary condition cell with edge lengths of about 4 nm. Four atomistic models were built with a range of crosslink degree and moisture content. Each of these structures was simulated at three temperatures: 300 K, 350 K, and 400 K. Elastic constants were calculated for these structures by monitoring the stress tensor as a function of applied strain deformations to the periodic boundary conditions. The mechanical properties showed reasonably consistent behavior with respect to these parameters. The moduli decreased with decreasing crosslink degree with increasing temperature. The moduli generally decreased with increasing moisture content, although this effect was not as consistent as that seen for temperature and crosslink degree.

  5. Elastic constants of the hard disc system in the self-consistent free volume approximation

    International Nuclear Information System (INIS)

    Wojciechowski, K.W.

    1990-09-01

    Elastic moduli of the two dimensional hard disc crystal are determined exactly within the Kirkwood self-consistent free volume approximation and compared with the Monte Carlo simulation results. (author). 22 refs, 1 fig., 1 tab

  6. Low moduli elastomers with low viscous dissipation

    DEFF Research Database (Denmark)

    Bejenariu, Anca Gabriela; Yu, Liyun; Skov, Anne Ladegaard

    2012-01-01

    A controlled reaction schema for addition curing silicones leads to both significantly lower elastic modulus and lower viscous dissipation than for the chemically identical network prepared by the traditional reaction schema....

  7. Moduli stabilisation for chiral global models

    International Nuclear Information System (INIS)

    Cicoli, Michele; Mayrhofer, Christoph; Valandro, Roberto

    2011-10-01

    We combine moduli stabilisation and (chiral) model building in a fully consistent global set-up in Type IIB/F-theory. We consider compactifications on Calabi-Yau orientifolds which admit an explicit description in terms of toric geometry. We build globally consistent compactifications with tadpole and Freed-Witten anomaly cancellation by choosing appropriate brane set-ups and world-volume fluxes which also give rise to SU(5)- or MSSM-like chiral models. We fix all the Kaehler moduli within the Kaehler cone and the regime of validity of the 4D effective field theory. This is achieved in a way compatible with the local presence of chirality. The hidden sector generating the non-perturbative effects is placed on a del Pezzo divisor that does not have any chiral intersections with any other brane. In general, the vanishing D-term condition implies the shrinking of the rigid divisor supporting the visible sector. However, we avoid this problem by generating r< n D-term conditions on a set of n intersecting divisors. The remaining (n-r) flat directions are fixed by perturbative corrections to the Kaehler potential. We illustrate our general claims in an explicit example. We consider a K3-fibred Calabi-Yau with four Kaehler moduli, that is an hypersurface in a toric ambient space and admits a simple F-theory up-lift. We present explicit choices of brane set-ups and fluxes which lead to three different phenomenological scenarios: the first with GUT-scale strings and TeV-scale SUSY by fine-tuning the background fluxes; the second with an exponentially large value of the volume and TeV-scale SUSY without fine-tuning the background fluxes; and the third with a very anisotropic configuration that leads to TeV-scale strings and two micron-sized extra dimensions. The K3 fibration structure of the Calabi-Yau three-fold is also particularly suitable for cosmological purposes. (orig.)

  8. Moduli stabilisation for chiral global models

    Energy Technology Data Exchange (ETDEWEB)

    Cicoli, Michele [Deutsches Elektronen-Synchrotron (DESY), Hamburg (Germany); Abdus Salam International Centre for Theoretical Physics, Trieste (Italy); Mayrhofer, Christoph [Heidelberg Univ. (Germany). Inst. fuer Theoretische Physik; Valandro, Roberto [Hamburg Univ. (Germany). 2. Inst. fuer Theoretische Physik

    2011-10-15

    We combine moduli stabilisation and (chiral) model building in a fully consistent global set-up in Type IIB/F-theory. We consider compactifications on Calabi-Yau orientifolds which admit an explicit description in terms of toric geometry. We build globally consistent compactifications with tadpole and Freed-Witten anomaly cancellation by choosing appropriate brane set-ups and world-volume fluxes which also give rise to SU(5)- or MSSM-like chiral models. We fix all the Kaehler moduli within the Kaehler cone and the regime of validity of the 4D effective field theory. This is achieved in a way compatible with the local presence of chirality. The hidden sector generating the non-perturbative effects is placed on a del Pezzo divisor that does not have any chiral intersections with any other brane. In general, the vanishing D-term condition implies the shrinking of the rigid divisor supporting the visible sector. However, we avoid this problem by generating rmoduli, that is an hypersurface in a toric ambient space and admits a simple F-theory up-lift. We present explicit choices of brane set-ups and fluxes which lead to three different phenomenological scenarios: the first with GUT-scale strings and TeV-scale SUSY by fine-tuning the background fluxes; the second with an exponentially large value of the volume and TeV-scale SUSY without fine-tuning the background fluxes; and the third with a very anisotropic configuration that leads to TeV-scale strings and two micron-sized extra dimensions. The K3 fibration structure of the Calabi-Yau three-fold is also particularly suitable for cosmological purposes. (orig.)

  9. GEO-MIX-SELF calculations of the elastic properties of a textured graphite sample at different hydrostatic pressures

    International Nuclear Information System (INIS)

    Matthies, Siegfried

    2012-01-01

    The recently developed GEO-MIX-SELF approximation (GMS) is applied to interpret the pressure dependence of the longitudinal ultrasonic wave velocities in a polycrystalline graphite sample that has already been investigated in a wide range of experimental contexts. Graphite single crystals have extremely anisotropic elastic properties, making this sample a challenging test to demonstrate the potential of the GMS method. GMS combines elements of well known self-consistent algorithms and of the geometric mean approximation. It is able to consider mixtures of different polycrystalline phases, each with its own nonspherical grain shape and preferred orientation (texture). Pores and 'cracks', typical for bulk graphite, are modeled as phases with 'empty' grains. The pressure dependence (up to 150 MPa) of the experimental wave velocities can be well explained using the known texture of the sample by fitting the shape parameters and volume fractions of the graphite grains, cracks and spherical pores. The pressure dependence of these parameters describes a reasonable scenario for the closing of the cracks and pores with increasing pressure. (orig.)

  10. Elastic interaction of partially debonded circular inclusions. II. Application to fibrous composite

    DEFF Research Database (Denmark)

    Kushch, V.I.; Shmegera, S.V.; Mishnaevsky, Leon

    2011-01-01

    have been solved to check an accuracy and numerical efficiency of the method. An effect of interface crack density on the effective elastic moduli of periodic and random structure FRC with interface damage has been evaluated. The developed approach provides a detailed analysis of the progressive...... debonding phenomenon including the interface cracks cluster formation, overall stiffness reduction and damage-induced anisotropy of the effective elastic moduli of composite....

  11. Moduli of Parabolic Higgs Bundles and Atiyah Algebroids

    DEFF Research Database (Denmark)

    Logares, Marina; Martens, Johan

    2010-01-01

    In this paper we study the geometry of the moduli space of (non-strongly) parabolic Higgs bundles over a Riemann surface with marked points. We show that this space possesses a Poisson structure, extending the one on the dual of an Atiyah algebroid over the moduli space of parabolic vector bundle...

  12. The universal connection and metrics on moduli spaces

    International Nuclear Information System (INIS)

    Massamba, Fortune; Thompson, George

    2003-11-01

    We introduce a class of metrics on gauge theoretic moduli spaces. These metrics are made out of the universal matrix that appears in the universal connection construction of M. S. Narasimhan and S. Ramanan. As an example we construct metrics on the c 2 = 1 SU(2) moduli space of instantons on R 4 for various universal matrices. (author)

  13. Mirror symmetry and the moduli space for generic hypersurfaces in toric varieties

    CERN Document Server

    Berglund, P; Klemm, A D

    1995-01-01

    The moduli dependence of (2,2) superstring compactifications based on Calabi--Yau hypersurfaces in weighted projective space has so far only been investigated for Fermat-type polynomial constraints. These correspond to Landau-Ginzburg orbifolds with c=9 whose potential is a sum of A-type singularities. Here we consider the generalization to arbitrary quasi-homogeneous singularities at c=9. We use mirror symmetry to derive the dependence of the models on the complexified K\\"ahler moduli and check the expansions of some topological correlation functions against explicit genus zero and genus one instanton calculations. As an important application we give examples of how non-algebraic (``twisted'') deformations can be mapped to algebraic ones, hence allowing us to study the full moduli space. We also study how moduli spaces can be nested in each other, thus enabling a (singular) transition from one theory to another. Following the recent work of Greene, Morrison and Strominger we show that this corresponds to bla...

  14. Structure of 14C via elastic and inelastic neutron scattering from 13C: Measurement, R-matrix analysis, and shell model calculations

    International Nuclear Information System (INIS)

    Resler, D.A.

    1987-03-01

    The specific purpose of this work is to provide a better understanding of the 14 C level structure; the general purpose is to provide the details for using shell model calculations in R-matrix analyses. Using the TOF facilities of the Ohio University Accelerator Laboratory, the elastic and first 3 inelastic differential scattering cross sections for 13 C + n were measured at 69 energies for 4.5 ≤ E/sub n/ ≤ 11 MeV. A multiple scattering code was developed which provided a simulation of the experimental scattering process allowing accurate corrections to the small inelastic data. The integrated 13 C(n,α) 10 Be cross section is estimated. The sequential 2n-decay of 14 C states populated by 13 C + n was observed. A shell model code was developed. Normal and nonnormal parity calculations were made for the lithium isotopes using a new two-body interaction. The results for 5 Li predict the 2s/sub 1/2/ and 1d/sub 5/2/ single-particle states to be located below the 3/2 + state. Similar calculations were made for 13 C, 13 N, and 14 C. Results for 13 C and 13 N show for E/sub x/ 7 Li and 14 C, 2 h-barω calculations were done. Shell model calculations generated the R-matrix parameters for the elastic and first 3 inelastic channels of 13 C + n. After adjusting some energies, the predicted structure generally agrees with experiment for E/sub n/ 13 C + n data were refit to replace R 0 background terms by more realistic broad states and to get better agreement with model calculations. R-matrix fitting of the full data set produced new 14 C level information. For E/sub n/ > 4 MeV (E/sub x/ > 12 MeV), 5 states are given definite J/sup π/ assignments; 3, tentative assignments. 122 refs., 91 figs., 30 tabs

  15. Metastable SUSY breaking, de Sitter moduli stabilisation and Kaehler moduli inflation

    International Nuclear Information System (INIS)

    Krippendorf, Sven; Quevedo, Fernando

    2009-01-01

    We study the influence of anomalous U(1) symmetries and their associated D-terms on the vacuum structure of global field theories once they are coupled to N = 1 supergravity and in the context of string compactifications with moduli stabilisation. In particular, we focus on a IIB string motivated construction of the ISS scenario and examine the influence of one additional U(1) symmetry on the vacuum structure. We point out that in the simplest one-Kaehler modulus compactification, the original ISS vacuum gets generically destabilised by a runaway behaviour of the potential in the modulus direction. In more general compactifications with several Kaehler moduli, we find a novel realisation of the LARGE volume scenario with D-term uplifting to de Sitter space and both D-term and F-term supersymmetry breaking. The structure of soft supersymmetry breaking terms is determined in the preferred scenario where the standard model cycle is not stabilised non-perturbatively and found to be flavour universal. Our scenario also provides a purely supersymmetric realisation of Kaehler moduli (blow-up and fibre) inflation, with similar observational properties as the original proposals but without the need to include an extra (non-SUSY) uplifting term.

  16. Two-Sided Estimates of Thermo-elastic Characteristics of Dispersed Inclusion Composites

    Directory of Open Access Journals (Sweden)

    V. S. Zarubin

    2015-01-01

    Full Text Available The composites, dispersion-reinforced with inclusions from high-strength and high-modulus materials are widely used in technology. Nanostructure elements can perform the role of such inclusions as well. Possible applications of such composites in heat-stressed structures under heavy mechanical and thermal influences significantly depend on a complex of thermo-mechanical characteristics including the values of the moduli of elasticity and coefficient of linear thermal expansion. There are different approaches to construction of mathematical models that allow calculating dependences to estimate elastic characteristics of composites. Relation between thermoelastic properties of matrix and inclusions of the composite with its temperature coefficient of linear expansion is studied in less detail. Thus, attention has been insufficient in estimating a degree of reliability and a possible error of derived dependencies.A dual variation formulation of the problem of thermo-elasticity in a non-uniform solids simulating the properties and structure of the composite with dispersed inclusions, makes it possible to define two-sided limits of possible values of the volume elasticity modulus, shear modulus, and coefficient of linear thermal expansion of such composite. These limits allow us to estimate the maximum possible error, if to take a half-sum of the limit values of these parameters as the thermoelastic characteristics of the composite. Implementing this approach to find possible errors, arising when using one or another calculating dependency, improves reliability of predicted thermo-elastic characteristics as applied to existing and promising composites.

  17. Close coupling calculations of magnetic transitions for He + H/sub 2/ in an uncoupled space frame. [Cross sections, T matrices, orbital angular momentum, elastic and inelastic transistors

    Energy Technology Data Exchange (ETDEWEB)

    Shimoni, Y; Kouri, D J; Kumar, A [Houston Univ., Tex. (USA). Dept. of Physics

    1977-12-01

    Full close coupling calculations of magnetic transitions in He + H/sub 2/ collisions are reported. The results are analyzed using the coupling space frame approach of Kouri and Shimoni. This enables one to study the magnetic transition T-matrices as a function of orbital angular momentum number l. The results for transitions which are elastic in rotor state j are found to be dominated by j/sub z/-conserving transitions. Those which are inelastic in j are dominated by j/sub z/-conserving transitions for very low l but at higher l values, the non-j/sub z/-conserving transitions dominate. The results for He + H/sub 2/ are consistent with the recent studies of Shimoni and Kouri of the coupled states approximation.

  18. A first principle study of the pressure dependent elastic properties of monazite LaPO{sub 4}

    Energy Technology Data Exchange (ETDEWEB)

    Ali, Kawsar, E-mail: ali.ksr71@gmail.com; Arya, A.; Ghosh, P. S.; Dey, G. K. [Material Science Division, Bhabha Atomic Research centre, Mumbai 400085 (India)

    2016-05-06

    DFT based ab-initio simulations have been performed to study the effect of pressure on the elastic properties of monazite LaPO{sub 4} which is a promising host material for immobilization of high level nuclear waste. The phase is found to be stable up to 30 GPa. The calculated polycrystalline bulk, shear and Young moduli show an increasing trend as a function of pressure. The ductility and anisotropy in shear modulus of the material have been found to increase with pressure; whilethe bulk modulus anisotropy decreases with pressure.

  19. Anomalous elasticity, fluctuations and disorder in elastic membranes

    Science.gov (United States)

    Le Doussal, Pierre; Radzihovsky, Leo

    2018-05-01

    Motivated by freely suspended graphene and polymerized membranes in soft and biological matter we present a detailed study of a tensionless elastic sheet in the presence of thermal fluctuations and quenched disorder. The manuscript is based on an extensive draft dating back to 1993, that was circulated privately. It presents the general theoretical framework and calculational details of numerous results, partial forms of which have been published in brief Letters (Le Doussal and Radzihovsky, 1992; 1993). The experimental realization atom-thin graphene sheets (Novoselov et al., 2004) have driven a resurgence in this fascinating subject, making our dated predictions and their detailed derivations timely. To this end we analyze the statistical mechanics of a generalized D-dimensional elastic "membrane" embedded in d dimensions using a self-consistent screening approximation (SCSA), that has proved to be unprecedentedly accurate in this system, exact in three complementary limits: (i) d → ∞, (ii) D → 4, and (iii) D = d. Focusing on the critical "flat" phase, for a homogeneous two-dimensional (D = 2) membrane embedded in three dimensions (d = 3), we predict its universal roughness exponent ζ = 0 . 590, length-scale dependent elastic moduli exponents η = 0 . 821 and ηu = 0 . 358, and an anomalous Poisson ratio, σ = - 1 / 3. In the presence of random uncorrelated heterogeneity the membrane exhibits a glassy wrinkled ground state, characterized by ζ‧ = 0 . 775 ,η‧ = 0 . 449, ηu‧ = 1 . 101 and a Poisson ratio σ‧ = - 1 / 3. Motivated by a number of physical realizations (charged impurities, disclinations and dislocations) we also study power-law correlated quenched disorder that leads to a variety of distinct glassy wrinkled phases. Finally, neglecting self-avoiding interaction we demonstrate that at high temperature a "phantom" sheet undergoes a continuous crumpling transition, characterized by a radius of gyration exponent, ν = 0 . 732 and η = 0

  20. Calculation of the RPA response function of nuclei to quasi-elastic electron scattering with a density-dependent NN interaction

    International Nuclear Information System (INIS)

    Caillon, J-C.; Labarsouque, J.

    1997-01-01

    So far, the non-relativistic longitudinal and transverse functions in electron quasi-elastic scattering on the nuclei failed in reproducing satisfactorily the existent experimental data. The calculations including relativistic RPA correlations utilize until now the relativistic Hartree approximation to describe the nuclear matter. But, this provides an incompressibility module two times higher than its experimental value what is an important drawback for the calculation of realistic relativistic RPA correlations. Hence, we have determined the RPA response functions of nuclei by utilising a description of the relativistic nuclear matter leading to an incompressibility module in agreement with the empirical value. To do that we have utilized an interaction in the relativistic Hartree approximation in which we have determined the coupling constants σ-N and ω-N as a function of the density in order to reproduce the saturation curve obtained by a Dirac-Brueckner calculation. The results which we have obtained show that the longitudinal response function and the Coulomb sum generally overestimated when one utilizes the pure relativistic Hartree approximation, are here in good agreement with the experimental data for several nuclei

  1. Moduli of Riemann surfaces, transcendental aspects

    International Nuclear Information System (INIS)

    Hain, R.

    2000-01-01

    These notes are an informal introduction to moduli spaces of compact Riemann surfaces via complex analysis, topology and Hodge Theory. The prerequisites for the first lecture are just basic complex variables, basic Riemann surface theory up to at least the Riemann-Roch formula, and some algebraic topology, especially covering space theory. The first lecture covers moduli in genus 0 and genus 1 as these can be understood using relatively elementary methods, but illustrate many of the points which arise in higher genus. The notes cover more material than was covered in the lectures, and sometimes the order of topics in the notes differs from that in the lectures. We have seen in genus 1 case that M 1 is the quotient Γ 1 /X 1 of a contractible complex manifold X 1 = H by a discrete group Γ 1 = SL 2 (Z). The action of Γ 1 on X 1 is said to be virtually free - that is, Γ 1 has a finite index subgroup which acts (fixed point) freely on X 1 . In this section we will generalize this to all g >= 1 - we will sketch a proof that there is a contractible complex manifold Xg, called Teichmueller space, and a group Γ g , called the mapping class group, which acts virtually freely on X g . The moduli space of genus g compact Riemann surfaces is the quotient: M g = Γ g /X g . This will imply that M g has the structure of a complex analytic variety with finite quotient singularities. Teichmueller theory is a difficult and technical subject. Because of this, it is only possible to give an overview. In this lecture, we compute the orbifold Picard group of M g for all g >= 1. Recall that an orbifold line bundle over M g is a holomorphic line bundle L over Teichmueller space X g together with an action of the mapping class group Γ g on it such that the projection L → X g is Γ g -equivariant. An orbifold section of this line bundle is a holomorphic Γ g -equivariant section X g → L of L. This is easily seen to be equivalent to fixing a level l>= 3 and considering holomorphic

  2. Elastic, thermal and high pressure structural properties of heavy rare earth antimonides

    International Nuclear Information System (INIS)

    Soni, P.; Pagare, G.; Sanyal, S.P.

    2009-01-01

    Pressure induced structural phase transition of two heavy rare earth antimonides (RESb; RE=Ho, Er) have been studied theoretically by using an inter-ionic potential theory. This method has been found quite satisfactory in the case of pnictides of rare earth and describes the crystal properties in the framework of rigid-ion modal. The long-range Coulomb interaction, short-range repulsive interaction and van der Waals (vdW) interactions are properly incorporated in this theory. These compounds exhibit first order crystallographic phase transition from their NaCl-type structure to CsCl-type structure at 27 GPa and 33.2 GPa, respectively. The bulk moduli of RESb compounds are compared with the experimental values of elastic constants. We have also calculated the Debye temperature by incorporating the elastic constants for both the rare earth antimonides. (author)

  3. Structural, phase stability, electronic, elastic properties and hardness of IrN{sub 2} and zinc blende IrN: First-principles calculations

    Energy Technology Data Exchange (ETDEWEB)

    Zhou, Zhaobo [Key Laboratory of Advanced Materials of Yunnan Province & Key Laboratory of Advanced Materials of Non-Ferrous and Precious Rare Metals Ministry of Education, Kunming University of Science and Technology, Kunming 650093 (China); Zhou, Xiaolong, E-mail: kmzxlong@163.com [Key Laboratory of Advanced Materials of Yunnan Province & Key Laboratory of Advanced Materials of Non-Ferrous and Precious Rare Metals Ministry of Education, Kunming University of Science and Technology, Kunming 650093 (China); Zhang, Kunhua [State Key Laboratory of Rare Precious Metals Comprehensive Utilization of New Technologies, Kunming Institute of Precious Metals, Kunming 650106 (China)

    2016-12-15

    First-principle calculations were performed to investigate the structural, phase stability, electronic, elastic properties and hardness of monoclinic structure IrN{sub 2} (m-IrN{sub 2}), orthorhombic structure IrN{sub 2} (o-IrN{sub 2}) and zinc blende structure IrN (ZB IrN). The results show us that only m-IrN{sub 2} is both thermodynamic and dynamic stability. The calculated band structure and density of states (DOS) curves indicate that o-IrN{sub 2} and ZB Ir-N compounds we calculated have metallic behavior while m-IrN{sub 2} has a small band gap of ~0.3 eV, and exist a common hybridization between Ir-5d and N-2p states, which forming covalent bonding between Ir and N atoms. The difference charge density reveals the electron transfer from Ir atom to N atom for three Ir-N compounds, which forming strong directional covalent bonds. Notable, a strong N-N bond appeared in m-IrN{sub 2} and o-IrN{sub 2}. The ratio of bulk to shear modulus (B/G) indicate that three Ir-N compounds we calculated are ductile, and ZB IrN possesses a better ductility than two types IrN{sub 2}. m-IrN{sub 2} has highest Debye temperature (736 K), illustrating it possesses strongest covalent bonding. The hardness of three Ir-N compounds were also calculated, and the results reveal that m-IrN{sub 2} (18.23 GPa) and o-IrN{sub 2} (18.02 GPa) are ultraincompressible while ZB IrN has a negative value, which may be attributed to phase transition at ca. 1.98 GPa.

  4. Moduli stabilization in higher dimensional brane models

    International Nuclear Information System (INIS)

    Flachi, Antonino; Pujolas, Oriol; Garriga, Jaume; Tanaka, Takahiro

    2003-01-01

    We consider a class of warped higher dimensional brane models with topology M x Σ x S 1 /Z 2 , where Σ is a D2 dimensional manifold. Two branes of co-dimension one are embedded in such a bulk space-time and sit at the orbifold fixed points. We concentrate on the case where an exponential warp factor (depending on the distance along the orbifold) accompanies the Minkowski M and the internal space Σ line elements. We evaluate the moduli effective potential induced by bulk scalar fields in these models, and we show that generically this can stabilize the size of the extra dimensions. As an application, we consider a scenario where supersymmetry is broken not far below the cutoff scale, and the hierarchy between the electroweak and the effective Planck scales is generated by a combination of redshift and large volume effects. The latter is efficient due to the shrinking of Σ at the negative tension brane, where matter is placed. In this case, we find that the effective potential can stabilize the size of the extra dimensions (and the hierarchy) without fine tuning, provided that the internal space Σ is flat. (author)

  5. Moduli stabilization in higher dimensional brane models

    Energy Technology Data Exchange (ETDEWEB)

    Flachi, Antonino; Pujolas, Oriol [IFAE, Campus UAB, 08193 Bellaterra, Barcelona (Spain)]. E-mail: pujolas@ifae.es; Garriga, Jaume [IFAE, Campus UAB, 08193 Bellaterra, Barcelona (Spain); Departament de Fisica Fonamental and C.E.R. en Astrofisica, Fisica de Particules i Cosmologia Universitat de Barcelona, Marti i Franques 1, 08028 Barcelona (Spain); Tanaka, Takahiro [Institute of Cosmology, Department of Physics and Astronomy, Tufts University, Medford MA 02155 (United States); Yukawa Institute for Theoretical Physics, Kyoto University, Kyoto 606-8502 (Japan)

    2003-08-01

    We consider a class of warped higher dimensional brane models with topology M x {sigma} x S{sup 1}/Z{sub 2}, where {sigma} is a D2 dimensional manifold. Two branes of co-dimension one are embedded in such a bulk space-time and sit at the orbifold fixed points. We concentrate on the case where an exponential warp factor (depending on the distance along the orbifold) accompanies the Minkowski M and the internal space {sigma} line elements. We evaluate the moduli effective potential induced by bulk scalar fields in these models, and we show that generically this can stabilize the size of the extra dimensions. As an application, we consider a scenario where supersymmetry is broken not far below the cutoff scale, and the hierarchy between the electroweak and the effective Planck scales is generated by a combination of redshift and large volume effects. The latter is efficient due to the shrinking of {sigma} at the negative tension brane, where matter is placed. In this case, we find that the effective potential can stabilize the size of the extra dimensions (and the hierarchy) without fine tuning, provided that the internal space {sigma} is flat. (author)

  6. Higher-Derivative Supergravity and Moduli Stabilization

    International Nuclear Information System (INIS)

    Ciupke, David; Westphal, Alexander; Louis, Jan; Hamburg Univ.

    2015-05-01

    We review the ghost-free four-derivative terms for chiral superfields in N=1 supersymmetry and supergravity. These terms induce cubic polynomial equations of motion for the chiral auxiliary fields and correct the scalar potential. We discuss the different solutions and argue that only one of them is consistent with the principles of effective field theory. Special attention is paid to the corrections along flat directions which can be stabilized or destabilized by the higher-derivative terms. We then compute these higher-derivative terms explicitly for the type IIB string compactified on a Calabi-Yau orientifold with fluxes via Kaluza-Klein reducing the (α') 3 R 4 corrections in ten dimensions for the respective N=1 Kaehler moduli sector. We prove that together with flux and the known (α') 3 -corrections the higher-derivative term stabilizes all Calabi-Yau manifolds with positive Euler number, provided the sign of the new correction is negative.

  7. Explicitly broken supersymmetry with exactly massless moduli

    Energy Technology Data Exchange (ETDEWEB)

    Dong, Xi [Stanford Institute for Theoretical Physics, Department of Physics, Stanford University,Stanford, CA 94305 (United States); Freedman, Daniel Z. [Stanford Institute for Theoretical Physics, Department of Physics, Stanford University,Stanford, CA 94305 (United States); Center for Theoretical Physics and Department of Mathematics,Massachusetts Institute of Technology,Cambridge, MA 02139 (United States); Zhao, Yue [Stanford Institute for Theoretical Physics, Department of Physics, Stanford University,Stanford, CA 94305 (United States)

    2016-06-16

    The AdS/CFT correspondence is applied to an analogue of the little hierarchy problem in three-dimensional supersymmetric theories. The bulk is governed by a supergravity theory in which a U(1) × U(1) R-symmetry is gauged by Chern-Simons fields. The bulk theory is deformed by a boundary term quadratic in the gauge fields. It breaks SUSY completely and sources an exactly marginal operator in the dual CFT. SUSY breaking is communicated by gauge interactions to bulk scalar fields and their spinor superpartners. The bulk-to-boundary propagator of the Chern-Simons fields is a total derivative with respect to the bulk coordinates. Integration by parts and the Ward identity permit evaluation of SUSY breaking effects to all orders in the strength of the deformation. The R-charges of scalars and spinors differ so large SUSY breaking mass shifts are generated. Masses of R-neutral particles such as scalar moduli are not shifted to any order in the deformation strength, despite the fact that they may couple to R-charged fields running in loops. We also obtain a universal deformation formula for correlation functions under an exactly marginal deformation by a product of holomorphic and anti-holomorphic U(1) currents.

  8. Young's moduli of cables for high field superconductive dipole magnet

    International Nuclear Information System (INIS)

    Yamada, Shunji; Shintomi, Takakazu.

    1983-01-01

    Superconductive dipole magnets for big accelerators are subjected to enormous electro-magnetic force, when they are operated with high field such as 10 Tesla. They should be constructed by means of superconductive cables, which have high Young's modulus, to obtain good performance. To develop such cables we measured the Young's moduli of cables for practical use of accelerator magnets. They are monolithic and compacted strand cables. We measured also Young's moduli of monolithic copper and brass cables for comparison. The obtained data showed the Young's moduli of 35 and 15 GPa for the monolithic and compacted strand cables, respectively. (author)

  9. Higgs, moduli problem, baryogenesis and large volume compactifications

    International Nuclear Information System (INIS)

    Higaki, Tetsutaro; Takahashi, Fuminobu

    2012-07-01

    We consider the cosmological moduli problem in the context of high-scale supersymmetry breaking suggested by the recent discovery of the standard-model like Higgs boson. In order to solve the notorious moduli-induced gravitino problem, we focus on the LARGE volume scenario, in which the modulus decay into gravitinos can be kinematically forbidden. We then consider the Affleck-Dine mechanism with or without an enhanced coupling with the inflaton, taking account of possible Q-ball formation. We show that the baryon asymmetry of the present Universe can be generated by the Affleck-Dine mechanism in LARGE volume scenario, solving the moduli and gravitino problems.

  10. Higgs, moduli problem, baryogenesis and large volume compactifications

    Energy Technology Data Exchange (ETDEWEB)

    Higaki, Tetsutaro [RIKEN Nishina Center, Saitama (Japan). Mathematical Physics Lab.; Kamada, Kohei [Deutsches Elektronen-Synchrotron (DESY), Hamburg (Germany); Takahashi, Fuminobu [Tohoku Univ., Sendai (Japan). Dept. of Physics

    2012-07-15

    We consider the cosmological moduli problem in the context of high-scale supersymmetry breaking suggested by the recent discovery of the standard-model like Higgs boson. In order to solve the notorious moduli-induced gravitino problem, we focus on the LARGE volume scenario, in which the modulus decay into gravitinos can be kinematically forbidden. We then consider the Affleck-Dine mechanism with or without an enhanced coupling with the inflaton, taking account of possible Q-ball formation. We show that the baryon asymmetry of the present Universe can be generated by the Affleck-Dine mechanism in LARGE volume scenario, solving the moduli and gravitino problems.

  11. Ab initio study of the elastic properties of sodium chloride at high pressure

    International Nuclear Information System (INIS)

    Liu Lei; Bi Yan; Xu Jian; Chen Xiangrong

    2010-01-01

    The equation of state and elastic properties for B1- and B2-NaCl up to 160 GPa have been studied by using the density functional simulation within the generalized gradient approximation (GGA). The calculated lattice constants of NaCl agree well with experimental values in a precision of 0.1% over the pressure range studied. It is found that the cell volume decreases 5.5% at the phase transition point. All three independent elastic stiffness coefficients, c 11 , c 12 and c 44 for B1- and B2-NaCl are evaluated by a calculated stress tensor which was generated by forcing small strain to the optimized unit cell. The calculated zero-pressure elastic moduli, wave velocities, and their initial pressure dependences of B1-NaCl are in excellent agreement with experiments. Systematic investigation on the elasticity of NaCl has been done through four parameters, the Zener anisotropy ratio (A Z ), the acoustic anisotropy factor (A a ), the Cauchy deviation (δ), and the normalized elastic constants (c ij '). With the pressure, the Zener anisotropy ratio A Z decreases in the B1-phase, but increases in the B2-phase and reaches 1 at about 174 GPa, it suggests that NaCl would become elastic isotropic at this pressure range. The acoustic anisotropy factor A a shows the similar pressure behavior as A Z . The Cauchy deviation (δ)) increases with pressures, it demonstrates that in the interatomic interaction, the many-body contribution becomes more important at higher pressures. A discussion on the normalized elastic constants is also presented.

  12. First–principle calculation of the elastic, band structure, electronic states, and optical properties of Cu–doped ZnS nanolayers

    Energy Technology Data Exchange (ETDEWEB)

    Lahiji, Mohammadreza Askaripour, E-mail: m.a.lahijiii@gmail.com [Department of applied mathematics, Astaneh Ashrafieh Branch, Islamic Azad University, Astaneh Ashrafieh (Iran, Islamic Republic of); Ziabari, Ali Abdolahzadeh, E-mail: ali.abd.ziabari@gmail.com [Nano Research Lab, Lahijan Branch, Islamic Azad University, P.O. Box: 1616, Lahijan (Iran, Islamic Republic of)

    2016-11-15

    The structural, elastic, electronic, and optical properties of undoped and Cu–doped ZnS nanostructured layers have been studied in the zincblende (ZB) phase, by first–principle approach. Density functional theory (DFT) has been employed to calculate the fundamental properties of the layers using full–potential linearized augmented plane–wave (FPLAPW) method. Mechanical analysis revealed that the bulk modulus increases with the increase of Cu content. Cu doping was found to reduce the band gap value of the material. In addition, DOS effective mass of the electrons and heavy holes was evaluated. Adding Cu caused the decrement/increment of transmission/reflectance of nanolayers in the UV–vis region. The substitution by Cu increased the intensity of the peaks, and a slight red shift was observed in the absorption peak. Moreover, the static dielectric constant, and static refractive index increased with Cu content. The optical conductivity also followed a similar trend to that of the dielectric constants. Energy loss function of the modeled compounds was also evaluated. All calculated parameters were compared with the available experimental and other theoretical results.

  13. Revisiting elastic anisotropy of biotite gneiss from the Outokumpu scientific drill hole based on new texture measurements and texture-based velocity calculations

    Science.gov (United States)

    Wenk, H.-R.; Vasin, R. N.; Kern, H.; Matthies, S.; Vogel, S. C.; Ivankina, T. I.

    2012-10-01

    A sample of biotite gneiss from the Outokumpu deep drilling project in Finland was investigated by Kern et al. (2008) for crystal preferred orientation and elastic anisotropy. Considerable differences between measured acoustic velocities and velocities calculated on the basis of texture patterns were observed. Measured P-wave anisotropy was 15.1% versus a Voigt average yielding 7.9%. Here we investigate the same sample with different methods and using different averaging techniques. Analyzing time-of-flight neutron diffraction data from Dubna-SKAT and LANSCE-HIPPO diffractometers with the Rietveld technique, much stronger preferred orientation for biotite is determined, compared to conventional pole-figure analysis reported previously. The comparison reveals important differences: HIPPO has much better counting statistics but pole figure coverage is poor. SKAT has better angular resolution. Using the new preferred orientation data and applying a self-consistent averaging method that takes grain shapes into account, close agreement of calculated and measured P-wave velocities is observed (12.6%). This is further improved by adding 0.1 vol.% flat micropores parallel to the biotite platelets in the simulation (14.9%).

  14. Elastic Properties of Synthetic Pyrope (Mg3Al2Si3O12) to 9 GPa and 1000°C

    Science.gov (United States)

    Gwanmesia, G. D.; Zhang, J.; Li, B.; Darling, K.; Kung, J.; Neuville, D.; Raterron, P.; Sullivan, S.; Liebermann, R. C.

    2003-04-01

    We have measured the elastic wave velocities of polycrystalline pyrope (Mg_3Al_2Si_3O12) to 9 GPa and 1000^oC by ultrasonic interferometry, combined with in-situ synchrotron x-ray diffraction and imaging techniques. Fine-grained polycrystalline specimens (99.5% of theoretical density) were hot-pressed from a homogeneous glass starting material in the USSA-2000 apparatus at Stony Brook; the physical properties of the recovered specimens were characterized with density measurements, x-ray diffraction and transmission electron microscopy. Bench-top elastic wave velocities were in excellent agreement with the isotropic averages calculated from single-crystal elastic moduli of Leitner et al. (1980) by the Hashin-Shtrikman method. Travel times of acoustic compressional (P) and shear (S) waves, specimen lengths and PVT equations of state for the specimen and a NaCl standard were measured to 9 GPa and 1000^oC in a DIA-type high pressure apparatus (SAM-85), installed on the superconducting wiggler beamline (X17B) at the National Synchrotron Light Source of the Brookhaven National Laboratory. These data enabled us to determine the pressure and temperature derivatives of the elastic wave velocities and moduli for isotropic pyrope. We compare our new values with those of previous investigators and discuss the implications of these data for interpreting the seismic velocity gradients in the transition zone of the Earth's mantle.

  15. Successfully combining SUGRA hybrid inflation and moduli stabilisation

    International Nuclear Information System (INIS)

    Davis, S.C.

    2008-01-01

    Inflation and moduli stabilisation mechanisms work well independently, and many string-motivated supergravitymodels have been proposed for them. However a complete theory will contain both, and there will be (gravitational) interactions between the two sectors. These give corrections to the inflaton potential, which generically ruin inflation. This holds true even for fine-tuned moduli stabilisation schemes. We show that a viable combined model can be obtained if it is the Kaehler functions (G=K+ln vertical stroke W vertical stroke 2 ) of the two sectors that are added, rather than the superpotentials (as is usually done). Interaction between the two sectors does still impose some restrictions on the moduli stabilisation mechanism, which are derived. Significantly, we find that the (post-inflation) moduli stabilisation scale no longer needs to be above the inflationary energy scale. (orig.)

  16. Successfully combining SUGRA hybrid inflation and moduli stabilisation

    Energy Technology Data Exchange (ETDEWEB)

    Davis, S.C. [CEA Centre d' Etudes de Saclay, 91 - Gif-sur-Yvette (France). Service de Physique Theorique; Postma, M. [Deutsches Elektronen-Synchrotron (DESY), Hamburg (Germany)]|[Nationaal Inst. voor Kernfysica en Hoge-Energiefysica (NIKHEF), Amsterdam (Netherlands)

    2008-01-15

    Inflation and moduli stabilisation mechanisms work well independently, and many string-motivated supergravitymodels have been proposed for them. However a complete theory will contain both, and there will be (gravitational) interactions between the two sectors. These give corrections to the inflaton potential, which generically ruin inflation. This holds true even for fine-tuned moduli stabilisation schemes. We show that a viable combined model can be obtained if it is the Kaehler functions (G=K+ln vertical stroke W vertical stroke {sup 2}) of the two sectors that are added, rather than the superpotentials (as is usually done). Interaction between the two sectors does still impose some restrictions on the moduli stabilisation mechanism, which are derived. Significantly, we find that the (post-inflation) moduli stabilisation scale no longer needs to be above the inflationary energy scale. (orig.)

  17. Aspects of Moduli Stabilization in Type IIB String Theory

    Directory of Open Access Journals (Sweden)

    Shaaban Khalil

    2016-01-01

    Full Text Available We review moduli stabilization in type IIB string theory compactification with fluxes. We focus on KKLT and Large Volume Scenario (LVS. We show that the predicted soft SUSY breaking terms in KKLT model are not phenomenological viable. In LVS, the following result for scalar mass, gaugino mass, and trilinear term is obtained: m0=m1/2=-A0=m3/2, which may account for Higgs mass limit if m3/2~O(1.5 TeV. However, in this case, the relic abundance of the lightest neutralino cannot be consistent with the measured limits. We also study the cosmological consequences of moduli stabilization in both models. In particular, the associated inflation models such as racetrack inflation and Kähler inflation are analyzed. Finally, the problem of moduli destabilization and the effect of string moduli backreaction on the inflation models are discussed.

  18. Metastable SUSY Breaking, de Sitter Moduli Stabilisation and Kähler Moduli Inflation

    CERN Document Server

    Krippendorf, Sven

    2009-01-01

    We study the influence of anomalous U(1) symmetries and their associated D-terms on the vacuum structure of global field theories once they are coupled to N=1 supergravity and in the context of string compactifications with moduli stabilisation. In particular, we focus on a IIB string motivated construction of the ISS scenario and examine the influence of one additional U(1) symmetry on the vacuum structure. We point out that in the simplest one-Kahler modulus compactification, the original ISS vacuum gets generically destabilised by a runaway behaviour of the potential in the modulus direction. In more general compactifications with several Kahler moduli, we find a novel realisation of the LARGE volume scenario with D-term uplifting to de Sitter space and both D-term and F-term supersymmetry breaking. The structure of soft supersymmetry breaking terms is determined in the preferred scenario where the standard model cycle is not stabilised non-perturbatively and found to be flavour universal. Our scenario als...

  19. Evaluation of Procedures for Backcalculation of Airfield Pavement Moduli

    Science.gov (United States)

    2015-08-01

    ER D C/ G SL T R -1 5 -3 1 Evaluation of Procedures for Backcalculation of Airfield Pavement Moduli G eo te ch n ic al a n d S tr u...August 2015 Evaluation of Procedures for Backcalculation of Airfield Pavement Moduli Lucy P. Priddy and Carlos R. Gonzalez Geotechnical and...USAF’s) airfield pavement structural evaluation procedures. Determining the structural integrity of airfield pavement relies on the analysis of

  20. The stabilities, electronic structures and elastic properties of Rb—As systems

    International Nuclear Information System (INIS)

    Ozisik Havva Bogaz; Colakoglu Kemal; Deligoz Engin; Ozisik Haci

    2012-01-01

    The structural, electronic and elastic properties of Rb—As systems (RbAs in NaP, LiAs and AuCu structures, RbAs 2 in the MgCu 2 structure, Rb 3 As in Na 3 As, Cu 3 P and Li 3 Bi structures, and Rb 5 As 4 in the A 5 B 4 structure) are investigated with the generalized gradient approximation in the frame of density functional theory. The lattice parameters, cohesive energies, formation energies, bulk moduli and the first derivatives of the bulk moduli (to fit Murnaghan's equation of state) of the considered structures are calculated and reasonable agreement is obtained. In addition, the phase transition pressures are also predicted. The electronic band structures, the partial densities of states corresponding to the band structures and the charge density distributions are presented and analysed. The second-order elastic constants based on the stress-strain method and other related quantities such as Young's modulus, the shear modulus, Poisson's ratio, sound velocities, the Debye temperature and shear anisotropy factors are also estimated. (condensed matter: electronic structure, electrical, magnetic, and optical properties)

  1. A comparative study of the experimental and the theoretical elastic data of Tm{sup 3+} doped zinc borotellurite glass

    Energy Technology Data Exchange (ETDEWEB)

    Hasnimulyati, L. [Department of Physics, Faculty of Science, Universiti Putra Malaysia, 43400, UPM, Serdang, Selangor (Malaysia); Halimah, M.K., E-mail: halimahmk@upm.edu.my [Department of Physics, Faculty of Science, Universiti Putra Malaysia, 43400, UPM, Serdang, Selangor (Malaysia); Zakaria, A.; Halim, S.A. [Department of Physics, Faculty of Science, Universiti Putra Malaysia, 43400, UPM, Serdang, Selangor (Malaysia); Ishak, M. [Technical Support Division, Malaysian Institute for Nuclear Technology Research (MINT), Bangi, 43000 Kajang (Malaysia)

    2017-05-01

    A series of glass samples with composition {[(TeO_2)_0_._7(B_2O_3)_0_._3]_0_._7[ZnO]_0_._3}{sub 1-x}{Tm_2O_3}{sub x} was prepared by using the melt-quenching technique. Then, the samples were characterized by using the densimeter, FTIR and ultrasound technique. The variations of density, molar volume, ultrasonic velocity, elastic moduli, and Poisson’s ratio were discussed and correlated with the composition of the glass samples and the FTIR spectra. It was found that the addition of thulium caused bridging and non-bridging oxygen to be formed at the same time due to the different effect that occur to tellurite and borate network as thulium is added. As thulium is varied from 1 until 3 mol%, bridging oxygens had been found to occur at a high rate and caused the ultrasonic velocity to increase. Nonetheless, when thulium oxide exceeded 3 mol%, non-bridging oxygens formed at a high rate. As a result, ultrasonic velocity was reduced. Furthermore, the values of elastic moduli (including bulk, shear, Young’s modulus, and Poisson’s ratio) were compared with the data that were calculated theoretically by using bulk compression, Makishima-Mackenzie, and Rocherulle models. - Highlights: • Bridging and non-bridging oxygen produced concurrently with the addition of Tm{sub 2}O{sub 3}. • All elastic moduli are increase with the increment of thulium oxide. • The three theoretical models are found invalid to be used in this study.

  2. Nonlocal elasticity tensors in dislocation and disclination cores

    International Nuclear Information System (INIS)

    Taupin, V.; Gbemou, K.; Fressengeas, C.; Capolungo, L.

    2017-01-01

    We introduced nonlocal elastic constitutive laws for crystals containing defects such as dislocations and disclinations. Additionally, the pointwise elastic moduli tensors adequately reflect the elastic response of defect-free regions by relating stresses to strains and couple-stresses to curvatures, elastic cross-moduli tensors relating strains to couple-stresses and curvatures to stresses within convolution integrals are derived from a nonlocal analysis of strains and curvatures in the defects cores. Sufficient conditions are derived for positive-definiteness of the resulting free energy, and stability of elastic solutions is ensured. The elastic stress/couple stress fields associated with prescribed dislocation/disclination density distributions and solving the momentum and moment of momentum balance equations in periodic media are determined by using a Fast Fourier Transform spectral method. Here, the convoluted cross-moduli bring the following results: (i) Nonlocal stresses and couple stresses oppose their local counterparts in the defects core regions, playing the role of restoring forces and possibly ensuring spatio-temporal stability of the simulated defects, (ii) The couple stress fields are strongly affected by nonlocality. Such effects favor the stability of the simulated grain boundaries and allow investigating their elastic interactions with extrinsic defects, (iii) Driving forces inducing grain growth or refinement derive from the self-stress and couple stress fields of grain boundaries in nanocrystalline configurations.

  3. Large magnetic coils-design accompanying calculation and optimization. Regarding orthotropic interlayers, temperature and elastic supports-derivation of a special finite element

    International Nuclear Information System (INIS)

    Stelzer, J.F.; Sievers, A.; Welzel, R.

    1976-10-01

    This paper deals with finite element calculations of large coils as they are used as main coils in Tokamaks. They consist of copper layers with glass fibre reinforced resin interlayers inbedded in a strong steel ring. In a first analysis model the several epoxy layers are condensed to only one the tickness of which is equal to the sum of the single sizes. This fictitious layer is assumed to lie in the middle of the copper and is treated as an orthotropic material. In a following changed model the epoxy layer is situated between the steel ring and the copper. In this location the epoxy was suspected to suffer from the highest shear stresses. Both models employ springy trusses as supporting features which simulate the real elastic behaviour of a sustaining vault. Special attentions are given a) to the shear stresses in the epoxy, b) to the hot and cold states of the coils, and c) to the forces transferred from the coils to the sustaining vault. An optimal structure design is carried out concerning the steel ring. (orig./GG) [de

  4. Electronic, elastic, acoustic and optical properties of cubic TiO2: A DFT approach

    International Nuclear Information System (INIS)

    Mahmood, Tariq; Cao, Chuanbao; Tahir, Muhammad; Idrees, Faryal; Ahmed, Maqsood; Tanveer, M.; Aslam, Imran; Usman, Zahid; Ali, Zulfiqar; Hussain, Sajad

    2013-01-01

    The electronic, elastic, acoustic and optical properties of cubic phases TiO 2 fluorite and pyrite are investigated using the first principles calculations. We have employed five different exchange–correlation functions within the local density and generalized gradient approximations using the ultrasoft plane wave pseudopotential method. The calculated band structures of cubic-TiO 2 elucidate that the TiO 2 fluorite and pyrite are direct and indirect semiconductors in contrast to the previous findings. From our studied properties such as bulk and shear moduli, elastic constants C 44 and Debye temperature for TiO 2 fluorite and pyrite, we infer that both the cubic phases are not superhard materials and the pyrite phase is harder than fluorite. The longitudinal and transversal acoustic wave speeds for both phases in the directions [100], [110] and [111] are determined using the pre-calculated elastic constants. In addition, we also calculate the optical properties such as dielectric function, absorption spectrum, refractive index and energy loss function using the pre-optimized structure. On the observation of optical properties TiO 2 fluorite phase turn out to be more photocatalytic than pyrite

  5. Computational study of structural, elastic and electronic properties of lithium disilicate (Li(2)Si(2)O(5)) glass-ceramic.

    Science.gov (United States)

    Biskri, Zine Elabidine; Rached, Habib; Bouchear, Merzoug; Rached, Djamel

    2014-04-01

    The objective of this study is to investigate theoretically the structural, elastic and electronic properties of Lithium Disilicate (LD) crystal (Li2Si2O5), using the pseudo potential method based on Density Functional Theory (DFT) with the Local Density Approximation (LDA) and the Generalized Gradient Approximation (GGA). The calculated structural properties namely the equilibrium lattice parameters and cell volume are in good agreement with the available experimental results. However, for the LD crystal elastic moduli: Shear modulus G, Young's modulus E and Poisson's ratio ν we have found a discrepancy between our theoretical values and experimental ones reported in polycrystalline sample containing LD crystals. The calculated elastic properties show that LD is more rigid compared with other components. We also investigated the mechanical stability of Li2Si2O5 compound and we have noticed that this compound is stable against elastic deformations. On the basis of shear to bulk modulus ratio analysis, we inferred that Li2Si2O5 compound is brittle in nature. In order to complete the fundamental characteristics of this compound we have measured the elastic anisotropy. Our results for the energy band structure and Density of States (DOS) show that Li2Si2O5 compound has an insulator characteristic. Copyright © 2013 Elsevier Ltd. All rights reserved.

  6. First-principles studies on the pressure dependences of the stress-strain relationship and elastic stability of semiconductors

    International Nuclear Information System (INIS)

    Wang, S Q; Ye, H Q; Yip, S

    2006-01-01

    We investigate the stress-strain relationship and elastic stability of zinc-blende GaP, GaN, InP and BN lattices under hydrostatic pressure by first-principles calculation. A simple and direct ab initio implementation for studying the mechanical properties of cubic crystals is developed. The four phases' full-set stress-strain coefficients in wide pressure ranges are theoretically calculated. The fundamental mechanism of elastic stability and the origin of phase transformation under hydrostatic pressure are explored. We found that the abilities for most of these lattices are enhanced to sustain axial strain but weaken to shear strain under higher pressure. The conditions of lattice stability are analysed using both the thermodynamic work-energy criterion and the elastic-stiffness criteria. We show that the lattice collapse of the perfect crystals is caused by the disappearance of their bulk moduli under volume dilation. Lattice defects are considered to be the main reason causing phase transformation under pressure. The correlation between the phonon softening and the variation of elastic coefficients is studied. The pressure dependence of the Kleinman internal strain parameter and its relationship to elastic stability is also explored

  7. AELAS: Automatic ELAStic property derivations via high-throughput first-principles computation

    Science.gov (United States)

    Zhang, S. H.; Zhang, R. F.

    2017-11-01

    The elastic properties are fundamental and important for crystalline materials as they relate to other mechanical properties, various thermodynamic qualities as well as some critical physical properties. However, a complete set of experimentally determined elastic properties is only available for a small subset of known materials, and an automatic scheme for the derivations of elastic properties that is adapted to high-throughput computation is much demanding. In this paper, we present the AELAS code, an automated program for calculating second-order elastic constants of both two-dimensional and three-dimensional single crystal materials with any symmetry, which is designed mainly for high-throughput first-principles computation. Other derivations of general elastic properties such as Young's, bulk and shear moduli as well as Poisson's ratio of polycrystal materials, Pugh ratio, Cauchy pressure, elastic anisotropy and elastic stability criterion, are also implemented in this code. The implementation of the code has been critically validated by a lot of evaluations and tests on a broad class of materials including two-dimensional and three-dimensional materials, providing its efficiency and capability for high-throughput screening of specific materials with targeted mechanical properties. Program Files doi:http://dx.doi.org/10.17632/f8fwg4j9tw.1 Licensing provisions: BSD 3-Clause Programming language: Fortran Nature of problem: To automate the calculations of second-order elastic constants and the derivations of other elastic properties for two-dimensional and three-dimensional materials with any symmetry via high-throughput first-principles computation. Solution method: The space-group number is firstly determined by the SPGLIB code [1] and the structure is then redefined to unit cell with IEEE-format [2]. Secondly, based on the determined space group number, a set of distortion modes is automatically specified and the distorted structure files are generated

  8. Quantitative determination of optical trapping strength and viscoelastic moduli inside living cells

    International Nuclear Information System (INIS)

    Mas, Josep; Berg-Sørensen, Kirstine; Richardson, Andrew C; Reihani, S Nader S; Oddershede, Lene B

    2013-01-01

    With the success of in vitro single-molecule force measurements obtained in recent years, the next step is to perform quantitative force measurements inside a living cell. Optical traps have proven excellent tools for manipulation, also in vivo, where they can be essentially non-invasive under correct wavelength and exposure conditions. It is a pre-requisite for in vivo quantitative force measurements that a precise and reliable force calibration of the tweezers is performed. There are well-established calibration protocols in purely viscous environments; however, as the cellular cytoplasm is viscoelastic, it would be incorrect to use a calibration procedure relying on a viscous environment. Here we demonstrate a method to perform a correct force calibration inside a living cell. This method (theoretically proposed in Fischer and Berg-Sørensen (2007 J. Opt. A: Pure Appl. Opt. 9 S239)) takes into account the viscoelastic properties of the cytoplasm and relies on a combination of active and passive recordings of the motion of the cytoplasmic object of interest. The calibration procedure allows us to extract absolute values for the viscoelastic moduli of the living cell cytoplasm as well as the force constant describing the optical trap, thus paving the way for quantitative force measurements inside the living cell. Here, we determine both the spring constant of the optical trap and the elastic contribution from the cytoplasm, influencing the motion of naturally occurring tracer particles. The viscoelastic moduli that we find are of the same order of magnitude as moduli found in other cell types by alternative methods. (paper)

  9. Multigene Genetic Programming for Estimation of Elastic Modulus of Concrete

    Directory of Open Access Journals (Sweden)

    Alireza Mohammadi Bayazidi

    2014-01-01

    Full Text Available This paper presents a new multigene genetic programming (MGGP approach for estimation of elastic modulus of concrete. The MGGP technique models the elastic modulus behavior by integrating the capabilities of standard genetic programming and classical regression. The main aim is to derive precise relationships between the tangent elastic moduli of normal and high strength concrete and the corresponding compressive strength values. Another important contribution of this study is to develop a generalized prediction model for the elastic moduli of both normal and high strength concrete. Numerous concrete compressive strength test results are obtained from the literature to develop the models. A comprehensive comparative study is conducted to verify the performance of the models. The proposed models perform superior to the existing traditional models, as well as those derived using other powerful soft computing tools.

  10. Calcul des propriétés élastiques des tissus utilisés dans les matériaux composites Computation of Elastic Properties of Fabrics Used in Composite Materials

    Directory of Open Access Journals (Sweden)

    Dal Maso F.

    2006-12-01

    elastic moduli. The other provide a rough estimate of moduli only.

  11. Optimization of flexible substrate by gradient elastic modulus design for performance improvement of flexible electronic devices

    Science.gov (United States)

    Xia, Minggang; Liang, Chunping; Hu, Ruixue; Cheng, Zhaofang; Liu, Shiru; Zhang, Shengli

    2018-05-01

    It is imperative and highly desirable to buffer the stress in flexible electronic devices. In this study, we designed and fabricated lamellate poly(dimethylsiloxane) (PDMS) samples with gradient elastic moduli, motivated by the protection of the pomelo pulp by its skin, followed by the measurements of their elastic moduli. We demonstrated that the electrical and fatigue performances of a Ag-nanowire thin film device on the PDMS substrate with a gradient elastic modulus are significantly better than those of a device on a substrate with a monolayer PDMS. This study provides a robust scheme to effectively protect flexible electronic devices.

  12. Elastic properties and spectroscopic studies of Na 2 O–ZnO–B 2 O 3 ...

    Indian Academy of Sciences (India)

    Elastic properties, 11B MAS–NMR and IR spectroscopic studies have been employed to study the structure of Na2O–ZnO–B2O3 glasses. Sound velocities and elastic moduli such as longitudinal, Young's, bulk and shear modulus have been measured at a frequency of 10 MHz as a function of ZnO concentration.

  13. On bulk viscosity and moduli decay

    International Nuclear Information System (INIS)

    Laine, Mikko

    2010-01-01

    This pedagogically intended lecture, one of four under the header 'Basics of thermal QCD', reviews an interesting relationship, originally pointed out by Boedeker, that exists between the bulk viscosity of Yang-Mills theory (of possible relevance to the hydrodynamics of heavy ion collision experiments) and the decay rate of scalar fields coupled very weakly to a heat bath (appearing in some particle physics inspired cosmological scenarios). This topic serves, furthermore, as a platform on which a number of generic thermal field theory concepts are illustrated. The other three lectures (on the QCD equation of state and the rates of elastic as well as inelastic processes experienced by heavy quarks) are recapitulated in brief encyclopedic form. (author)

  14. Atomistic simulation of the structural and elastic properties of ...

    Indian Academy of Sciences (India)

    experimental data and previous theoretical results, showing no phase transition ... and theoretical [2,9–11] studies have been dedicated to deter- ..... [33] introduced a simple relationship that empirically links the plastic properties of materials with their elastic moduli. The shear modulus G represents the resistance to plastic.

  15. Wave propagation in elastic layers with damping

    DEFF Research Database (Denmark)

    Sorokin, Sergey; Darula, Radoslav

    2016-01-01

    The conventional concepts of a loss factor and complex-valued elastic moduli are used to study wave attenuation in a visco-elastic layer. The hierarchy of reduced-order models is employed to assess attenuation levels in various situations. For the forcing problem, the attenuation levels are found...... for alternative excitation cases. The differences between two regimes, the low frequency one, when a waveguide supports only one propagating wave, and the high frequency one, when several waves are supported, are demonstrated and explained....

  16. On D-brane dynamics and moduli stabilization

    Science.gov (United States)

    Kitazawa, Noriaki

    2017-09-01

    We discuss the effect of the dynamics of D-branes on moduli stabilization in type IIB string theory compactifications, with reference to a concrete toy model of T6/Z 3 orientifold compactification with fractional D3-branes and anti-D3-branes at orbifold fixed points. The resulting attractive forces between anti-D3-branes and D3-branes, together with the repulsive forces between anti-D3-branes and O3-planes, can affect the stability of the compact space. There are no complex structure moduli in T6/Z 3 orientifold, which should thus capture some generic features of more general settings where all complex structure moduli are stabilized by three-form fluxes. The simultaneous presence of branes and anti-branes brings along the breaking of supersymmetry. Non-BPS combinations of this type are typical of “brane supersymmetry breaking” and are a necessary ingredient in the KKLT scenario for stabilizing the remaining Kähler moduli. The conclusion of our analysis is that, while mutual D-brane interactions sometimes help Kähler moduli stabilization, this is not always the case.

  17. Moduli vacuum misalignment and precise predictions in string inflation

    International Nuclear Information System (INIS)

    Cicoli, Michele; Dutta, Koushik; Maharana, Anshuman; Quevedo, Fernando

    2016-01-01

    The predictions for all the cosmological observables of any inflationary model depend on the number of e-foldings which is sensitive to the post-inflationary history of the universe. In string models the generic presence of light moduli leads to a late-time period of matter domination which lowers the required number of e-foldings and, in turn, modifies the exact predictions of any inflationary model. In this paper we compute exactly the shift of the number of e-foldings in Kähler moduli inflation which is determined by the magnitude of the moduli initial displacement caused by vacuum misalignment and the moduli decay rates. We find that the preferred number of e-foldings gets reduced from 50 to 45, causing a modification of the spectral index at the percent level. Our results illustrate the importance of understanding the full post-inflationary evolution of the universe in order to derive precise predictions in string inflation. To perform this task it is crucial to work in a setting where there is good control over moduli stabilisation.

  18. Moduli vacuum misalignment and precise predictions in string inflation

    Energy Technology Data Exchange (ETDEWEB)

    Cicoli, Michele [Dipartimento di Fisica ed Astronomia, Università di Bologna,via Irnerio 46, 40126 Bologna (Italy); INFN sezione di Bologna,viale Berti Pichat 6/2, 40127 Bologna (Italy); Abdus Salam ICTP,Strada Costiera 11, Trieste 34014 (Italy); Dutta, Koushik [Theory Division, Saha Institute of Nuclear Physics,1/AF Salt Lake, Kolkata 700064 (India); Maharana, Anshuman [Harish Chandra Research Intitute,Chattnag Road, Jhunsi, Allahabad 211019 (India); Quevedo, Fernando [Abdus Salam ICTP,Strada Costiera 11, Trieste 34014 (Italy); DAMTP, University of Cambridge,Wilberforce Road, Cambridge, CB3 0WA (United Kingdom)

    2016-08-03

    The predictions for all the cosmological observables of any inflationary model depend on the number of e-foldings which is sensitive to the post-inflationary history of the universe. In string models the generic presence of light moduli leads to a late-time period of matter domination which lowers the required number of e-foldings and, in turn, modifies the exact predictions of any inflationary model. In this paper we compute exactly the shift of the number of e-foldings in Kähler moduli inflation which is determined by the magnitude of the moduli initial displacement caused by vacuum misalignment and the moduli decay rates. We find that the preferred number of e-foldings gets reduced from 50 to 45, causing a modification of the spectral index at the percent level. Our results illustrate the importance of understanding the full post-inflationary evolution of the universe in order to derive precise predictions in string inflation. To perform this task it is crucial to work in a setting where there is good control over moduli stabilisation.

  19. Yttrium aluminium garnet under pressure: Structural, elastic, and vibrational properties from ab initio studies

    International Nuclear Information System (INIS)

    Monteseguro, V.; Rodríguez-Hernández, P.; Muñoz, A.

    2015-01-01

    The structural, elastic, and vibrational properties of yttrium aluminum garnet Y 3 Al 5 O 12 are studied under high pressure by ab initio calculations in the framework of the density functional theory. The calculated ground state properties are in good agreement with the available experimental data. Pressure dependences of bond length and bulk moduli of the constituent polyhedra are reported. The evolution of the elastic constants and the major elastic properties, Young and shear modulus, Poisson's ratios, and Zener anisotropy ratio, are described. The mechanical stability is analyzed, on the light of “Born generalized stability criteria,” showing that the garnet is mechanically unstable above 116 GPa. Symmetries, frequencies, and pressure coefficients of the Raman-active modes are discussed on the basis of the calculated total and partial phonon density of states, which reflect the dynamical contribution of each atom. The relations between the phonon modes of Y 3 Al 5 O 12 and the internal and external molecular modes of the different polyhedra are discussed. Infrared-active modes, as well as the silent modes, and their pressure dependence are also investigated. No dynamical instabilities were found below 116 GPa

  20. Influence of Young's moduli in 3D fluid-structure coupled models of the human cochlea

    Science.gov (United States)

    Böhnke, Frank; Semmelbauer, Sebastian; Marquardt, Torsten

    2015-12-01

    The acoustic wave propagation in the human cochlea was studied using a tapered box-model with linear assumptions respective to all mechanical parameters. The discretisation and evaluation is conducted by a commercial finite element package (ANSYS). The main difference to former models of the cochlea was the representation of the basilar membrane by a 3D elastic solid. The Young's moduli of this solid were modified to study their influence on the travelling wave. The lymph in the scala vestibuli and scala tympani was represented by a viscous and nearly incompressible fluid finite element approach. Our results show the maximum displacement for f = 2kHz at half of the length of the cochlea in accordance with former experiments. For low frequencies f <200 Hz nearly zero phase shifts were found, whereas for f =1 kHz it reaches values up to -12 cycles depending on the degree of orthotropy.

  1. Natural inflation and moduli stabilization in heterotic orbifolds

    International Nuclear Information System (INIS)

    Ruehle, Fabian; Wieck, Clemens

    2015-03-01

    We study moduli stabilization in combination with inflation in heterotic orbifold compactifications in the light of a large Hubble scale and the favored tensor-to-scalar ratio r∼0.05. To account for a trans-Planckian field range we implement aligned natural inflation. Although there is only one universal axion in heterotic constructions, further axions from the geometric moduli can be used for alignment and inflation. We argue that such an alignment is rather generic on orbifolds, since all non-perturbative terms are determined by modular weights of the involved fields and the Dedekind η function. We present two setups inspired by the mini-landscape models of the Z 6-II orbifold which realize aligned inflation and stabilization of the relevant moduli. One has a supersymmetric vacuum after inflation, while the other includes a gaugino condensate which breaks supersymmetry at a high scale.

  2. Noncommutative solitons: moduli spaces, quantization, finite θ effects and stability

    Science.gov (United States)

    Hadasz, Leszek; Rocek, Martin; Lindström, Ulf; von Unge, Rikard

    2001-06-01

    We find the N-soliton solution at infinite θ, as well as the metric on the moduli space corresponding to spatial displacements of the solitons. We use a perturbative expansion to incorporate the leading θ-1 corrections, and find an effective short range attraction between solitons. We study the stability of various solutions. We discuss the finite θ corrections to scattering, and find metastable orbits. Upon quantization of the two-soliton moduli space, for any finite θ, we find an s-wave bound state.

  3. CP violation and moduli stabilization in heterotic models

    International Nuclear Information System (INIS)

    Giedt, Joel

    2002-01-01

    The role of moduli stabilization in predictions for CP violation is examined in the context of four-dimensional effective supergravity models obtained from the weakly coupled heterotic string. They point out that while stabilization of compactification moduli has been studied extensively, the determination of background values for other scalar by dynamical means has not been subjected to the same degree of scrutiny. These other complex scalars are important potential sources of CP violation and they show in a simple model how their background values (including complex phases) may be determined from the minimization of the supergravity scalar potential, subject to the constraint of vanishing cosmological constant

  4. Structural, elastic and magnetic properties of Mn and Sb doped chromium nitride – An ab initio study

    Energy Technology Data Exchange (ETDEWEB)

    Ikram Un Nabi Lone; Sheik Sirajuddeen M Mohamed, E-mail: msheiksiraj@bsauniv.ac.in; Shameem Banu, I.B.; Sathik Basha, S.

    2017-05-01

    Structural, magnetic and elastic properties of Mn and Sb doped CrN were investigated by the electronic band structure calculations using Full Potential Linear Augmented Plane Wave (FP-LAPW) method. The host compound CrN was doped with Mn and Sb separately, in the doping concentration of 12.5% to replace Cr atoms. The introduction of Mn and Sb atoms replacing the Cr atoms does not change the structural stability of the compound. The changes in magnetic and elastic properties were investigated and compared in GGA and GGA+U methods. The doped CrN undergoes a relative increase in the magnetic order with the substitution of Mn and Sb atoms. In GGA method, the magnetic moments are found to be greater in Mn doped CrN than that found in Sb doped Cr{sub 0.875}NSb{sub 0.125}. When doped with Sb, the elastic moduli such as Young’s modulus, bulk modulus and rigidity modulus show a relative increase in comparison with that in Mn doped CrN. Using Hubbard model in GGA+U method, both the magnetic and elastic properties increase in Mn and Sb doped compounds. - Highlights: • Mn and Sb doped Chromium Nitride. • Structural properties. • Magnetic properties. • Elastic properties.

  5. Ultrasonic measurement of high burn-up fuel elastic properties

    International Nuclear Information System (INIS)

    Laux, D.; Despaux, G.; Augereau, F.; Attal, J.; Gatt, J.; Basini, V.

    2006-01-01

    The ultrasonic method developed for the evaluation of high burn-up fuel elastic properties is presented hereafter. The objective of the method is to provide data for fuel thermo-mechanical calculation codes in order to improve industrial nuclear fuel and materials or to design new reactor components. The need for data is especially crucial for high burn-up fuel modelling for which the fuel mechanical properties are essential and for which a wide range of experiments in MTR reactors and high burn-up commercial reactor fuel examinations have been included in programmes worldwide. To contribute to the acquisition of this knowledge the LAIN activity is developing in two directions. First one is development of an ultrasonic focused technique adapted to active materials study. This technique was used few years ago in the EdF laboratory in Chinon to assess the ageing of materials under irradiation. It is now used in a hot cell at ITU Karlsruhe to determine the elastic moduli of high burnup fuels from 0 to 110 GWd/tU. Some of this work is presented here. The second on going programme is related to the qualification of acoustic sensors in nuclear environments, which is of a great interest for all the methods, which work, in a hostile nuclear environment

  6. The ratio Rdp of the quasi-elastic nd → p(nn) to the elastic np → pn charge-exchange process yields at 0 deg over 0.55-2.0 GeV neutron beam energy region: 2. Comparison of the results with the model dependent calculations

    International Nuclear Information System (INIS)

    Sharov, V.I.; Morozov, A.A.; Shindin, R.A.; Chernykh, E.V.; Nomofilov, A.A.; Strunov, L.N.

    2008-01-01

    In our previous paper, the new experimental results on ratio R dp of the quasi-elastic charge-exchange yield at 0 Lab d eg for the nd → p + (nn) reaction to the elastic np → pn charge-exchange yield, were presented. The measurements were carried out at the Nuclotron of the Veksler and Baldin Laboratory of High Energies of the Joint Institute for Nuclear Research at the neutron beam kinetic energies of 0.55, 0.8, 1.0,1.2, 1.4, 1.8 and 2.0 GeV. In this paper, the comparison of these R dp data with the R dp calculations obtained within the impulse approximation by using the invariant amplitude sets from the GW/VPI phase-shift analysis, is made. The calculated R dp values with the set of invariant amplitude data for the elastic np → pn charge exchange at θ p,CM = 0 deg are in a good agreement with the experimental data. It has been confirmed that at θ p,CM = 0 deg the nd → pnn process is caused by the elastic np → pn charge-exchange reaction. Thus, it has been shown that the obtained experimental R dp results can be used for the Delta-Sigma experimental programme to reduce the total ambiguity in the extraction of the amplitude parts

  7. Elastic properties

    International Nuclear Information System (INIS)

    Ledbetter, H.M.

    1983-01-01

    This chapter investigates the following five aspects of engineering-material solid-state elastic constants: general properties, interrelationships, relationships to other physical properties, changes during cooling from ambient to near-zero temperature, and near-zero-temperature behavior. Topics considered include compressibility, bulk modulus, Young's modulus, shear modulus, Poisson's ratio, Hooke's law, elastic-constant measuring methods, thermodynamic potentials, higher-order energy terms, specific heat, thermal expansivity, magnetic materials, structural phase transitions, polymers, composites, textured aggregates, and other-phenomena correlations. Some of the conclusions concerning polycrystalline elastic properties and their temperature dependence are: elastic constants are physical, not mechanical, properties which relate thermodynamically to other physical properties such as specific heat and thermal expansivity; elastic constants at low temperatures are nearly temperature independent, as required by the third law of thermodynamics; and elastic constants can be used to study directional properties of materials, such as textured aggregates and composites

  8. Nonlinear elastic properties of bulk metallic glasses Zr52.5Ti5Cu17.9Ni14.6Al10 and Pd40Cu30Ni10P20

    International Nuclear Information System (INIS)

    Kobelev, N.P.; Kolyvanov, E.L.; Khonik, V.A.

    2005-01-01

    The influence of uniaxial compression on the propagation of ultrasonic vibrations in Zr 52.5 Ti 5 Cu 17.9 Ni 14.6 Al 10 and Pd 40 Cu 30 Ni 10 P 20 bulk metallic glasses produced by melt quenching at a rate of 100 K/s is investigated. Elastic deformation was realized by compression of the samples along their long axis up to strains of about 1 GPa. Deriving of major ratios used during the calculation of the third-order elastic moduli of the glasses is described in brief, the results of the calculations being provided. A qualitative agreement between the calculated results and available data on the influence of the uniform pressure on the sound wave propagation rate was obtained [ru

  9. Infinite Grassmannian and moduli space of G-bundles

    International Nuclear Information System (INIS)

    Kumar, S.; Ramanathan, A.

    1993-03-01

    Let C be a smooth irreducible projective curve and G a simply connected simple affine algebraic group of C. We study in this paper the relationship between the space of vacua defined in Conformal Field Theory and the space of sections of a line bundle on the moduli space of G-bundles over C. (author). 33 refs

  10. Moduli space for endomorphisms of finite dimension vector spaces

    International Nuclear Information System (INIS)

    Kanarek, H.

    1990-12-01

    Consider the set (End n ) of endomorphisms of vector spaces of dimension n n ). What we present here is a decomposition of (End n ) in which each element has a fine moduli space and one of them is composed by the semisimple endomorphisms as D. Mumford shows. (author). 2 refs

  11. On the L2-metric of vortex moduli spaces

    NARCIS (Netherlands)

    Baptista, J.M.

    2011-01-01

    We derive general expressions for the Kähler form of the L2-metric in terms of standard 2-forms on vortex moduli spaces. In the case of abelian vortices in gauged linear sigma-models, this allows us to compute explicitly the Kähler class of the L2-metric. As an application we compute the total

  12. Moduli for decorated tuples of sheaves and representation spaces ...

    Indian Academy of Sciences (India)

    R. Narasimhan (Krishtel eMaging) 1461 1996 Oct 15 13:05:22

    We extend the scope of a former paper to vector bundle problems involving ... the machinery of algebraic geometry to the gauge theoretic moduli space for the pairs ... A nice example of a classification problem which can be formulated in our ... Numerous famous special cases of this construction have been studied in the ...

  13. Stability of Picard Bundle Over Moduli Space of Stable Vector ...

    Indian Academy of Sciences (India)

    Abstract. Answering a question of [BV] it is proved that the Picard bundle on the moduli space of stable vector bundles of rank two, on a Riemann surface of genus at least three, with fixed determinant of odd degree is stable.

  14. Moduli and (un)attractor black hole thermodynamics

    NARCIS (Netherlands)

    Astefanesei, D.; Goldstein, K.D.; Mahapatra, S.

    2008-01-01

    We investigate four-dimensional spherically symmetric black hole solutions in gravity theories with massless, neutral scalars non-minimally coupled to gauge fields. In the non-extremal case, we explicitly show that, under the variation of the moduli, the scalar charges appear in the first law of

  15. On the possibility of large axion moduli spaces

    Energy Technology Data Exchange (ETDEWEB)

    Rudelius, Tom [Jefferson Physical Laboratory, Harvard University,Cambridge, MA 02138 (United States)

    2015-04-28

    We study the diameters of axion moduli spaces, focusing primarily on type IIB compactifications on Calabi-Yau three-folds. In this case, we derive a stringent bound on the diameter in the large volume region of parameter space for Calabi-Yaus with simplicial Kähler cone. This bound can be violated by Calabi-Yaus with non-simplicial Kähler cones, but additional contributions are introduced to the effective action which can restrict the field range accessible to the axions. We perform a statistical analysis of simulated moduli spaces, finding in all cases that these additional contributions restrict the diameter so that these moduli spaces are no more likely to yield successful inflation than those with simplicial Kähler cone or with far fewer axions. Further heuristic arguments for axions in other corners of the duality web suggest that the difficulty observed in http://dx.doi.org/10.1088/1475-7516/2003/06/001 of finding an axion decay constant parametrically larger than M{sub p} applies not only to individual axions, but to the diagonals of axion moduli space as well. This observation is shown to follow from the weak gravity conjecture of http://dx.doi.org/10.1088/1126-6708/2007/06/060, so it likely applies not only to axions in string theory, but also to axions in any consistent theory of quantum gravity.

  16. String loop moduli stabilisation and cosmology in IIB flux compactifications

    International Nuclear Information System (INIS)

    Cicoli, M.

    2010-01-01

    We present a detailed review of the moduli stabilisation mechanism and possible cosmological implications of the LARGE Volume Scenario (LVS) that emerges naturally in the context of type IIB Calabi-Yau flux compactifications. After a quick overview of physics beyond the Standard Model, we present string theory as the most promising candidate for a consistent theory of quantum gravity. We then give a pedagogical introduction to type IIB compactifications on Calabi-Yau orientifolds where most of the moduli are stabilised by turning on background fluxes. However in order to fix the Kaehler moduli one needs to consider several corrections beyond the leading order approximations. After presenting a survey of all the existing solutions to this problem, we derive the topological conditions on an arbitrary Calabi-Yau to obtain the LVS since it requires no fine-tuning of the fluxes and provides a natural solution of the hierarchy problem. After performing a systematic study of the behaviour of string loop corrections for general type IIB compactifications, we show how they play a crucial role to achieve full Kaehler moduli stabilisation in the LVS. Before examining the possible cosmological implication of these scenarios, we present a broad overview of string cosmology. We then notice how, in the case of K3-fibrations, string loop corrections give rise naturally to an inflationary model which yields observable gravity waves. We finally study the finite-temperature behaviour of the LVS and discuss prospects for future work. (Abstract Copyright [2010], Wiley Periodicals, Inc.)

  17. Moduli effective action in warped brane-world compactifications

    International Nuclear Information System (INIS)

    Garriga, Jaume; Pujolas, Oriol; Tanaka, Takahiro

    2003-01-01

    We consider a class of 5D brane-world solutions with a power-law warp factor a(y)∝y q , and bulk dilaton with profile phi∝lny, where y is the proper distance in the extra dimension. This class includes the heterotic M-theory brane-world of [Phys. Rev. D 59 (1999) 086001, and] and the Randall-Sundrum (RS) model as a limiting case. In general, there are two moduli fields y ± , corresponding to the 'positions' of two branes (which live at the fixed points of an orbifold compactification). Classically, the moduli are massless, due to a scaling symmetry of the action. However, in the absence of supersymmetry, they develop an effective potential at one loop. Local terms proportional to K ± 4 , where K ± =q/y ± is the local curvature scale at the location of the corresponding brane, are needed in order to remove the divergences in the effective potential. Such terms break the scaling symmetry and hence they may act as stabilizers for the moduli. When the branes are very close to each other, the effective potential induced by massless bulk fields behaves like V∼d -4 , where d is the separation between branes. When the branes are widely separated, the potentials for each one of the moduli generically develop a 'Coleman-Weinberg'-type behaviour of the form a 4 (y ± )K ± 4 ln(K ± /μ ± ), where μ ± are renormalization scales. In the RS case, the bulk geometry is AdS and K ± are equal to a constant, independent of the position of the branes, so these terms do not contribute to the mass of the moduli. However, for generic warp factor, they provide a simple stabilization mechanism. For q > or approx. 10, the observed hierarchy can be naturally generated by this potential, giving the lightest modulus a mass of order m - < or approx. TeV

  18. The effects of gamma irradiation on the elastic properties of soda lime glass doped with cerium oxide

    Energy Technology Data Exchange (ETDEWEB)

    Laopaiboon, R.; Laopaiboon, J.; Pencharee, S. [Glass Technology Excellent Center (GTEC), Department of Physics, Faculty of Science, Ubon Ratchathani University, Ubon Ratchathani, 34190 (Thailand); Nontachat, S. [Department of Radiotherapy, Ubon Ratchathani Cancer Centre, Ubon Ratchathani, 34190 (Thailand); Bootjomchai, C., E-mail: cherdsak_per@hotmail.co.th [Glass Technology Excellent Center (GTEC), Department of Physics, Faculty of Science, Ubon Ratchathani University, Ubon Ratchathani, 34190 (Thailand)

    2016-05-05

    Soda lime glass doped with cerium oxide was prepared using a conventional melt quenching technique. The density and molar volume of the glass samples were measured. Ultrasonic wave velocities of the glass samples were carried out using a pulse echo technique. The density and ultrasonic velocities were used for determining elastic moduli of the glass samples, both before and after irradiation with gamma rays at 1 kGy. The results revealed that the influence of gamma irradiation caused the matrix structure of the glass samples to be damaged by creating displacements, electronic defects and/or breaks in the network bonds, leading to the formation of non-bridging oxygens (NBOs). Elastic properties were investigated under the influence of gamma irradiation. The results also revealed that the structures of the glass samples were distorted by irradiation. Damage by irradiation created the NBOs and/or the transformation of main glass network structures from Q{sub 4} to Q{sub 3}. Evidence of these results was acquired from FTIR spectra. The results of FTIR supported the results and were obtained from ultrasonic velocities. In addition, the elastic properties obtained from experiments were compared with theoretical values calculated from the Makishima and Mackenzie model (M–M model). - Highlights: • Results show good agreement between experimental and theoretical of elastic moduli. • Influence of irradiation created a distorted network structure. • Transformation of network structure from Ref. Q{sub 4} to Q{sub 3} after irradiation. • FTIR result is good evidence of the result is obtained from ultrasonic technique.

  19. The Molybdenum titanium Phase Diagram Evaluated from Ab initio Calculations

    Science.gov (United States)

    2016-10-07

    solid solution, therefore occurs at lower temperatures and is more complex than previously anticipated. 1. Introduction The demand for permanent...and relatively low elastic moduli [1, 2, 3, 4, 5, 6, 7, 8, 9]. Titanium alloys with low Young’s moduli inhibit the stress shielding effect and thus...Instituut Voor Kern-en Stralingsfysica, K. U. Leuven, Belgium), 2002, ISBN 90- 807215-1-4 (http://www,wien2k.at/reg_user/ textbooks ). 36 J. P. Desclaux

  20. Analytical modeling of effect of interlayer on effective moduli of layered graphene-polymer nanocomposites

    Institute of Scientific and Technical Information of China (English)

    C.C.Roach; Y.C.Lu

    2017-01-01

    Nanocomposites enhanced with two-dimensional,layered graphene fillers are a new class of engineering materials that exhibit superior properties and characteristics to composites with conventional fillers.However,the roles of "interlayers" in layered graphene fillers have yet to be fully explored.This paper examines the effect of interlayers on mechanical properties of layered graphene polymer composites.As an effective filler,the fundamental properties (in-plane Young's modulus EL1,out-of-plane Young's modulus EL2;shear modulus GL12,major Poisson's ratio 1L12) of the layered graphene were computed by using the Arridge's lamellar model.The effects of interlayers on effective moduli of layered graphene epoxy composites were examined through the Tandon-Weng model.The properties of the interlayer show noticeable impact on elastic properties of the composites,particular the out-of-plane properties (Young's modulus E2 and shear modulus G12).The interlayer spacing is seen to have much great influence on properties of the composites.As the interlayer spacing increases from 0.34 nm to 2 nm,all elastic properties of the composites have been greatly decreased.

  1. Effective stress law for anisotropic elastic deformation

    International Nuclear Information System (INIS)

    Carroll, M.M.

    1979-01-01

    An effective stress law is derived analytically to describe the effect of pore fluid pressure on the linearly elastic response of saturated porous rocks which exhibit anisotropy. For general anisotropy the difference between the effective stress and the applied stress is not hydrostatic. The effective stress law involves two constants for transversely isotropic response and three constants for orthotropic response; these constants can be expressed in terms of the moduli of the porous material and of the solid material. These expressions simplify considerably when the anisotropy is structural rather than intrinsic, i.e., in the case of an isotropic solid material with an anisotropic pore structure. In this case the effective stress law involves the solid or grain bulk modulus and two or three moduli of the porous material, for transverse isotropy and orthotropy, respectively. The law reduces, in the case of isotropic response, to that suggested by Geertsma (1957) and by Skempton (1961) and derived analytically by Nur and Byerlee

  2. Explicit Gromov-Hausdorff compactifications of moduli spaces of Kähler-Einstein Fano manifolds

    DEFF Research Database (Denmark)

    Spotti, Cristiano; Sun, Song

    We exhibit the first non-trivial concrete examples of Gromov-Hausdorff compactifications of moduli spaces of Kähler-Einstein Fano manifolds in all complex dimensions bigger than two (Fano K-moduli spaces). We also discuss potential applications to explicit study of moduli spaces of K-stable Fano...

  3. On rationality of moduli spaces of vector bundles on real Hirzebruch ...

    Indian Academy of Sciences (India)

    Introduction. Moduli spaces of semistable vector bundles on a smooth projective variety are studied from various points of view. One of the questions that is often addressed is the birational type of the moduli space, more precisely, the question of rationality. It is known that the moduli space of semistable vector bundles of ...

  4. Cosserat moduli of anisotropic cancellous bone : A micromechanical analysis

    NARCIS (Netherlands)

    Fatemi, J.; Onck, P.R.; Poort, G.; Van Keulen, F.

    A micromechanical-based approach is proposed to quantify the effective (in the macroscopic sense) elastic constants of Cosserat materials. The material under investigation (cancellous bone) is cellular and classically elastic at the microscopic level and assumed to be dense Cosserat elastic at the

  5. Resonant frequency study of tensile and shear elasticity moduli of carbon fibre reinforced composites (CFRC)

    Czech Academy of Sciences Publication Activity Database

    Černý, Martin; Glogar, Petr; Manocha, L.

    2000-01-01

    Roč. 38, č. 15 (2000), s. 2139-2149 ISSN 0008-6223 R&D Projects: GA ČR GA106/99/0096; GA ČR GA106/96/0596 Institutional research plan: CEZ:AV0Z3046908 Subject RIV: BI - Acoustics Impact factor: 1.715, year: 2000

  6. Dynamic and static elastic moduli of North Sea and deep sea chalk

    DEFF Research Database (Denmark)

    Gommesen, Lars; Fabricius, Ida Lykke

    2001-01-01

    We have established an empirical relationship between the dynamic and the static mechanical properties of North Sea and deep sea chalk for a large porosity interval with respect to porosity, effective stress history and textural composition. The chalk investigated is from the Tor and Hod Formatio...

  7. A Laboratory Study of the Effect of Stress State on the Elastic Moduli of Sand

    Science.gov (United States)

    1990-01-01

    frequency. Drnevich (1967) investigated the effect of strain history on the dynamic properties of a dry Ottawa sand. One finding of his work was that the...2.2) in which jo = effective octahedral normal stress, e = void ratio, H = ambient stress and vibration history , S - de9,ee of saturation, To...zt) = ik[Cei(kz-wt) - De-i(kz+Wt) (3.20) dz I Substituting Eqs. 3.19 and 3.20 into the second boundary condition at z - L yields ikEA [Cei(kL-cot

  8. Room Temperature Elastic Moduli and Vickers Hardness of Hot-Pressed LLZO Cubic Garnet

    Science.gov (United States)

    2012-01-01

    4140-steel [29] as well as composites such as Al/Al2O3 [30] and Ni– YSZ cermets [27]. The RUS apparatus used in this study consists of a computer...Microstructure and lattice parameter of LLZO specimens In this study , the LLZO microstructure was observed on a (i) fracture surface of LLZO-01 (Fig. 1a) and... study are consistent with the trend (Eq. 2) of a power law decrease in mechanical properties with increasing lattice parameter observed for other garnet

  9. Elastic, dynamical, and electronic properties of LiHg and Li3Hg: First-principles study

    Science.gov (United States)

    Wang, Yan; Hao, Chun-Mei; Huang, Hong-Mei; Li, Yan-Ling

    2018-04-01

    The elastic, dynamical, and electronic properties of cubic LiHg and Li3Hg were investigated based on first-principles methods. The elastic constants and phonon spectral calculations confirmed the mechanical and dynamical stability of the materials at ambient conditions. The obtained elastic moduli of LiHg are slightly larger than those of Li3Hg. Both LiHg and Li3Hg are ductile materials with strong shear anisotropy as metals with mixed ionic, covalent, and metallic interactions. The calculated Debye temperatures are 223.5 K and 230.6 K for LiHg and Li3Hg, respectively. The calculated phonon frequency of the T2 g mode in Li3Hg is 326.8 cm-1. The p states from the Hg and Li atoms dominate the electronic structure near the Fermi level. These findings may inspire further experimental and theoretical study on the potential technical and engineering applications of similar alkali metal-based intermetallic compounds.

  10. No-scale D-term inflation with stabilized moduli

    Energy Technology Data Exchange (ETDEWEB)

    Buchmueller, Wilfried; Domcke, Valerie; Wieck, Clemens

    2013-09-15

    We study the consistency of hybrid inflation and moduli stabilization, using the Kallosh- Linde model as an example for the latter. We find that F-term hybrid inflation is not viable since inflationary trajectories are destabilized by tachyonic modes. On the other hand, D-term hybrid inflation is naturally compatible with moduli stabilization due to the absence of a large superpotential term during the inflationary phase. Our model turns out to be equivalent to superconformal D-term inflation and it therefore successfully accounts for the CMB data in the large-field regime. Supersymmetry breaking can be incorporated via an O'Raifeartaigh model. For GUT-scale inflation one obtains a stringent bound on the gravitino mass. A rough estimate yields m{sub 3/2}>or similar 10{sup 5} GeV, contrary to naive expectation.

  11. The Hilbert Series of the One Instanton Moduli Space

    CERN Document Server

    Benvenuti, Sergio; Mekareeya, Noppadol; 10.1007

    2010-01-01

    The moduli space of k G-instantons on R^4 for a classical gauge group G is known to be given by the Higgs branch of a supersymmetric gauge theory that lives on Dp branes probing D(p + 4) branes in Type II theories. For p = 3, these (3 + 1) dimensional gauge theories have N = 2 supersymmetry and can be represented by quiver diagrams. The F and D term equations coincide with the ADHM construction. The Hilbert series of the moduli spaces of one instanton for classical gauge groups is easy to compute and turns out to take a particularly simple form which is previously unknown. This allows for a G invariant character expansion and hence easily generalisable for exceptional gauge groups, where an ADHM construction is not known. The conjectures for exceptional groups are further checked using some new techniques like sewing relations in Hilbert Series. This is applied to Argyres-Seiberg dualities.

  12. Moduli evolution in the presence of flux compactifications

    International Nuclear Information System (INIS)

    Barreiro, Tiago; Carlos, Beatriz de; Copeland, Ed; Nunes, Nelson J.

    2005-01-01

    We study the cosmological evolution of the volume moduli in a class of recently proposed inflationary universe models of Kachru et al. arising out of Type IIB string theory, where a number of the moduli fields have been stabilized through flux compactifications. Developing an approach introduced by some of us earlier, we show, in agreement with Brustein et al., how the presence of extra sources of matter act so as to provide additional friction, slowing the modulus field as it evolves down its potential, thereby vastly increasing the region of parameter space which leads to the eventual stabilization of these fields. Extending the case to include both the real and imaginary parts of the volume modulus, we show how the parameter space of initial conditions is modified and comment on the impact for these inflationary models arising out of flux type compactifications

  13. IMPA-ICTP School on Moduli of Curves

    CERN Document Server

    Ciliberto, Ciro; Esteves, Eduardo; Melo, Margarida; Voisin, Claire

    2017-01-01

    Providing a timely description of the present state of the art of moduli spaces of curves and their geometry, this volume is written in a way which will make it extremely useful both for young people who want to approach this important field, and also for established researchers, who will find references, problems, original expositions, new viewpoints, etc. The book collects the lecture notes of a number of leading algebraic geometers and in particular specialists in the field of moduli spaces of curves and their geometry. This is an important subject in algebraic geometry and complex analysis which has seen spectacular developments in recent decades, with important applications to other parts of mathematics such as birational geometry and enumerative geometry, and to other sciences, including physics.  The themes treated are classical but with a constant look to modern developments (see Cascini, Debarre, Farkas, and Sernesi's contributions), and include very new material, such as Bridgeland stability (see M...

  14. No-scale D-term inflation with stabilized moduli

    International Nuclear Information System (INIS)

    Buchmueller, Wilfried; Domcke, Valerie; Wieck, Clemens

    2013-09-01

    We study the consistency of hybrid inflation and moduli stabilization, using the Kallosh- Linde model as an example for the latter. We find that F-term hybrid inflation is not viable since inflationary trajectories are destabilized by tachyonic modes. On the other hand, D-term hybrid inflation is naturally compatible with moduli stabilization due to the absence of a large superpotential term during the inflationary phase. Our model turns out to be equivalent to superconformal D-term inflation and it therefore successfully accounts for the CMB data in the large-field regime. Supersymmetry breaking can be incorporated via an O'Raifeartaigh model. For GUT-scale inflation one obtains a stringent bound on the gravitino mass. A rough estimate yields m 3/2 >or similar 10 5 GeV, contrary to naive expectation.

  15. The Coulomb Branch Formula for Quiver Moduli Spaces

    CERN Document Server

    Manschot, Jan; Sen, Ashoke

    2014-01-01

    In recent series of works, by translating properties of multi-centered supersymmetric black holes into the language of quiver representations, we proposed a formula that expresses the Hodge numbers of the moduli space of semi-stable representations of quivers with generic superpotential in terms of a set of invariants associated to `single-centered' or `pure-Higgs' states. The distinguishing feature of these invariants is that they are independent of the choice of stability condition. Furthermore they are uniquely determined by the $\\chi_y$-genus of the moduli space. Here, we provide a self-contained summary of the Coulomb branch formula, spelling out mathematical details but leaving out proofs and physical motivations.

  16. Moduli evolution in the presence of thermal corrections

    International Nuclear Information System (INIS)

    Barreiro, Tiago; Carlos, Beatriz de; Copeland, Edmund J.; Nunes, Nelson J.

    2008-01-01

    We study the effect of thermal corrections on the evolution of moduli in effective supergravity models. This is motivated by previous results in the literature suggesting that these corrections could alter and even erase the presence of a minimum in the zero temperature potential, something that would have disastrous consequences in these particular models. We show that, in a representative sample of flux compactification constructions, this need not be the case, although we find that the inclusion of thermal corrections can dramatically decrease the region of initial conditions for which the moduli are stabilized. Moreover, the bounds on the reheating temperature coming from demanding that the full, finite temperature potential, has a minimum can be considerably relaxed given the slow pace at which the evolution proceeds.

  17. Quantum moduli spaces of N=1 string theories

    International Nuclear Information System (INIS)

    Banks, T.; Dine, M.

    1996-01-01

    Generically, string models with N=1 supersymmetry are not expected to have moduli beyond perturbation theory; stringy nonperturbative effects as well as low energy field-theoretic phenomena such as gluino condensation will lift any flat directions. In this work, we describe models where some subspace of the moduli space survives nonperturbatively. Discrete R symmetries forbid any inherently stringy effects, and dynamical considerations control the field-theoretic effects. The surviving subspace is a space of high symmetry; the system is attracted to this subspace by a potential which we compute. Models of this type may be useful for considerations of duality and raise troubling cosmological questions about string theory. Our considerations also suggest a mechanism for fixing the expectation value of the dilaton. copyright 1996 The American Physical Society

  18. Instantons from geodesics in AdS moduli spaces

    Science.gov (United States)

    Ruggeri, Daniele; Trigiante, Mario; Van Riet, Thomas

    2018-03-01

    We investigate supergravity instantons in Euclidean AdS5 × S5/ℤk. These solutions are expected to be dual to instantons of N = 2 quiver gauge theories. On the supergravity side the (extremal) instanton solutions are neatly described by the (lightlike) geodesics on the AdS moduli space for which we find the explicit expression and compute the on-shell actions in terms of the quantised charges. The lightlike geodesics fall into two categories depending on the degree of nilpotency of the Noether charge matrix carried by the geodesic: for degree 2 the instantons preserve 8 supercharges and for degree 3 they are non-SUSY. We expect that these findings should apply to more general situations in the sense that there is a map between geodesics on moduli-spaces of Euclidean AdS vacua and instantons with holographic counterparts.

  19. Bohr--Sommerfeld Lagrangians of moduli spaces of Higgs bundles

    DEFF Research Database (Denmark)

    Biswas, Indranil; Gammelgaard, Niels Leth; Logares, Marina

    Let $X$ be a compact connected Riemann surface of genus at least two. Let $M_H(r,d)$ denote the moduli space of semistable Higgs bundles on $X$ of rank $r$ and degree $d$. We prove that the compact complex Bohr-Sommerfeld Lagrangians of $M_H(r,d)$ are precisely the irreducible components of the n......Let $X$ be a compact connected Riemann surface of genus at least two. Let $M_H(r,d)$ denote the moduli space of semistable Higgs bundles on $X$ of rank $r$ and degree $d$. We prove that the compact complex Bohr-Sommerfeld Lagrangians of $M_H(r,d)$ are precisely the irreducible components...

  20. On Rationality of Moduli Spaces of Vector Bundles on Real ...

    Indian Academy of Sciences (India)

    Let be a real form of a Hirzebruch surface. Let M H ( r , c 1 , c 2 ) be the moduli space of vector bundles on . Under some numerical conditions on r , c 1 and c 2 , we identify those M H ( r , c 1 , c 2 ) that are rational. Author Affiliations. Indranil Biswas1 Ronnie Sebastian2. School of Mathematics, Tata Institute of ...

  1. On natural inflation and moduli stabilisation in string theory

    Energy Technology Data Exchange (ETDEWEB)

    Palti, Eran [Institut für Theoretische Physik, Ruprecht-Karls-Universität, Philosophenweg 19, Heidelberg, 69120 (Germany)

    2015-10-28

    Natural inflation relies on the existence of an axion decay constant which is super-Planckian. In string theory only sub-Planckian axion decay constants have been found in any controlled regime. However in field theory it is possible to generate an enhanced super-Planckian decay constant by an appropriate aligned mixing between axions with individual sub-Planckian decay constants. We study the possibility of such a mechanism in string theory. In particular we construct a new realisation of an alignment scenario in type IIA string theory compactifications on a Calabi-Yau where the alignment is induced through fluxes. Within field theory the original decay constants are taken to be independent of the parameters which induce the alignment. In string theory however they are moduli dependent quantities and so interact gravitationally with the physics responsible for the mixing. We show that this gravitational effect of the fluxes on the moduli can precisely cancel any enhancement of the effective decay constant. This censorship of an effective super-Planckian decay constant depends on detailed properties of Calabi-Yau moduli spaces and occurs for all the examples and classes that we study. We expand these results to a general superpotential assuming only that the axion superpartners are fixed supersymmetrically and are able to show for a large class of Calabi-Yau manifolds, but not all, that the cancellation effect occurs and is independent of the superpotential. We also study simple models where the moduli are fixed non-supersymmetrically and find that similar cancellation behaviour can emerge. Finally we make some comments on a possible generalisation to axion monodromy inflation models.

  2. Von Neuman representations on self-dual Hilbert W* moduli

    International Nuclear Information System (INIS)

    Frank, M.

    1987-01-01

    Von Neumann algebras M of bounded operators on self-dual Hilbert W* moduli H possessing a cyclic-separating element x-bar in H are considered. The close relation of them to certain real subspaces of H is established. Under the supposition that the underlying W*-algebra is commutative, a Tomita-Takesaki type theorem is stated. The natural cone in H arising from the pair (M, x-bar) is investigated and its properties are obtained

  3. A micromechanics model of the elastic properties of human dentine

    Energy Technology Data Exchange (ETDEWEB)

    Kinney, J. H. [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); Balooch, M. [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); Marshall, G. W. [Univ. of California, San Francisco, CA (United States). Dept. of Restorative Dentistry; Marshall, S. J. [Univ. of California, San Francisco, CA (United States). Dept. of Restorative Dentistry

    1999-10-01

    A generalized self-consistent model of cylindrical inclusions in a homogeneous and isotropic matrix phase was used to study the effects of tubule orientation on the elastic properties of dentin. Closed form expressions for the five independent elastic constants of dentin were derived in terms of tubule concentration, and the Young's moduli and Poisson ratios of peri- and intertubular dentin. An atomic force microscope (AFM) indentation technique determined the Young's moduli of the peri- and intertubular dentin as approximately 30 GPa and 15 GPa, respectively. Over the natural variation in tubule density found in dentin, there was only a slight variation in the axial and transverse shear moduli with position in the tooth, and there was no measurable effect of tubule orientation. We conclude that tubule orientation has no appreciable effect on the elastic behavior of normal dentin, and that the elastic properties of healthy dentin can be modeled as an isotropic continuum with a Young's modulus of approximately 16 GPa and a shear modulus of 6.2 GPa.

  4. Longitudinal sound velocities, elastic anisotropy, and phase transition of high-pressure cubic H2O ice to 82 GPa

    Science.gov (United States)

    Kuriakose, Maju; Raetz, Samuel; Hu, Qing Miao; Nikitin, Sergey M.; Chigarev, Nikolay; Tournat, Vincent; Bulou, Alain; Lomonosov, Alexey; Djemia, Philippe; Gusev, Vitalyi E.; Zerr, Andreas

    2017-10-01

    Water ice is a molecular solid whose behavior under compression reveals the interplay of covalent bonding in molecules and forces acting between them. This interplay determines high-pressure phase transitions, the elastic and plastic behavior of H2O ice, which are the properties needed for modeling the convection and internal structure of the giant planets and moons of the solar system as well as H2O -rich exoplanets. We investigated experimentally and theoretically elastic properties and phase transitions of cubic H2O ice at room temperature and high pressures between 10 and 82 GPa. The time-domain Brillouin scattering (TDBS) technique was used to measure longitudinal sound velocities (VL) in polycrystalline ice samples compressed in a diamond anvil cell. The high spatial resolution of the TDBS technique revealed variations of VL caused by elastic anisotropy, allowing us to reliably determine the fastest and the slowest sound velocity in a single crystal of cubic H2O ice and thus to evaluate existing equations of state. Pressure dependencies of the single-crystal elastic moduli Ci j(P ) of cubic H2O ice to 82 GPa have been obtained which indicate its hardness and brittleness. These results were compared with ab initio calculations. It is suggested that the transition from molecular ice VII to ionic ice X occurs at much higher pressures than proposed earlier, probably above 80 GPa.

  5. First principle calculations of alkali hydride electronic structures

    International Nuclear Information System (INIS)

    Novakovic, N; Radisavljevic, I; Colognesi, D; Ostojic, S; Ivanovic, N

    2007-01-01

    Electronic structure, volume optimization, bulk moduli, elastic constants, and frequencies of the transversal optical vibrations in LiH, NaH, KH, RbH, and CsH are calculated using the full potential augmented plane wave method, extended with local orbitals, and the full potential linearized augmented plane wave method. The obtained results show some common features in the electronic structure of these compounds, but also clear differences, which cannot be explained using simple empirical trends. The differences are particularly prominent in the electronic distributions and interactions in various crystallographic planes. In the light of these findings we have elaborated some selected experimental results and discussed several theoretical approaches frequently used for the description of various alkali hydride properties

  6. Moduli effective action in warped brane-world compactifications

    Energy Technology Data Exchange (ETDEWEB)

    Garriga, Jaume E-mail: garriga@ifae.es; Pujolas, Oriol; Tanaka, Takahiro

    2003-04-07

    We consider a class of 5D brane-world solutions with a power-law warp factor a(y){proportional_to}y{sup q}, and bulk dilaton with profile phi{proportional_to}lny, where y is the proper distance in the extra dimension. This class includes the heterotic M-theory brane-world of [Phys. Rev. D 59 (1999) 086001, and] and the Randall-Sundrum (RS) model as a limiting case. In general, there are two moduli fields y{sub {+-}}, corresponding to the 'positions' of two branes (which live at the fixed points of an orbifold compactification). Classically, the moduli are massless, due to a scaling symmetry of the action. However, in the absence of supersymmetry, they develop an effective potential at one loop. Local terms proportional to K{sub {+-}}{sup 4}, where K{sub {+-}}=q/y{sub {+-}} is the local curvature scale at the location of the corresponding brane, are needed in order to remove the divergences in the effective potential. Such terms break the scaling symmetry and hence they may act as stabilizers for the moduli. When the branes are very close to each other, the effective potential induced by massless bulk fields behaves like V{approx}d{sup -4}, where d is the separation between branes. When the branes are widely separated, the potentials for each one of the moduli generically develop a 'Coleman-Weinberg'-type behaviour of the form a{sup 4}(y{sub {+-}})K{sub {+-}}{sup 4}ln(K{sub {+-}}/{mu}{sub {+-}}), where {mu}{sub {+-}} are renormalization scales. In the RS case, the bulk geometry is AdS and K{sub {+-}} are equal to a constant, independent of the position of the branes, so these terms do not contribute to the mass of the moduli. However, for generic warp factor, they provide a simple stabilization mechanism. For q > or approx. 10, the observed hierarchy can be naturally generated by this potential, giving the lightest modulus a mass of order m{sub -} < or approx. TeV.

  7. Wave anisotropy of shear viscosity and elasticity

    Science.gov (United States)

    Rudenko, O. V.; Sarvazyan, A. P.

    2014-11-01

    The paper presents the theory of shear wave propagation in a "soft solid" material possessing anisotropy of elastic and dissipative properties. The theory is developed mainly for understanding the nature of the low-frequency acoustic characteristics of skeletal muscles, which carry important diagnostic information on the functional state of muscles and their pathologies. It is shown that the shear elasticity of muscles is determined by two independent moduli. The dissipative properties are determined by the fourth-rank viscosity tensor, which also has two independent components. The propagation velocity and attenuation of shear waves in muscle depend on the relative orientation of three vectors: the wave vector, the polarization vector, and the direction of muscle fiber. For one of the many experiments where attention was distinctly focused on the vector character of the wave process, it was possible to make a comparison with the theory, estimate the elasticity moduli, and obtain agreement with the angular dependence of the wave propagation velocity predicted by the theory.

  8. Young's moduli of carbon materials investigated by various classical molecular dynamics schemes

    Science.gov (United States)

    Gayk, Florian; Ehrens, Julian; Heitmann, Tjark; Vorndamme, Patrick; Mrugalla, Andreas; Schnack, Jürgen

    2018-05-01

    For many applications classical carbon potentials together with classical molecular dynamics are employed to calculate structures and physical properties of such carbon-based materials where quantum mechanical methods fail either due to the excessive size, irregular structure or long-time dynamics. Although such potentials, as for instance implemented in LAMMPS, yield reasonably accurate bond lengths and angles for several carbon materials such as graphene, it is not clear how accurate they are in terms of mechanical properties such as for instance Young's moduli. We performed large-scale classical molecular dynamics investigations of three carbon-based materials using the various potentials implemented in LAMMPS as well as the EDIP potential of Marks. We show how the Young's moduli vary with classical potentials and compare to experimental results. Since classical descriptions of carbon are bound to be approximations it is not astonishing that different realizations yield differing results. One should therefore carefully check for which observables a certain potential is suited. Our aim is to contribute to such a clarification.

  9. Elastic properties of Ti-24Nb-4Zr-8Sn single crystals with bcc crystal structure

    International Nuclear Information System (INIS)

    Zhang, Y.W.; Li, S.J.; Obbard, E.G.; Wang, H.; Wang, S.C.; Hao, Y.L.; Yang, R.

    2011-01-01

    Research highlights: → The single crystals of Ti2448 alloy with the bcc crystal structure were prepared. → The elastic moduli and constants were measured by several resonant methods. → The crystal shows significant elastic asymmetry in tension and compression. → The crystal exhibits weak nonlinear elasticity with large elastic strain ∼2.5%. → The crystal has weak atomic interactions against crystal distortion to low symmetry. - Abstract: Single crystals of Ti2448 alloy (Ti-24Nb-4Zr-8Sn in wt.%) were grown successfully using an optical floating-zone furnace. Several kinds of resonant methods gave consistent Young's moduli of 27.1, 56.3 and 88.1 GPa and shear moduli of 34.8, 11.0 and 14.6 GPa for the , and oriented single crystals, and C 11 , C 12 and C 44 of 57.2, 36.1 and 35.9 GPa respectively. Uniaxial testing revealed asymmetrical elastic behaviors of the crystals: tension caused elastic softening with a large reversible strain of ∼4% and a stress plateau of ∼250 MPa, whereas compression resulted in gradual elastic stiffening with much smaller reversible strain. The crystals exhibited weak nonlinear elasticity with a large elastic strain of ∼2.5% and a high strength, approaching ∼20% and ∼30% of its ideal shear and ideal tensile strength respectively. The crystals showed linear elasticity with a small elastic strain of ∼1%. These elastic deformation characteristics have been interpreted in terms of weakened atomic interactions against crystal distortion to low crystal symmetry under external applied stresses. These results are consistent with the properties of polycrystalline Ti2448, including high strength, low elastic modulus, large recoverable strain and weak strengthening effect due to grain refinement.

  10. First-principles calculation of the structural and elastic properties of ternary metal nitrides TaxMo1-xN and TaxW1-xN

    Science.gov (United States)

    Bouamama, Kh.; Djemia, P.; Benhamida, M.

    2015-09-01

    First-principles pseudo-potentials calculations of the mixing enthalpy, of the lattice constants a0 and of the single-crystal elastic constants cij for ternary metal nitrides TaxMe1-xN (Me=Mo or W) alloys considering the cubic B1-rocksalt structure is carried out. For disordered ternary alloys, we employ the virtual crystal approximation VCA in which the alloy pseudopotentials are constructed within a first-principles VCA scheme. The supercell method SC is also used for ordered structures in order to evaluate clustering effects. We find that the mixing enthalpy still remains negative for TaxMe1-xN alloys in the whole composition range which implies these cubic TaxMo1-xN and TaxW1-xN ordered solid solutions are stable. We investigate the effect of Mo and W alloying on the trend of the mechanical properties of TaN. The effective shear elastic constant c44, the Cauchy pressure (c12-c44), and the shear to bulk modulus G/B ratio are used to discuss, respectively, the mechanical stability of the ternary structure and the brittle/ductile behavior in reference to TaN, MeN alloys. We determine the onset transition from the unstable structure to the stable one B1-rocksalt from the elastic stability criteria when alloying MeN with Ta. In a second stage, in the frame of anisotropic elasticity, we estimate by one homogenization method the averaged constants of the polycrystalline TaxMe1-xN alloys considering the special case of an isotropic medium with no crystallographic texture.

  11. Hybrid elastic solids

    KAUST Repository

    Lai, Yun

    2011-06-26

    Metamaterials can exhibit electromagnetic and elastic characteristics beyond those found in nature. In this work, we present a design of elastic metamaterial that exhibits multiple resonances in its building blocks. Band structure calculations show two negative dispersion bands, of which one supports only compressional waves and thereby blurs the distinction between a fluid and a solid over a finite frequency regime, whereas the other displays super anisotropy-in which compressional waves and shear waves can propagate only along different directions. Such unusual characteristics, well explained by the effective medium theory, have no comparable analogue in conventional solids and may lead to novel applications. © 2011 Macmillan Publishers Limited. All rights reserved.

  12. Hybrid elastic solids

    KAUST Repository

    Lai, Yun; Wu, Ying; Sheng, Ping; Zhang, Zhaoqing

    2011-01-01

    Metamaterials can exhibit electromagnetic and elastic characteristics beyond those found in nature. In this work, we present a design of elastic metamaterial that exhibits multiple resonances in its building blocks. Band structure calculations show two negative dispersion bands, of which one supports only compressional waves and thereby blurs the distinction between a fluid and a solid over a finite frequency regime, whereas the other displays super anisotropy-in which compressional waves and shear waves can propagate only along different directions. Such unusual characteristics, well explained by the effective medium theory, have no comparable analogue in conventional solids and may lead to novel applications. © 2011 Macmillan Publishers Limited. All rights reserved.

  13. Remarks on orthotropic elastic models applied to wood

    Directory of Open Access Journals (Sweden)

    Nilson Tadeu Mascia

    2006-09-01

    Full Text Available Wood is generally considered an anisotropic material. In terms of engineering elastic models, wood is usually treated as an orthotropic material. This paper presents an analysis of two principal anisotropic elastic models that are usually applied to wood. The first one, the linear orthotropic model, where the material axes L (Longitudinal, R( radial and T(tangential are coincident with the Cartesian axes (x, y, z, is more accepted as wood elastic model. The other one, the cylindrical orthotropic model is more adequate of the growth caracteristics of wood but more mathematically complex to be adopted in practical terms. Specifically due to its importance in wood elastic parameters, this paper deals with the fiber orientation influence in these models through adequate transformation of coordinates. As a final result, some examples of the linear model, which show the variation of elastic moduli, i.e., Young´s modulus and shear modulus, with fiber orientation are presented.

  14. Investigation of structural, electronic and anisotropic elastic properties of Ru-doped WB{sub 2} compound by increased valence electron concentration

    Energy Technology Data Exchange (ETDEWEB)

    Surucu, Gokhan, E-mail: g_surucu@yahoo.com [Ahi Evran University, Department of Electric and Energy, 40100, Kirsehir (Turkey); Gazi University, Photonics Application and Research Center, 06500, Ankara (Turkey); Kaderoglu, Cagil [Ankara University, Department of Engineering Physics, 06100, Ankara (Turkey); Deligoz, Engin; Ozisik, Haci [Aksaray University, Department of Physics, 68100, Aksaray (Turkey)

    2017-03-01

    First principles density functional theory (DFT) calculations have been used to investigate the structural, anisotropic elastic and electronic properties of ruthenium doped tungsten-diboride ternary compounds (W{sub 1−x}Ru{sub x}B{sub 2}) for an increasing molar fraction of Ru atom from 0.1 to 0.9 by 0.1. Among the nine different compositions, W{sub 0.3}Ru{sub 0.7}B{sub 2} has been found as the most stable one due to the formation energy and band filling theory calculations. Moreover, the band structures and partial density of states (PDOS) have been computed for each x composition. After obtaining the elastic constants for all x compositions, the secondary results such as Bulk modulus, Young’s modulus, Poisson’s ratio, Shear modulus, and Vickers Hardness of polycrystalline aggregates have been derived and the relevant mechanical properties have been discussed. In addition, the elastic anisotropy has been visualized in detail by plotting the directional dependence of compressibility, Poisson ratio, Young’s and Shear moduli. - Highlights: • Effects of Ru substitution in WB{sub 2} using increased valence electron concentration. • Structural, electronic, mechanic and elastic properties for increasing Ru content. • Considered alloys are incompressible, brittle, stiffer and high hard materials.

  15. Quasi-experimental taxation elasticities of US gasoline demand

    International Nuclear Information System (INIS)

    Goel, R.K.

    1994-01-01

    Taxation elasticities provide inputs in public policy aimed at raising revenues. Using the quasi-experimental method, this paper calculates gasoline taxation elasticities for the USA over 1952-86. The medium (mean) elasticity over this period is found to be -0.075 (-0.122). However, the elasticity following the oil shock of 1973 is found to be statistically different from the pre-shock elasticity. Reasons for this change in elasticity are discussed. The implication of this analysis is that tax policies based on price elasticities, rather than on tax elasticities, might be using an inappropriate elasticity estimate and consequently misinterpreting the government's ability to raise tax revenues. (author)

  16. Cell elasticity with altered cytoskeletal architectures across multiple cell types.

    Science.gov (United States)

    Grady, Martha E; Composto, Russell J; Eckmann, David M

    2016-08-01

    The cytoskeleton is primarily responsible for providing structural support, localization and transport of organelles, and intracellular trafficking. The structural support is supplied by actin filaments, microtubules, and intermediate filaments, which contribute to overall cell elasticity to varying degrees. We evaluate cell elasticity in five different cell types with drug-induced cytoskeletal derangements to probe how actin filaments and microtubules contribute to cell elasticity and whether it is conserved across cell type. Specifically, we measure elastic stiffness in primary chondrocytes, fibroblasts, endothelial cells (HUVEC), hepatocellular carcinoma cells (HUH-7), and fibrosarcoma cells (HT 1080) subjected to two cytoskeletal destabilizers: cytochalasin D and nocodazole, which disrupt actin and microtubule polymerization, respectively. Elastic stiffness is measured by atomic force microscopy (AFM) and the disruption of the cytoskeleton is confirmed using fluorescence microscopy. The two cancer cell lines showed significantly reduced elastic moduli values (~0.5kPa) when compared to the three healthy cell lines (~2kPa). Non-cancer cells whose actin filaments were disrupted using cytochalasin D showed a decrease of 60-80% in moduli values compared to untreated cells of the same origin, whereas the nocodazole-treated cells showed no change in elasticity. Overall, we demonstrate actin filaments contribute more to elastic stiffness than microtubules but this result is cell type dependent. Cancer cells behaved differently, exhibiting increased stiffness as well as stiffness variability when subjected to nocodazole. We show that disruption of microtubule dynamics affects cancer cell elasticity, suggesting therapeutic drugs targeting microtubules be monitored for significant elastic changes. Copyright © 2016 Elsevier Ltd. All rights reserved.

  17. Strain fluctuations and elastic constants

    Energy Technology Data Exchange (ETDEWEB)

    Parrinello, M.; Rahman, A.

    1982-03-01

    It is shown that the elastic strain fluctuations are a direct measure of elastic compliances in a general anisotropic medium; depending on the ensemble in which the fluctuation is measured either the isothermal or the adiabatic compliances are obtained. These fluctuations can now be calculated in a constant enthalpy and pressure, and hence, constant entropy, ensemble due to recent develpments in the molecular dynamics techniques. A calculation for a Ni single crystal under uniform uniaxial 100 tensile or compressive load is presented as an illustration of the relationships derived between various strain fluctuations and the elastic modulii. The Born stability criteria and the behavior of strain fluctuations are shown to be related.

  18. Elastic Beanstalk

    CERN Document Server

    Vliet, Jurg; Wel, Steven; Dowd, Dara

    2011-01-01

    While it's always been possible to run Java applications on Amazon EC2, Amazon's Elastic Beanstalk makes the process easier-especially if you understand how it works beneath the surface. This concise, hands-on book not only walks you through Beanstalk for deploying and managing web applications in the cloud, you'll also learn how to use this AWS tool in other phases of development. Ideal if you're a developer familiar with Java applications or AWS, Elastic Beanstalk provides step-by-step instructions and numerous code samples for building cloud applications on Beanstalk that can handle lots

  19. Gauge and moduli hierarchy in a multiply warped braneworld scenario

    International Nuclear Information System (INIS)

    Das, Ashmita; SenGupta, Soumitra

    2013-01-01

    Discovery of Higgs-like boson near the mass scale ∼126 Gev generates renewed interest to the gauge hierarchy problem in the standard model related to the stabilisation of the Higgs mass within Tev scale without any unnatural fine tuning. One of the successful attempts to resolve this problem has been the Randall–Sundrum warped geometry model. Subsequently this 5-dimensional model was extended to a doubly warped 6-dimensional (or higher) model which can offer a geometric explanation of the fermion mass hierarchy in the standard model of elementary particles (D. Choudhury and S. SenGupta, 2007 [1]). In an attempt to address the dark energy issue, we in this work extend such 6-dimensional warped braneworld model to include non-flat 3-branes at the orbifold fixed points such that a small but non-vanishing brane cosmological constant is induced in our observable brane. We show that the requirements of a Planck to Tev scale warping along with a vanishingly small but non-zero cosmological constant on the visible brane with non-hierarchical moduli, each with scale close to Planck length, lead to a scenario where the 3-branes can have energy scales either close to Tev or close to Planck scale. Such a scenario can address both the gauge hierarchy as well as fermion mass hierarchy problem in standard model without introducing hierarchical scales between the two moduli. Thus simultaneous resolutions to the gauge hierarchy problem, fermion mass hierarchy problem and non-hierarchical moduli problem are closely linked with the near flatness condition of our universe.

  20. Elastic wave velocities of iron-bearing Ringwoodite (Mg0.8Fe0.2)2SiO2 to 12GPa at room temperature

    Science.gov (United States)

    Higo, Y.; Li, B.; Inoue, T.; Irifune, T.; Libermann, R. C.

    2002-12-01

    At present, it is widely accepted that olivine is the most important mineral in the Earth's upper mantle. The elastic property changes associated with the phase transformations to its high-pressure polymorphs are very important parameters to constrain the composition of the mantle transition zone. In this study, we measured the elastic wave velocity of iron-bearing Ringwoodite (Mg0.8Fe0.2)2SiO4. The specimen was hot-pressed at 18GPa and 1273K in a 2000-ton Uniaxial Split Sphere Apparatus (ORANGE-2000: GRC at ehime university). The recovered polycrystalline specimen was characterized by x-ray diffraction, EPMA, ultrasonic techniques, and the density was determined by Archimedes' method, and found to be single-phase and fine-grained. Bench top measurements of the compressional and shear wave velocities yielded Vp=9.10 km/s and Vs=5.52 km/s. High-pressure ultrasonic measurement was carried out in a 1000-ton Uniaxial Split-Cylinder Apparatus (USCA-1000: SUNY) at pressures up to 12GPa at room temperature using ZnTe as internal pressure marker. The sample was surrounded by lead to minimize the deviatoric stress. Also in this experiment, the travel times of the Al2O3 buffer rod were used for pressure calculation. The travel times of the buffer rod under the same cell geometry have been calibrated as a function of sample pressure by the thermal equation of state of NaCl using in-situ X-ray diffraction techniques. The results of our high-pressure experiment, including the elastic moduli and their pressure dependence, effect of iron on the elastic moduli, as well as their implication for the mantle transition zone, will be presented.

  1. Moduli stabilization and uplifting with dynamically generated F-terms

    International Nuclear Information System (INIS)

    Dudas, Emilian; Papineau, Chloe; Pokorski, Stefan

    2007-01-01

    We use the F-term dynamical supersymmetry breaking models with metastable vacua in order to uplift the vacuum energy in the KKLT moduli stabilization scenario. The main advantage compared to earlier proposals is the manifest supersymmetric treatment and the natural coexistence of a TeV gravitino mass with a zero cosmological constant. We argue that it is generically difficult to avoid anti de-Sitter supersymmetric minima, however the tunneling rate from the metastable vacuum with zero vacuum energy towards them can be very suppressed. We briefly comment on the properties of the induced soft terms in the observable sector

  2. Moduli stabilization and uplifting with dynamically generated F-terms

    Energy Technology Data Exchange (ETDEWEB)

    Dudas, Emilian [CERN Theory Division, CH-1211, Geneva 23 (Switzerland); Papineau, Chloe [CPhT, Ecole Polytechnique, F-91128 Palaiseau Cedex (France); Pokorski, Stefan [Institute of Theoretical Physics, Univ. of Warsaw, 00-681 Warsaw (Poland)

    2007-02-15

    We use the F-term dynamical supersymmetry breaking models with metastable vacua in order to uplift the vacuum energy in the KKLT moduli stabilization scenario. The main advantage compared to earlier proposals is the manifest supersymmetric treatment and the natural coexistence of a TeV gravitino mass with a zero cosmological constant. We argue that it is generically difficult to avoid anti de-Sitter supersymmetric minima, however the tunneling rate from the metastable vacuum with zero vacuum energy towards them can be very suppressed. We briefly comment on the properties of the induced soft terms in the observable sector.

  3. Fixing All Moduli in a Simple F-Theory Compactification

    International Nuclear Information System (INIS)

    Denef, F.

    2005-01-01

    We discuss a simple example of an F-theory compactification on a Calabi-Yau fourfold where background fluxes, together with nonperturbative effects from Euclidean D3 instantons and gauge dynamics on D7 branes, allow us to fix all closed and open string moduli. We explicitly check that the known higher order corrections to the potential, which we neglect in our leading approximation, only shift the results by a small amount. In our exploration of the model, we encounter interesting new phenomena, including examples of transitions where D7 branes absorb O3 planes, while changing topology to preserve the net D3 charge

  4. Non-minimal gauge mediation and moduli stabilization

    International Nuclear Information System (INIS)

    Jelinski, T.; Lalak, Z.; Pawelczyk, J.

    2010-01-01

    In this Letter we consider U(1) A -gauged Polonyi model with two spurions coupled to a twisted closed string modulus. This offers a consistent setup for metastable SUSY breakdown which allows for moduli stabilization and naturally leads to gauge or hybrid gauge/gravitational mediation mechanism. Due to the presence of the second spurion one can arrange for a solution of the μ and B μ problems in a version of modified Giudice-Masiero mechanism, which works both in the limit of pure gauge mediation and in the mixed regime of hybrid mediation.

  5. Moduli/inflaton mixing with supersymmetry breaking field

    Energy Technology Data Exchange (ETDEWEB)

    Endo, M.; Takahashi, F. [Deutsches Elektronen-Synchrotron (DESY), Hamburg (Germany)]|[Tokyo Univ. (Japan). Inst. for Cosmic Ray Research; Hamaguchi, K. [Deutsches Elektronen-Synchrotron (DESY), Hamburg (Germany)]|[Tokyo Univ. (Japan). Dept. of Physics

    2006-05-15

    A heavy scalar field such as moduli or an inflaton generally mixes with a field responsible for the supersymmetry breaking. We study the scalar decay into the standard model particles and their superpartners, gravitinos, and the supersymmetry breaking sector, particularly paying attention to decay modes that proceed via the mixing between the scalar and the supersymmetry breaking field. The impacts of the new decay processes on cosmological scenarios are also discussed; the modulus field generically produces too much gravitinos, and most of the inflation models tend to result in too high reheating temperature and/or gravitino overproduction. (Orig.)

  6. Structural, elastic, mechanical and thermodynamic properties of Terbium oxide: First-principles investigations

    Directory of Open Access Journals (Sweden)

    Samah Al-Qaisi

    Full Text Available First-principles investigations of the Terbium oxide TbO are performed on structural, elastic, mechanical and thermodynamic properties. The investigations are accomplished by employing full potential augmented plane wave FP-LAPW method framed within density functional theory DFT as implemented in the WIEN2k package. The exchange-correlation energy functional, a part of the total energy functional, is treated through Perdew Burke Ernzerhof scheme of the Generalized Gradient Approximation PBEGGA. The calculations of the ground state structural parameters, like lattice constants a0, bulk moduli B and their pressure derivative B′ values, are done for the rock-salt RS, zinc-blende ZB, cesium chloride CsCl, wurtzite WZ and nickel arsenide NiAs polymorphs of the TbO compound. The elastic constants (C11, C12, C13, C33, and C44 and mechanical properties (Young’s modulus Y, Shear modulus S, Poisson’s ratio σ, Anisotropic ratio A and compressibility β, were also calculated to comprehend its potential for valuable applications. From our calculations, the RS phase of TbO compound was found strongest one mechanically amongst the studied cubic structures whereas from hexagonal phases, the NiAs type structure was found stronger than WZ phase of the TbO. To analyze the ductility of the different structures of the TbO, Pugh’s rule (B/SH and Cauchy pressure (C12–C44 approaches are used. It was found that ZB, CsCl and WZ type structures of the TbO were of ductile nature with the obvious dominance of the ionic bonding while RS and NiAs structures exhibited brittle nature with the covalent bonding dominance. Moreover, Debye temperature was calculated for both cubic and hexagonal structures of TbO in question by averaging the computed sound velocities. Keywords: DFT, TbO, Elastic properties, Thermodynamic properties

  7. Program POD; A computer code to calculate nuclear elastic scattering cross sections with the optical model and neutron inelastic scattering cross sections by the distorted-wave born approximation

    International Nuclear Information System (INIS)

    Ichihara, Akira; Kunieda, Satoshi; Chiba, Satoshi; Iwamoto, Osamu; Shibata, Keiichi; Nakagawa, Tsuneo; Fukahori, Tokio; Katakura, Jun-ichi

    2005-07-01

    The computer code, POD, was developed to calculate angle-differential cross sections and analyzing powers for shape-elastic scattering for collisions of neutron or light ions with target nucleus. The cross sections are computed with the optical model. Angle-differential cross sections for neutron inelastic scattering can also be calculated with the distorted-wave Born approximation. The optical model potential parameters are the most essential inputs for those model computations. In this program, the cross sections and analyzing powers are obtained by using the existing local or global parameters. The parameters can also be inputted by users. In this report, the theoretical formulas, the computational methods, and the input parameters are explained. The sample inputs and outputs are also presented. (author)

  8. Elastic-plastic analysis of the toroidal field coil inner leg of the compact ignition tokamak

    International Nuclear Information System (INIS)

    Horie, T.

    1987-07-01

    Elastic-plastic analyses were made for the inner leg of the Compact Ignition Tokamak toroidal field (TF) coil, which is made of copper-Inconel composite material. From the result of the elastic-plastic analysis, the effective Young's moduli of the inner leg were determined by the analytical equations. These Young's moduli are useful for the three-dimensional, elastic, overall TF coil analysis. Comparison among the results of the baseline design (R = 1.324 m), the bucked pressless design, the 1.527-m major radius design, and the 1.6-m major radius design was also made, based on the elastic-plastic TF coil inner leg analyses

  9. The output least-squares approach to estimating Lamé moduli

    Science.gov (United States)

    Gockenbach, Mark S.

    2007-12-01

    The Lamé moduli of a heterogeneous, isotropic, planar membrane can be estimated by observing the displacement of the membrane under a known edge traction, and choosing estimates of the moduli that best predict the observed displacement under a finite-element simulation. This algorithm converges to the exact moduli given pointwise measurements of the displacement on an increasingly fine mesh. The error estimates that prove this convergence also show the instability of the inverse problem.

  10. Elastic modulus, microplastic properties and durability of titanium alloys for biomedical applications

    Czech Academy of Sciences Publication Activity Database

    Betekhtin, V. I.; Kolobov, Yu. R.; Golosova, O. A.; Dvořák, Jiří; Sklenička, Václav; Kardashev, B. K.; Kadomtsev, A. G.; Narykova, M. V.; Ivanov, M. B.

    2016-01-01

    Roč. 45, 1-2 (2016), s. 42-51 ISSN 1606-5131 Institutional support: RVO:68081723 Keywords : Creep * Elastic moduli * Plastic flow * Beta-type titanium alloys * Biomedical applications Subject RIV: JG - Metallurgy Impact factor: 2.500, year: 2016

  11. Elastic properties of rigid fiber-reinforced composites

    Science.gov (United States)

    Chen, J.; Thorpe, M. F.; Davis, L. C.

    1995-05-01

    We study the elastic properties of rigid fiber-reinforced composites with perfect bonding between fibers and matrix, and also with sliding boundary conditions. In the dilute region, there exists an exact analytical solution. Around the rigidity threshold we find the elastic moduli and Poisson's ratio by decomposing the deformation into a compression mode and a rotation mode. For perfect bonding, both modes are important, whereas only the compression mode is operative for sliding boundary conditions. We employ the digital-image-based method and a finite element analysis to perform computer simulations which confirm our analytical predictions.

  12. On a new compactification of the moduli of vector bundles on a surface

    International Nuclear Information System (INIS)

    Timofeeva, N V

    2008-01-01

    A new compactification of the moduli scheme of Gieseker-stable vector bundles with prescribed Hilbert polynomial on a smooth projective polarized surface (S,H) defined over a field k=k-bar of characteristic zero is constructed. The families of locally free sheaves on the surface S are completed by locally free sheaves on surfaces that are certain modifications of S. The new moduli space has a birational morphism onto the Gieseker-Maruyama moduli space. The case when the Gieseker-Maruyama space is a fine moduli space is considered. Bibliography: 12 titles.

  13. On a new compactification of moduli of vector bundles on a surface. III: Functorial approach

    International Nuclear Information System (INIS)

    Timofeeva, Nadezhda V

    2011-01-01

    A new compactification for the scheme of moduli for Gieseker-stable vector bundles with prescribed Hilbert polynomial on the smooth projective polarized surface (S,L) is constructed. We work over the field k=k-bar of characteristic zero. Families of locally free sheaves on the surface S are completed with locally free sheaves on schemes which are modifications of S. The Gieseker-Maruyama moduli space has a birational morphism onto the new moduli space. We propose the functor for families of pairs 'polarized scheme-vector bundle' with moduli space of such type. Bibliography: 16 titles.

  14. How Pore Filling Shale Affects Elastic Wave Velocities in Fully and Partially Saturated Sandstone: Characterization, Measurement, and Modelling

    DEFF Research Database (Denmark)

    Sørensen, Morten Kanne; Fabricius, Ida Lykke

    2017-01-01

    The elastic bulk modulus of a sandstone is affected by the fluid saturation as compression induces a pressure in the fluid thus increasing the bulk modulus of the sandstone as a whole. Assuming a uniform induced pressure and no interaction between the saturating fluid and the solid rock the fluid...... contribution to the elastic bulk modulus is quantified by Gassmann's equations. Experimental measurements of the fluid contribution to the elastic moduli are, however often much larger than predicted within the assumptions of Gassmann. Clay-rich low-mobility sandstones are especially prone to having elastic...... moduli highly sensitive to the fluid saturation. The presence of clay in a sandstone can affect two of the underlying assumptions to Gassmann's equations: decreased fluid mobility can cause pressure gradients and fluid-clay interactions are common. The elastic and petrophysical properties of clay...

  15. Elastic scattering

    International Nuclear Information System (INIS)

    Leader, Elliot

    1991-01-01

    With very few unexplained results to challenge conventional ideas, physicists have to look hard to search for gaps in understanding. An area of physics which offers a lot more than meets the eye is elastic and diffractive scattering where particles either 'bounce' off each other, emerging unscathed, or just graze past, emerging relatively unscathed. The 'Blois' workshops provide a regular focus for this unspectacular, but compelling physics, attracting highly motivated devotees

  16. Li-ion conduction in the LiBH4:LiI system from Density Functional Theory calculations and Quasi-Elastic Neutron Scattering

    DEFF Research Database (Denmark)

    Myrdal, Jon Steinar Gardarsson; Blanchard, Didier; Sveinbjörnsson, Dadi Þorsteinn

    2013-01-01

    The hexagonal high-temperature polymorph of LiBH4 is stabilized by solid solution with LiI to exhibit superionic Li+ ionic conductivity at room temperature. Herein, the mechanisms for the Li+ diffusion are investigated for the first time by density functional theory (DFT) calculations coupled...

  17. Spectral dimension of elastic Sierpinski gaskets with general elastic forces

    International Nuclear Information System (INIS)

    Liu, S.H.; Liu, A.J.

    1985-01-01

    The spectral dimension is calculated for a Sierpinski gasket with the most general elastic restoring forces allowed by symmetry. The elastic forces consist of bond-stretching and angle-bending components. The spectral dimension is the same as that for the bond-stretching-force (central-force) model. This demonstrates that on the Sierpinski gasket the two types of forces belong to the same universality class

  18. Rock Physical Interpretation of the Relationship between Dynamic and Static Young's Moduli of Sedimentary Rocks

    Science.gov (United States)

    Takahashi, T.

    2017-12-01

    The static Young's modulus (deformability) of a rock is indispensable for designing and constructing tunnels, dams and underground caverns in civil engineering. Static Young's modulus which is an elastic modulus at large strain level is usually obtained with the laboratory tests of rock cores sampled in boreholes drilled in a rock mass. A deformability model of the entire rock mass is then built by extrapolating the measurements based on a rock mass classification obtained in geological site characterization. However, model-building using data obtained from a limited number of boreholes in the rock mass, especially a complex rock mass, may cause problems in the accuracy and reliability of the model. On the other hand, dynamic Young's modulus which is the modulus at small strain level can be obtained from seismic velocity. If dynamic Young's modulus can be rationally converted to static one, a seismic velocity model by the seismic method can be effectively used to build a deformability model of the rock mass. In this study, we have, therefore, developed a rock physics model (Mavko et al., 2009) to estimate static Young's modulus from dynamic one for sedimentary rocks. The rock physics model has been generally applied to seismic properties at small strain level. In the proposed model, however, the sandy shale model, one of rock physics models, is extended for modeling the static Young's modulus at large strain level by incorporating the mixture of frictional and frictionless grain contacts into the Hertz-Mindlin model. The proposed model is verified through its application to the dynamic Young's moduli derived from well log velocities and static Young's moduli measured in the tri-axial compression tests of rock cores sampled in the same borehole as the logs were acquired. This application proves that the proposed rock physics model can be possibly used to estimate static Young's modulus (deformability) which is required in many types of civil engineering applications

  19. Elastic response of thermal spray deposits under indentation tests

    International Nuclear Information System (INIS)

    Leigh, S.H.; Lin, C.K.; Berndt, C.C.

    1997-01-01

    The elastic response behavior of thermal spray deposits at Knoop indentations has been investigated using indentation techniques. The ration of hardness to elastic modulus, which is an important prerequisite for the evaluation of indentation fracture toughness, is determined by measuring the elastic recovery of the in-surface dimensions of Knoop indentations. The elastic moduli of thermal spray deposits are in the range of 12%--78% of the comparable bulk materials and reveal the anisotropic behavior of thermal spray deposits. A variety of thermal spray deposits has been examined, including Al 2 O 3 , yttria-stabilized ZrO 2 (YSZ), and NiAl. Statistical tools have been used to evaluate the error estimates of the data

  20. Structural and elastic properties of defect chalcopyrite HgGa{sub 2}S{sub 4} under high pressure

    Energy Technology Data Exchange (ETDEWEB)

    Gomis, O., E-mail: osgohi@fis.upv.es [Centro de Tecnologías Físicas: Acústica, Materiales y Astrofísica, MALTA Consolider Team, Universitat Politècnica de València, 46022 València (Spain); Santamaría-Pérez, D. [Departamento de Física Aplicada-ICMUV, MALTA Consolider Team, Universitat de València, Edificio de Investigación, C/Dr. Moliner 50, Burjassot, 46100 València (Spain); Departamento de Química Física I, Universidad Complutense de Madrid, MALTA Consolider Team, Avenida Complutense s/n, 28040 Madrid (Spain); Vilaplana, R.; Luna, R. [Centro de Tecnologías Físicas: Acústica, Materiales y Astrofísica, MALTA Consolider Team, Universitat Politècnica de València, 46022 València (Spain); Sans, J.A.; Manjón, F.J. [Instituto de Diseño para la Fabricación y Producción Automatizada, MALTA Consolider Team, Universitat Politècnica de València, 46022 València (Spain); Errandonea, D. [Departamento de Física Aplicada-ICMUV, MALTA Consolider Team, Universitat de València, Edificio de Investigación, C/Dr. Moliner 50, Burjassot, 46100 València (Spain); and others

    2014-01-15

    Highlights: • Single crystals of HgGa{sub 2}S{sub 4} with defect-chalcopyrite (DC) structure were synthesized. • High-pressure X-ray diffraction in DC-HgGa{sub 2}S{sub 4} was performed. • Equation of state of DC-HgGa{sub 2}S{sub 4} determined (bulk modulus of 48.4 GPa). • Calculated elastic constants of DC-HgGa{sub 2}S{sub 4} reported at different pressures. • DC-HgGa{sub 2}S{sub 4} becomes mechanically unstable above 13.8 GPa. -- Abstract: In this work, we focus on the study of the structural and elastic properties of mercury digallium sulfide (HgGa{sub 2}S{sub 4}) at high pressures. This compound belongs to the family of AB{sub 2}X{sub 4} ordered-vacancy compounds and exhibits a tetragonal defect chalcopyrite structure. X-ray diffraction measurements at room temperature have been performed under compression up to 15.1 GPa in a diamond anvil cell. Our measurements have been complemented and compared with ab initio total energy calculations. The axial compressibility and the equation of state of the low-pressure phase of HgGa{sub 2}S{sub 4} have been experimentally and theoretically determined and compared to other related ordered-vacancy compounds. The pressure dependence of the theoretical cation–anion and vacancy-anion distances and compressibilities in HgGa{sub 2}S{sub 4} are reported and discussed in comparison to other related ordered-vacancy compounds. Finally, the pressure dependence of the theoretical elastic constants and elastic moduli of HgGa{sub 2}S{sub 4} has been studied. Our calculations indicate that the low-pressure phase of HgGa{sub 2}S{sub 4} becomes mechanically unstable above 13.8 GPa.

  1. Elastic Properties and the Band Gap of AlNxP1-x Semiconductor Alloy: A Comparative Study of Various Ab Initio Approaches

    Directory of Open Access Journals (Sweden)

    M. P. Polak

    2016-01-01

    Full Text Available Structural and elastic properties of AlNxP1-x, a novel semiconductor alloy, are studied from the first principles in both zinc-blende and wurtzite structures. Performances of the finite difference (FD method and the density functional perturbation theory (DFPT are tested and compared. Both of these methods are applied to two different approaches of alloy simulation, a supercell of 16 and 32 atoms (for zinc-blende and wurtzite structures, resp. and the alchemical mixing (AM method, where the pseudopotentials are mixed in an appropriate way to form an alloy. All elastic properties, including the elastic tensors, elastic moduli, Poisson’s ratio, B/G, and relaxation coefficient, as well as lattice parameters are calculated using all said methods. Conclusions about the use of the approaches investigated in this paper and about their performance are drawn. In addition, in both crystal structures, the band gap is studied in the whole composition range using the MBJLDA functional. The band gap bowings are unusually high, which confirms earlier reports.

  2. Exact moduli space metrics for hyperbolic vortex polygons

    International Nuclear Information System (INIS)

    Krusch, S.; Speight, J. M.

    2010-01-01

    Exact metrics on some totally geodesic submanifolds of the moduli space of static hyperbolic N-vortices are derived. These submanifolds, denoted as Σ n,m , are spaces of C n -invariant vortex configurations with n single vortices at the vertices of a regular polygon and m=N-n coincident vortices at the polygon's center. The geometric properties of Σ n,m are investigated, and it is found that Σ n,n-1 is isometric to the hyperbolic plane of curvature -(3πn) -1 . The geodesic flow on Σ n,m and a geometrically natural variant of geodesic flow recently proposed by Collie and Tong ['The dynamics of Chern-Simons vortices', Phys. Rev. D Part. Fields Gravit. Cosmol. 78, 065013 (2008);e-print arXiv:hep-th/0805.0602] are analyzed in detail.

  3. Dynamics of moduli and gaugino condensates in an expanding universe

    International Nuclear Information System (INIS)

    Papineau, C.; Ramos-Sanchez, S.; Postma, M.

    2009-08-01

    We study dynamical moduli stabilization driven by gaugino condensation in supergravity. In the presence of background radiation, there exists a region of initial conditions leading to successful stabilization. We point out that most of the allowed region corresponds to initial Hubble rate H close to the scale of condensation Λ, which is the natural cutoff of the effective theory. We first show that including the condensate dynamics sets a strong bound on the initial conditions. We then find that (complete) decoupling of the condensate happens at H about two orders of magnitude below Λ. This bound implies that in the usual scenario with the condensate integrated out, only the vicinity of the minimum leads to stabilization. Finally, we discuss the effects of thermal corrections. (orig.)

  4. Yukawa unification in moduli-dominant SUSY breaking

    International Nuclear Information System (INIS)

    Khalil, S.; Tatsuo Kobayashi

    1997-07-01

    We study Yukawa in string models with moduli-dominant SUSY breaking. This type of SUSY breaking in general leads to non-universal soft masses, i.e. soft scalar masses and gaugino masses. Such non-universality is important for phenomenological aspects of Yukawa unification, i.e., successful electroweak breaking, SUSY corrections to the bottom mass and the branching ratio of b → sγ. We show three regions in the whole parameter space which lead to successful electroweak breaking and allow small SUSY corrections to the bottom mass. For these three regions we investigated the b → sγ decay and mass spectra. (author). 26 refs, 6 figs

  5. Instanton transition in thermal and moduli deformed de Sitter cosmology

    International Nuclear Information System (INIS)

    Kounnas, Costas; Partouche, Herve

    2008-01-01

    We consider the de Sitter cosmology deformed by the presence of a thermal bath of radiation and/or time-dependent moduli fields. Depending on the parameters, either a first or second-order phase transition can occur. In the first case, an instanton allows a double analytic continuation. It induces a probability to enter the inflationary evolution by tunnel effect from another cosmological solution. The latter starts with a big bang and, in the case the transition does not occur, ends with a big crunch. A temperature duality exchanges the two cosmological branches. In the limit where the pure de Sitter universe is recovered, the tunnel effect reduces to a 'creation from nothing', due to the vanishing of the big bang branch. However, the latter may be viable in some range of the deformation parameter. In the second case, there is a smooth evolution from a big bang to the inflationary phase

  6. Ab initio calculations of mechanical properties: Methods and applications

    Czech Academy of Sciences Publication Activity Database

    Pokluda, J.; Černý, Miroslav; Šob, Mojmír; Umeno, Y.

    2015-01-01

    Roč. 73, AUG (2015), s. 127-158 ISSN 0079-6425 R&D Projects: GA ČR(CZ) GAP108/12/0311 Institutional support: RVO:68081723 Keywords : Ab initio methods * Elastic moduli * Intrinsic hardness * Stability analysis * Theoretical strength * Intrinsic brittleness/ductility Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 31.083, year: 2015

  7. Moduli Spaces for Linear Differential Equations and the Painlevé Equations

    NARCIS (Netherlands)

    Put, Marius van der; Saito, Masa-Hiko

    2009-01-01

    A systematic construction of isomonodromic families of connections of rank two on the Riemarm sphere is obtained by considering the analytic Riemann-Hilbert map RH : M -> R, where M is a moduli space of connections and 72, the monodromy space, is a moduli space for analytic data (i.e., ordinary

  8. Micromechanics-based determination of effective elastic properties of polymer bonded explosives

    International Nuclear Information System (INIS)

    Banerjee, Biswajit; Adams, D.O.

    2003-01-01

    Polymer bonded explosives are particulate composites containing a high volume fraction of stiff elastic explosive particles in a compliant viscoelastic binder. Since the volume fraction of particles can be greater than 0.9 and the modulus contrast greater than 20 000, rigorous bounds on the elastic moduli of the composite are an order of magnitude different from experimentally determined values. Analytical solutions are also observed to provide inaccurate estimates of effective elastic properties. Direct finite element approximations of effective properties require large computational resources because of the complexity of the microstructure of these composites. An alternative approach, the recursive cells method (RCM) is also explored in this work. Results show that the degree of discretization and the microstructures used in finite element models of PBXs can significantly affect the estimated Young's moduli

  9. On Elasticity Measurement in Cloud Computing

    Directory of Open Access Journals (Sweden)

    Wei Ai

    2016-01-01

    Full Text Available Elasticity is the foundation of cloud performance and can be considered as a great advantage and a key benefit of cloud computing. However, there is no clear, concise, and formal definition of elasticity measurement, and thus no effective approach to elasticity quantification has been developed so far. Existing work on elasticity lack of solid and technical way of defining elasticity measurement and definitions of elasticity metrics have not been accurate enough to capture the essence of elasticity measurement. In this paper, we present a new definition of elasticity measurement and propose a quantifying and measuring method using a continuous-time Markov chain (CTMC model, which is easy to use for precise calculation of elasticity value of a cloud computing platform. Our numerical results demonstrate the basic parameters affecting elasticity as measured by the proposed measurement approach. Furthermore, our simulation and experimental results validate that the proposed measurement approach is not only correct but also robust and is effective in computing and comparing the elasticity of cloud platforms. Our research in this paper makes significant contribution to quantitative measurement of elasticity in cloud computing.

  10. Multi-scale imaging and elastic simulation of carbonates

    Science.gov (United States)

    Faisal, Titly Farhana; Awedalkarim, Ahmed; Jouini, Mohamed Soufiane; Jouiad, Mustapha; Chevalier, Sylvie; Sassi, Mohamed

    2016-05-01

    Digital Rock Physics (DRP) is an emerging technology that can be used to generate high quality, fast and cost effective special core analysis (SCAL) properties compared to conventional experimental techniques and modeling techniques. The primary workflow of DRP conssits of three elements: 1) image the rock sample using high resolution 3D scanning techniques (e.g. micro CT, FIB/SEM), 2) process and digitize the images by segmenting the pore and matrix phases 3) simulate the desired physical properties of the rocks such as elastic moduli and velocities of wave propagation. A Finite Element Method based algorithm, that discretizes the basic Hooke's Law equation of linear elasticity and solves it numerically using a fast conjugate gradient solver, developed by Garboczi and Day [1] is used for mechanical and elastic property simulations. This elastic algorithm works directly on the digital images by treating each pixel as an element. The images are assumed to have periodic constant-strain boundary condition. The bulk and shear moduli of the different phases are required inputs. For standard 1.5" diameter cores however the Micro-CT scanning reoslution (around 40 μm) does not reveal smaller micro- and nano- pores beyond the resolution. This results in an unresolved "microporous" phase, the moduli of which is uncertain. Knackstedt et al. [2] assigned effective elastic moduli to the microporous phase based on self-consistent theory (which gives good estimation of velocities for well cemented granular media). Jouini et al. [3] segmented the core plug CT scan image into three phases and assumed that micro porous phase is represented by a sub-extracted micro plug (which too was scanned using Micro-CT). Currently the elastic numerical simulations based on CT-images alone largely overpredict the bulk, shear and Young's modulus when compared to laboratory acoustic tests of the same rocks. For greater accuracy of numerical simulation prediction, better estimates of moduli inputs

  11. Nonlinear Elasticity

    Science.gov (United States)

    Fu, Y. B.; Ogden, R. W.

    2001-05-01

    This collection of papers by leading researchers in the field of finite, nonlinear elasticity concerns itself with the behavior of objects that deform when external forces or temperature gradients are applied. This process is extremely important in many industrial settings, such as aerospace and rubber industries. This book covers the various aspects of the subject comprehensively with careful explanations of the basic theories and individual chapters each covering a different research direction. The authors discuss the use of symbolic manipulation software as well as computer algorithm issues. The emphasis is placed firmly on covering modern, recent developments, rather than the very theoretical approach often found. The book will be an excellent reference for both beginners and specialists in engineering, applied mathematics and physics.

  12. Experimental determination of third-order elastic constants of diamond.

    Science.gov (United States)

    Lang, J M; Gupta, Y M

    2011-03-25

    To determine the nonlinear elastic response of diamond, single crystals were shock compressed along the [100], [110], and [111] orientations to 120 GPa peak elastic stresses. Particle velocity histories and elastic wave velocities were measured by using laser interferometry. The measured elastic wave profiles were used, in combination with published acoustic measurements, to determine the complete set of third-order elastic constants. These constants represent the first experimental determination, and several differ significantly from those calculated by using theoretical models.

  13. Ab initio study of the elastic properties of single and polycrystal TiO2, ZrO2 and HfO2 in the cotunnite structure

    International Nuclear Information System (INIS)

    Caravaca, M A; Mino, J C; Perez, V J; Casali, R A; Ponce, C A

    2009-01-01

    In this work, we study theoretically the elastic properties of the orthorhombic (Pnma) high-pressure phase of IV-B group oxides: titania, zirconia and hafnia. By means of the self-consistent SIESTA code, pseudopotentials, density functional theory in the LDA and GGA approximations, the total energies, hydrostatic pressures and stress tensor components are calculated. From the stress-strain relationships, in the linear regime, the elastic constants C ij are determined. Derived elastic constants, such as bulk, Young's and shear modulus, Poisson coefficient and brittle/ductile behavior are estimated with the polycrystalline approach, using Voigt-Reuss-Hill theories. We have found that C 11 , C 22 and C 33 elastic constants of hafnia and zirconia show increased strength with respect to the experimental values of the normal phase, P 2 1 /c. A similar situation applies to titania if these constants are compared with its normal phase, rutile. However, shear elastic constants C 44 , C 55 and C 66 are similar to the values found in the normal phase. This fact increases the compound anisotropy as well as its ductile behavior. The dependence of unit-cell volumes under hydrostatic pressures is also analyzed. P-V data, fitted to third-order Birch-Murnaghan equations of state, provide the bulk modulus B 0 and its pressure derivatives B' 0 . In this case, LDA estimations show good agreement with respect to recent measured bulk moduli of ZrO 2 and HfO 2 . Thermo-acoustic properties, e.g. the propagation speed of transverse, longitudinal elastic waves together with associated Debye temperatures, are also estimated.

  14. Pressure effect on the structural, elastic, electronic and optical properties of the Zintl phase KAsSn, first principles study

    Energy Technology Data Exchange (ETDEWEB)

    Guechi, A., E-mail: ab_guechi@yahoo.fr [Institute of Optics and Precision Mechanics, Setif-1 University, 19000 Setif (Algeria); Laboratory of Optoelectronics and Components, Department of Physics, Faculty of Science, Setif-1 University, 19000 Setif (Algeria); Merabet, A. [Institute of Optics and Precision Mechanics, Setif-1 University, 19000 Setif (Algeria); Laboratory of Physics and Mechanics of Metallic Materials, Setif-1 University, 19000 Setif (Algeria); Chegaar, M. [Laboratory of Optoelectronics and Components, Department of Physics, Faculty of Science, Setif-1 University, 19000 Setif (Algeria); Bouhemadou, A. [Laboratory for Developing New Materials and their Characterization, Department of Physics, Faculty of Science, Setif-1 University, 19000 Setif (Algeria); Department of Physics and Astronomy, College of Science, King Saud University, P.O. Box 2455, Riyadh 11451 (Saudi Arabia); Guechi, N. [Laboratory for Developing New Materials and their Characterization, Department of Physics, Faculty of Science, Setif-1 University, 19000 Setif (Algeria)

    2015-02-25

    Highlights: • KAsSn is interesting in the materials community due to its complex structure and narrow gap. • Physical properties of KAsSn have not taken much attention in previous studies. • The KAsSn structure is shown to be mechanically stable. • KAsSn is predicted to be brittleness and characterized by a weak elastic anisotropy. • Its high absorption in the U.V. energy range shows its use in the optoelectronic devices. - Abstract: In this work, a first-principles study of ternary Zintl phase KAsSn compound using density-functional theory (DFT) method within the generalized gradient approximation developed by Wu–Cohen (GGA-Wc) has been performed. Based on the optimized structural parameter, the electronic structure, elastic and optical properties have been investigated. The calculated lattice constants agree reasonably with the previous results. The effect of high pressure on the structural parameters has been shown. The elastic constants were calculated and satisfy the stability conditions for hexagonal crystal. These indicate that this compound is stable in the studied pressure regime. The single crystal elastic constants (C{sub ij}) and related properties are calculated using the static finite strain technique, moreover the polycrystalline elastic moduli such as bulk modulus, shear modulus, micro-hardness parameter H{sub ν}, Young’s modulus and Poisson’s ratio were estimated using Voigt, Reuss and Hill’s (VRH) approximations. The elastic anisotropy of the KAsSn was also analyzed. On another hand the Debye temperature was obtained from the average sound velocity. Electronic properties have been studied throughout the calculation of band structure, density of states and charge densities. It is shown that this crystal belongs to the semiconductors with a pseudo gap of about 0.34 eV. Furthermore, in order to clarify the optical transitions of this compound, linear optical functions including the complex dielectric function, refractive index

  15. Towards an elastic model of wurtzite AlN nanowires

    International Nuclear Information System (INIS)

    Mitrushchenkov, A; Chambaud, G; Yvonnet, J; He, Q-C

    2010-01-01

    Starting with ab initio calculations of AlN wurtzite [0001] nanowires with diameters up to 4 nm, a finite element method is developed to deal with larger nanostructures/nanoparticles. The ab initio calculations show that the structure of the nanowires can be well represented by an internal part with AlN bulk elastic properties, and one atomic surface layer with its own elastic behavior. The proposed finite element method includes surface elements with their own elastic properties using surface elastic coefficients deduced from the ab initio calculations. The elastic properties obtained with the finite element model compare very well with those obtained with the full ab initio calculations.

  16. Density functional study of vibrational, thermodynamic and elastic properties of ZrCo and ZrCoX3 (X = H, D and T) compounds

    International Nuclear Information System (INIS)

    Chattaraj, D.; Parida, S.C.; Dash, Smruti; Majumder, C.

    2015-01-01

    Highlights: • The physico-chemical properties of ZrCo and its hydrides were studied. • The isotope effect on vibrational and thermodynamic properties was investigated. • The changes in elastic properties due to hydrogenation of ZrCo were investigated. • Thermodynamics properties of ZrCo and its hydrides were calculated. - Abstract: The dynamical, thermodynamic and elastic properties of ZrCo and its hydrides ZrCoX 3 (X = H, D and T) are reported. While the electronic structure calculations are performed using plane wave pseudopotential approach, the effect of isotopes on the vibrational and thermodynamic properties has been demonstrated through frozen phonon approach. The results reveal significant difference between the ZrCoH 3 and its isotopic analogs in terms of phonon frequencies and zero point energies. For example, the energy gap between optical and acoustic modes reduces in the order of ZrCoT 3 > ZrCoD 3 > ZrCoH 3 . The vibrational properties shows that the intermetallic ZrCo is dynamically stable whereas ZrCoX 3 (X = H, D and T) are dynamically unstable. The calculated formation energies of ZrCoX 3 , including the ZPE, are −146.7, −158.3 and −164.1 kJ/(mole of ZrCoX 3 ) for X = H, D and T, respectively. In addition, the changes in elastic properties of ZrCo upon hydrogenation have also been investigated. The results show that both ZrCo and ZrCoH 3 are mechanically stable at ambient pressure. The Debye temperatures of both ZrCo and ZrCoH 3 are determined using the calculated elastic moduli

  17. Density functional study of vibrational, thermodynamic and elastic properties of ZrCo and ZrCoX{sub 3} (X = H, D and T) compounds

    Energy Technology Data Exchange (ETDEWEB)

    Chattaraj, D., E-mail: debchem@barc.gov.in [Product Development Division, Bhabha Atomic Research Centre, Trombay, Mumbai 400 085 (India); Parida, S.C.; Dash, Smruti [Product Development Division, Bhabha Atomic Research Centre, Trombay, Mumbai 400 085 (India); Majumder, C. [Chemistry Division, Bhabha Atomic Research Centre, Trombay, Mumbai 400 085 (India)

    2015-04-25

    Highlights: • The physico-chemical properties of ZrCo and its hydrides were studied. • The isotope effect on vibrational and thermodynamic properties was investigated. • The changes in elastic properties due to hydrogenation of ZrCo were investigated. • Thermodynamics properties of ZrCo and its hydrides were calculated. - Abstract: The dynamical, thermodynamic and elastic properties of ZrCo and its hydrides ZrCoX{sub 3} (X = H, D and T) are reported. While the electronic structure calculations are performed using plane wave pseudopotential approach, the effect of isotopes on the vibrational and thermodynamic properties has been demonstrated through frozen phonon approach. The results reveal significant difference between the ZrCoH{sub 3} and its isotopic analogs in terms of phonon frequencies and zero point energies. For example, the energy gap between optical and acoustic modes reduces in the order of ZrCoT{sub 3} > ZrCoD{sub 3} > ZrCoH{sub 3}. The vibrational properties shows that the intermetallic ZrCo is dynamically stable whereas ZrCoX{sub 3} (X = H, D and T) are dynamically unstable. The calculated formation energies of ZrCoX{sub 3}, including the ZPE, are −146.7, −158.3 and −164.1 kJ/(mole of ZrCoX{sub 3}) for X = H, D and T, respectively. In addition, the changes in elastic properties of ZrCo upon hydrogenation have also been investigated. The results show that both ZrCo and ZrCoH{sub 3} are mechanically stable at ambient pressure. The Debye temperatures of both ZrCo and ZrCoH{sub 3} are determined using the calculated elastic moduli.

  18. Density functional study of elastic and vibrational properties of the Heusler-type alloys Fe2VAl and Fe2VGa

    DEFF Research Database (Denmark)

    Kanchana, V.; Vaitheeswaran, G.; Ma, Yanming

    2009-01-01

    agree well with the experimental values. The elastic constants of Fe2VAl and Fe2VGa are predicted. From the elastic constants the shear modulus, Young's modulus, Poisson's ratio, sound velocities, and Debye temperatures are obtained. By analyzing the ratio between the bulk and shear moduli, we conclude...

  19. Anisotropy in elastic properties of TiSi2 (C49, C40 and C54), TiSi and Ti5Si3: an ab-initio density functional study

    International Nuclear Information System (INIS)

    Niranjan, Manish K

    2015-01-01

    We present a comparative study of the anisotropy in the elastic properties of the C49, C54 and C40 phases of TiSi 2 , as well as orthorhombic TiSi and hexagonal Ti 5 Si 3 . The elastic constants, elastic moduli, Debye temperature and sound velocities are computed within the framework of density functional theory. The computed values of the elastic constants and moduli are found to be in excellent agreement with available experimental values. The average elastic moduli, such as Young’s modulus, shear modulus, bulk modulus and Poisson’s ratio, of polycrystalline aggregates are computed using the computed elastic constants of single crystals. The anisotropy in elastic properties is analyzed using estimates of shear anisotropic factors, bulk modulus anisotropic factors and variations in Young’s and bulk moduli in different crystallographic directions. Among the Ti–Si phases, the computed directional Young’s modulus profiles of C49 TiSi 2 and C40 TiSi 2 are found to be quite similar to those of bulk Si and Ti, respectively. In addition to the elastic properties, the electronic structure of five Ti–Si phases is studied. The density of states and planar charge density profiles reveal mixed covalent–metallic bonding in all Ti–Si phases. (paper)

  20. The Infinitesimal Moduli Space of Heterotic G 2 Systems

    Science.gov (United States)

    de la Ossa, Xenia; Larfors, Magdalena; Svanes, Eirik E.

    2018-06-01

    Heterotic string compactifications on integrable G 2 structure manifolds Y with instanton bundles {(V,A), (TY,\\tilde{θ})} yield supersymmetric three-dimensional vacua that are of interest in physics. In this paper, we define a covariant exterior derivative D and show that it is equivalent to a heterotic G 2 system encoding the geometry of the heterotic string compactifications. This operator D acts on a bundle Q}=T^*Y \\oplus End(V) \\oplus End(TY)} and satisfies a nilpotency condition \\check{{D^2=0} , for an appropriate projection of D. Furthermore, we determine the infinitesimal moduli space of these systems and show that it corresponds to the finite-dimensional cohomology group H^1_{D}(Q). We comment on the similarities and differences of our result with Atiyah's well-known analysis of deformations of holomorphic vector bundles over complex manifolds. Our analysis leads to results that are of relevance to all orders in the {α'} expansion.

  1. Quantum triangulations. Moduli spaces, strings, and quantum computing

    Energy Technology Data Exchange (ETDEWEB)

    Carfora, Mauro; Marzouli, Annalisa [Univ. degli Studi di Pavia (Italy). Dipt. Fisica Nucleare e Teorica; Istituto Nazionale di Fisica Nucleare e Teorica, Pavia (Italy)

    2012-07-01

    Research on polyhedral manifolds often points to unexpected connections between very distinct aspects of Mathematics and Physics. In particular triangulated manifolds play quite a distinguished role in such settings as Riemann moduli space theory, strings and quantum gravity, topological quantum field theory, condensed matter physics, and critical phenomena. Not only do they provide a natural discrete analogue to the smooth manifolds on which physical theories are typically formulated, but their appearance is rather often a consequence of an underlying structure which naturally calls into play non-trivial aspects of representation theory, of complex analysis and topology in a way which makes manifest the basic geometric structures of the physical interactions involved. Yet, in most of the existing literature, triangulated manifolds are still merely viewed as a convenient discretization of a given physical theory to make it more amenable for numerical treatment. The motivation for these lectures notes is thus to provide an approachable introduction to this topic, emphasizing the conceptual aspects, and probing, through a set of cases studies, the connection between triangulated manifolds and quantum physics to the deepest. This volume addresses applied mathematicians and theoretical physicists working in the field of quantum geometry and its applications. (orig.)

  2. Effective moduli of high volume fraction particulate composites

    International Nuclear Information System (INIS)

    Kwon, P.; Dharan, C.K.H.

    1995-01-01

    Predictions using current micromechanics theories for the effective moduli of particulate-reinforced composites tend to break down at high volume fractions of the reinforcing phase. The predictions are usually well below experimentally measured values of the Young's modulus for volume fractions exceeding about 0.6. In this paper, the concept of contiguity, which is a measure of phase continuity, is applied to Mori-Tanaka micromechanics theory. It is shown that contiguity of the second phase increases with volume fraction, leading eventually to a reversal in the roles of the inclusion and matrix. In powder metallurgy practice, it is well known that at high volume fractions, sintering and consolidation of the reinforcement make it increasingly continuous and more like the matrix phase, while the former matrix tends to become more like the inclusion phase. The concept of contiguity applied to micromechanics theory results in very good agreement between the predicted Young's modulus and experimental data on tungsten carbide particulate-reinforced cobalt

  3. Explaining the electroweak scale and stabilizing moduli in M theory

    International Nuclear Information System (INIS)

    Acharya, Bobby S.; Bobkov, Konstantin; Kane, Gordon L.; Kumar, Piyush; Shao Jing

    2007-01-01

    In a recent paper [B. Acharya, K. Bobkov, G. Kane, P. Kumar, and D. Vaman, Phys. Rev. Lett. 97, 191601 (2006).] it was shown that in fluxless M theory vacua with at least two hidden sectors undergoing strong gauge dynamics and a particular form of the Kaehler potential, all moduli are stabilized by the effective potential and a stable hierarchy is generated, consistent with standard gauge unification. This paper explains the results of [B. Acharya, K. Bobkov, G. Kane, P. Kumar, and D. Vaman, Phys. Rev. Lett. 97, 191601 (2006).] in more detail and generalizes them, finding an essentially unique de Sitter vacuum under reasonable conditions. One of the main phenomenological consequences is a prediction which emerges from this entire class of vacua: namely, gaugino masses are significantly suppressed relative to the gravitino mass. We also present evidence that, for those vacua in which the vacuum energy is small, the gravitino mass, which sets all the superpartner masses, is automatically in the TeV-100 TeV range

  4. Explaining the electroweak scale and stabilizing moduli in M theory

    Science.gov (United States)

    Acharya, Bobby S.; Bobkov, Konstantin; Kane, Gordon L.; Kumar, Piyush; Shao, Jing

    2007-12-01

    In a recent paper [B. Acharya, K. Bobkov, G. Kane, P. Kumar, and D. Vaman, Phys. Rev. Lett. 97, 191601 (2006).PRLTAO0031-900710.1103/PhysRevLett.97.191601] it was shown that in fluxless M theory vacua with at least two hidden sectors undergoing strong gauge dynamics and a particular form of the Kähler potential, all moduli are stabilized by the effective potential and a stable hierarchy is generated, consistent with standard gauge unification. This paper explains the results of [B. Acharya, K. Bobkov, G. Kane, P. Kumar, and D. Vaman, Phys. Rev. Lett. 97, 191601 (2006).PRLTAO0031-900710.1103/PhysRevLett.97.191601] in more detail and generalizes them, finding an essentially unique de Sitter vacuum under reasonable conditions. One of the main phenomenological consequences is a prediction which emerges from this entire class of vacua: namely, gaugino masses are significantly suppressed relative to the gravitino mass. We also present evidence that, for those vacua in which the vacuum energy is small, the gravitino mass, which sets all the superpartner masses, is automatically in the TeV 100 TeV range.

  5. Computational Elastic Knots

    KAUST Repository

    Zhao, Xin

    2013-01-01

    Elastic rods have been studied intensively since the 18th century. Even now the theory of elastic rods is still developing and enjoying popularity in computer graphics and physical-based simulation. Elastic rods also draw attention from architects

  6. Elastic electron scattering from the DNA bases: cytosine and thymine

    International Nuclear Information System (INIS)

    Colyer, C J; Bellm, S M; Lohmanny, B; Blanco, F; Garcia, G

    2012-01-01

    Relative elastic differential cross sections for elastic scattering from cytosine and thymine have been measured using the crossed beam method. The experimental data are compared with theoretical cross sections calculated by the screen corrected additivity rule method.

  7. Moduli Potentials in Type IIA Compactifications with RR and NS Flux

    Energy Technology Data Exchange (ETDEWEB)

    Kachru, S.

    2004-12-01

    We describe a simple class of type IIA string compactifications on Calabi-Yau manifolds where background fluxes generate a potential for the complex structure moduli, the dilaton, and the Kaehler moduli. This class of models corresponds to gauged {Nu} = 2 supergravities, and the potential is completely determined by a choice of gauging and by data of the {Nu} = 2 Calabi-Yau model--the prepotential for vector multiplets and the quaternionic metric on the hypermultiplet moduli space. Using mirror symmetry, one can determine many (though not all) of the quantum corrections which are relevant in these models.

  8. WE-E-9A-01: Ultrasound Elasticity

    Energy Technology Data Exchange (ETDEWEB)

    Emelianov, S [University of Texas at Austin, Austin, TX (United States); Hall, T [University of WI-Madison, Madison, WI (United States); Bouchard, R [UT MD Anderson Cancer Center and UTHSC at Houston Graduate School of Biomed, Houston, TX (United States)

    2014-06-15

    Principles and techniques of ultrasound-based elasticity imaging will be presented, including quasistatic strain imaging, shear wave elasticity imaging, and their implementations in available systems. Deeper exploration of quasistatic methods, including elastic relaxation, and their applications, advantages, artifacts and limitations will be discussed. Transient elastography based on progressive and standing shear waves will be explained in more depth, along with applications, advantages, artifacts and limitations, as will measurement of complex elastic moduli. Comparisons will be made between ultrasound radiation force techniques, MR elastography, and the simple A mode plus mechanical plunger technique. Progress in efforts, such as that by the Quantitative Imaging Biomarkers Alliance, to reduce the differences in the elastic modulus reported by different commercial systems will be explained. Dr. Hall is on an Advisory Board for Siemens Ultrasound and has a research collaboration with them, including joint funding by R01CA140271 for nonlinear elasticity imaging. Learning Objectives: Be reminded of the long history of palpation of tissue elasticity for critical medical diagnosis and the relatively recent advances to be able to image tissue strain in response to an applied force. Understand the differences between shear wave speed elasticity measurement and imaging and understand the factors affecting measurement and image frame repletion rates. Understand shear wave propagation effects that can affect measurements, such as essentially lack of propagation in fluids and boundary effects, so important in thin layers. Know characteristics of available elasticity imaging phantoms, their uses and limitations. Understand thermal and cavitational limitations affecting radiation force-based shear wave imaging. Have learning and references adequate to for you to use in teaching elasticity imaging to residents and technologists. Be able to explain how elasticity measurement

  9. WE-E-9A-01: Ultrasound Elasticity

    International Nuclear Information System (INIS)

    Emelianov, S; Hall, T; Bouchard, R

    2014-01-01

    Principles and techniques of ultrasound-based elasticity imaging will be presented, including quasistatic strain imaging, shear wave elasticity imaging, and their implementations in available systems. Deeper exploration of quasistatic methods, including elastic relaxation, and their applications, advantages, artifacts and limitations will be discussed. Transient elastography based on progressive and standing shear waves will be explained in more depth, along with applications, advantages, artifacts and limitations, as will measurement of complex elastic moduli. Comparisons will be made between ultrasound radiation force techniques, MR elastography, and the simple A mode plus mechanical plunger technique. Progress in efforts, such as that by the Quantitative Imaging Biomarkers Alliance, to reduce the differences in the elastic modulus reported by different commercial systems will be explained. Dr. Hall is on an Advisory Board for Siemens Ultrasound and has a research collaboration with them, including joint funding by R01CA140271 for nonlinear elasticity imaging. Learning Objectives: Be reminded of the long history of palpation of tissue elasticity for critical medical diagnosis and the relatively recent advances to be able to image tissue strain in response to an applied force. Understand the differences between shear wave speed elasticity measurement and imaging and understand the factors affecting measurement and image frame repletion rates. Understand shear wave propagation effects that can affect measurements, such as essentially lack of propagation in fluids and boundary effects, so important in thin layers. Know characteristics of available elasticity imaging phantoms, their uses and limitations. Understand thermal and cavitational limitations affecting radiation force-based shear wave imaging. Have learning and references adequate to for you to use in teaching elasticity imaging to residents and technologists. Be able to explain how elasticity measurement

  10. Contact-resonance atomic force microscopy for nanoscale elastic property measurements: Spectroscopy and imaging

    International Nuclear Information System (INIS)

    Stan, G.; Krylyuk, S.; Davydov, A.V.; Vaudin, M.D.; Bendersky, L.A.; Cook, R.F.

    2009-01-01

    Quantitative measurements of the elastic modulus of nanosize systems and nanostructured materials are provided with great accuracy and precision by contact-resonance atomic force microscopy (CR-AFM). As an example of measuring the elastic modulus of nanosize entities, we used the CR-AFM technique to measure the out-of-plane indentation modulus of tellurium nanowires. A size-dependence of the indentation modulus was observed for the investigated tellurium nanowires with diameters in the range 20-150 nm. Over this diameter range, the elastic modulus of the outer layers of the tellurium nanowires experienced significant enhancement due to a pronounced surface stiffening effect. Quantitative estimations for the elastic moduli of the outer and inner parts of tellurium nanowires of reduced diameter are made with a core-shell structure model. Besides localized elastic modulus measurements, we have also developed a unique CR-AFM imaging capability to map the elastic modulus over a micrometer-scale area. We used this CR-AFM capability to construct indentation modulus maps at the junction between two adjacent facets of a tellurium microcrystal. The clear contrast observed in the elastic moduli of the two facets indicates the different surface crystallography of these facets.

  11. Elasticity maps of living neurons measured by combined fluorescence and atomic force microscopy.

    Science.gov (United States)

    Spedden, Elise; White, James D; Naumova, Elena N; Kaplan, David L; Staii, Cristian

    2012-09-05

    Detailed knowledge of mechanical parameters such as cell elasticity, stiffness of the growth substrate, or traction stresses generated during axonal extensions is essential for understanding the mechanisms that control neuronal growth. Here, we combine atomic force microscopy-based force spectroscopy with fluorescence microscopy to produce systematic, high-resolution elasticity maps for three different types of live neuronal cells: cortical (embryonic rat), embryonic chick dorsal root ganglion, and P-19 (mouse embryonic carcinoma stem cells) neurons. We measure how the stiffness of neurons changes both during neurite outgrowth and upon disruption of microtubules of the cell. We find reversible local stiffening of the cell during growth, and show that the increase in local elastic modulus is primarily due to the formation of microtubules. We also report that cortical and P-19 neurons have similar elasticity maps, with elastic moduli in the range 0.1-2 kPa, with typical average values of 0.4 kPa (P-19) and 0.2 kPa (cortical). In contrast, dorsal root ganglion neurons are stiffer than P-19 and cortical cells, yielding elastic moduli in the range 0.1-8 kPa, with typical average values of 0.9 kPa. Finally, we report no measurable influence of substrate protein coating on cell body elasticity for the three types of neurons. Copyright © 2012 Biophysical Society. Published by Elsevier Inc. All rights reserved.

  12. The elastic properties of zirconium alloy fuel cladding and pressure tubing materials

    International Nuclear Information System (INIS)

    Rosinger, H.E.; Northwood, D.O.

    1979-01-01

    A knowledge of the elastic properties of zirconium alloys is required in the mathematical modelling of cladding and pressure tubing performance. Until recently, little of this type of data was available, particularly at elevated temperatures. The dynamic elastic moduli of zircaloy-2, zircaloy-4, the alloys Zr-1.0 wt%Nb, Zr-2.5 wt%Nb and Marz grade zirconium have therefore been determined over the temperature range 275 to 1000 K. Young's modulus and shear modulus for all the zirconium alloys decrease with temperature and are expressed by empirical relations fitted to the data. The elastic properties are texture dependent and a detailed study has been conducted on the effect of texture on the elastic properties of Zr-1.0 wt% Nb over the temperature range 275 to 775 K. The results are compared with polycrystalline elastic constants computed from single crystal elastic constants, and the effect of texture on the dynamic elastic moduli is discussed in detail. (Auth.)

  13. The multiple V-shaped double peeling of elastic thin films from elastic soft substrates

    Science.gov (United States)

    Menga, N.; Afferrante, L.; Pugno, N. M.; Carbone, G.

    2018-04-01

    In this paper, a periodic configuration of V-shaped double peeling process is investigated. Specifically, an elastic thin film is detached from a soft elastic material by applying multiple concentrated loads periodically distributed with spatial periodicity λ. The original Kendall's idea is extended to take into account the change in elastic energy occurring in the substrate when the detachment fronts propagate. The symmetric configuration typical of a V-peeling process causes the energy release rate to be sensitive to variations of the elastic energy stored in the soft substrate. This results in an enhancement of the adhesion strength because part of the external work required to trigger the peeling mechanism is converted in substrate elastic energy. A key role is played by both spatial periodicity λ and elasticity ratio E/Eh, between tape and substrate elastic moduli, in determining the conditions of stable adhesion. Indeed, the presence of multiple peeling fronts determines a modification of the mechanism of interaction, because deformations close to each peeling front are also affected by the stresses related to the other fronts. Results show that the energy release rate depends on the detached length of the tape so that conditions can be established which lead to an increase of the supported load compared to the classical peeling on rigid substrates. Finally, we also find that for any given value of the load per unit length, an optimum value of the wavelength λ exists that maximizes the tolerance of the system, before unstable propagation of the peeling front can occur.

  14. Stability, elastic properties and fracture toughness of Al0.75X0.75B14 (X=Sc, Ti, V, Cr, Y, Zr, Nb, Mo) investigated using ab initio calculations

    International Nuclear Information System (INIS)

    Emmerlich, Jens; Thieme, Niklas; To Baben, Moritz; Music, Denis; Schneider, Jochen M

    2013-01-01

    The effect of the transition metal valence electron concentration on the energy of formation, effective charge of B icosahedra, elastic properties, surface energy and fracture toughness was calculated using density functional theory for icosahedral transition metal borides of AlXB 14 (X=Sc, Ti, V, Cr, Y, Zr, Nb, Mo). Consistent with previous work on AlYB 14 (Kölpin et al 2009 J. Phys.: Condens. Matter 21 355006) it is shown that phase stability is generally dependent on the effective charge of the icosahedral transition metal borides. Also, ionization potential and electronegativity are identified as parameters affecting the effective charge of B icosahedra suitable for use in predicting the phase stability. Al 0.75 Y 0.75 B 14 , Al 0.75 Sc 0.75 B 14 and Al 0.75 Zr 0.75 B 14 have been identified as promising phases for application as protective coatings as they exhibit high phase stability and stiffness combined with a comparatively high fracture toughness. (paper)

  15. Compositional dependence of Young's moduli for amorphous FeCo-SiO2 thin films

    International Nuclear Information System (INIS)

    Zhang, L.; Xie, J. L.; Deng, L. J.; Guo, Q.; Zhu, Z. W.; Bi, L.

    2011-01-01

    Systematic force-deflection measurements with microcantilevers and a combinatorial-deposition method have been used to investigate the Young's moduli of amorphous composite FeCo-SiO 2 thin films as a function of film composition, with high compositional resolution. It is found that the modulus decreases monotonically with increasing FeCo content. Such a trend can be explained in terms of the metalloid atoms having a significant effect on the Young's moduli of metal-metalloid composites, which is associated with the strong chemical interaction between the metalloid and themetallic atoms rather than that between the metallic components themselves. This work provides an efficient and effective method to study the moduli of magnetic thin films over a largecomposition coverage, and to compare the relative magnitudes of moduli for differentcompositions at high compositional resolution.

  16. Moduli of mathematical instanton vector bundles with odd c2 on projective space

    International Nuclear Information System (INIS)

    Tikhomirov, Aleksandr S

    2012-01-01

    We study the moduli space I n of mathematical instanton vector bundles of rank 2 with second Chern class n≥1 on the projective space P 3 , and prove the irreducibility of I n for arbitrary odd n≥1.

  17. An Efficient and Accurate Genetic Algorithm for Backcalculation of Flexible Pavement Layer Moduli : Executive Summary Report

    Science.gov (United States)

    2012-12-01

    Backcalculation of pavement moduli has been an intensively researched subject for more than four decades. Despite the existence of many backcalculation programs employing different backcalculation procedures and algorithms, accurate inverse of the la...

  18. A flux-scaling scenario for high-scale moduli stabilization in string theory

    Directory of Open Access Journals (Sweden)

    Ralph Blumenhagen

    2015-08-01

    Full Text Available Tree-level moduli stabilization via geometric and non-geometric fluxes in type IIB orientifolds on Calabi–Yau manifolds is investigated. The focus is on stable non-supersymmetric minima, where all moduli are fixed except for some massless axions. The scenario includes the purely axionic orientifold-odd moduli. A set of vacua allowing for parametric control over the moduli vacuum expectation values and their masses is presented, featuring a specific scaling with the fluxes. Uplift mechanisms and supersymmetry breaking soft masses on MSSM-like D7-branes are discussed as well. This scenario provides a complete effective framework for realizing the idea of F-term axion monodromy inflation in string theory. It is argued that, with all masses close to the Planck and GUT scales, one is confronted with working at the threshold of controlling all mass hierarchies.

  19. A flux-scaling scenario for high-scale moduli stabilization in string theory

    Energy Technology Data Exchange (ETDEWEB)

    Blumenhagen, Ralph [Max-Planck-Institut für Physik (Werner-Heisenberg-Institut), Föhringer Ring 6, 80805 München (Germany); Font, Anamaría [Max-Planck-Institut für Physik (Werner-Heisenberg-Institut), Föhringer Ring 6, 80805 München (Germany); Arnold Sommerfeld Center for Theoretical Physics, LMU, Theresienstr. 37, 80333 München (Germany); Fuchs, Michael [Max-Planck-Institut für Physik (Werner-Heisenberg-Institut), Föhringer Ring 6, 80805 München (Germany); Herschmann, Daniela, E-mail: herschma@mpp.mpg.de [Max-Planck-Institut für Physik (Werner-Heisenberg-Institut), Föhringer Ring 6, 80805 München (Germany); Plauschinn, Erik [Dipartimento di Fisica e Astronomia “Galileo Galilei”, Università di Padova, Via Marzolo 8, 35131 Padova (Italy); INFN, Sezione di Padova, Via Marzolo 8, 35131 Padova (Italy); Sekiguchi, Yuta; Wolf, Florian [Max-Planck-Institut für Physik (Werner-Heisenberg-Institut), Föhringer Ring 6, 80805 München (Germany); Arnold Sommerfeld Center for Theoretical Physics, LMU, Theresienstr. 37, 80333 München (Germany)

    2015-08-15

    Tree-level moduli stabilization via geometric and non-geometric fluxes in type IIB orientifolds on Calabi–Yau manifolds is investigated. The focus is on stable non-supersymmetric minima, where all moduli are fixed except for some massless axions. The scenario includes the purely axionic orientifold-odd moduli. A set of vacua allowing for parametric control over the moduli vacuum expectation values and their masses is presented, featuring a specific scaling with the fluxes. Uplift mechanisms and supersymmetry breaking soft masses on MSSM-like D7-branes are discussed as well. This scenario provides a complete effective framework for realizing the idea of F-term axion monodromy inflation in string theory. It is argued that, with all masses close to the Planck and GUT scales, one is confronted with working at the threshold of controlling all mass hierarchies.

  20. Deformations, moduli stabilisation and gauge couplings at one-loop

    Energy Technology Data Exchange (ETDEWEB)

    Honecker, Gabriele; Koltermann, Isabel [PRISMA Cluster of Excellence, MITP & Institut für Physik (WA THEP),Johannes Gutenberg-Universität,Staudingerweg 9, 55128 Mainz (Germany); Staessens, Wieland [Instituto de Física Teórica UAM-CSIC, Universidad Autónoma de Madrid Cantoblanco,Calle de Nicolás Cabrera 13-15, 28049 Madrid (Spain); Departamento de Física Teórica, Universidad Autónoma de Madrid Cantoblanco,Calle de Nicolás Cabrera 13-15, 28049 Madrid (Spain)

    2017-04-05

    We investigate deformations of ℤ{sub 2} orbifold singularities on the toroidal orbifold T{sup 6}/(ℤ{sub 2}×ℤ{sub 6}) with discrete torsion in the framework of Type IIA orientifold model building with intersecting D6-branes wrapping special Lagrangian cycles. To this aim, we employ the hypersurface formalism developed previously for the orbifold T{sup 6}/(ℤ{sub 2}×ℤ{sub 2}) with discrete torsion and adapt it to the (ℤ{sub 2}×ℤ{sub 6}×ΩR) point group by modding out the remaining ℤ{sub 3} subsymmetry and the orientifold projection ΩR. We first study the local behaviour of the ℤ{sub 3}×ΩR invariant deformation orbits under non-zero deformation and then develop methods to assess the deformation effects on the fractional three-cycle volumes globally. We confirm that D6-branes supporting USp(2N) or SO(2N) gauge groups do not constrain any deformation, while deformation parameters associated to cycles wrapped by D6-branes with U(N) gauge groups are constrained by D-term supersymmetry breaking. These features are exposed in global prototype MSSM, Left-Right symmetric and Pati-Salam models first constructed in (DOI: 10.1016/j.nuclphysb.2015.10.009; 10.1002/prop.201400066), for which we here count the number of stabilised moduli and study flat directions changing the values of some gauge couplings. Finally, we confront the behaviour of tree-level gauge couplings under non-vanishing deformations along flat directions with the one-loop gauge threshold corrections at the orbifold point and discuss phenomenological implications, in particular on possible LARGE volume scenarios and the corresponding value of the string scale M{sub string}, for the same global D6-brane models.

  1. The visco-elastic multilayer program VEROAD

    NARCIS (Netherlands)

    Hopman, P.C.

    1996-01-01

    The mathematical principles and derivation of a linear visco-elastic multilayer computer program are described. The mathematical derivation is based on Fourier Transformation. The program is called VEROAD, which is an acronym for Visco-Elastic ROad Analysis Delft. The program allows calculation of

  2. Heavy ion elastic scattering of code : OPTHI

    International Nuclear Information System (INIS)

    Ismail, M.; Divatia, A.S.

    1982-01-01

    A computer code, OPTHI has been designed to calculate nuclear optical model elastic cross sections for the scattering of heavy ions. The program has been designed to be utilitarian rather than capable of giving an exact description of elastic scattering. Input format is described and the program listing is given. (M.G.B.)

  3. Picard-Fuchs equations and the moduli space of superconformal field theories

    International Nuclear Information System (INIS)

    Cadavid, A.C.; Ferrara, S.

    1991-01-01

    We derive simple techniques which allow us to relate Picard-Fuchs differential equations for the periods of holomorphic p-forms on certain complex manifolds, to their moduli space and its modular group (target space duality). For Calabi-Yau manifolds the special geometry of moduli space gives the Zamolodchikov metric and the Yukawa couplings in terms of the periods. For general N=2 superconformal theories these equations exactly determine perturbed correlation functions of the chiral rings of primary fields. (orig.)

  4. On the reconstruction of a unitary matrix from its moduli. Existence of continuous ambiguities

    International Nuclear Information System (INIS)

    Auberson, G.

    1989-01-01

    It is shown that, for an n x n unitary matrix with n ≥ 4, the knowledge of the moduli of its elements is not always sufficient to determine this matrix up to 'trivial' or 'discrete' ambiguities. Using a parametrization a la Kobayashi-Maskawa in the case n=4, we exhibit various configurations of the moduli for which a continuous ambiguity appears (i.e., some non-trivial phase remains free). (orig.)

  5. Symplectic geometry on moduli spaces of holomorphic bundles over complex surfaces

    OpenAIRE

    Khesin, Boris; Rosly, Alexei

    2000-01-01

    We give a comparative description of the Poisson structures on the moduli spaces of flat connections on real surfaces and holomorphic Poisson structures on the moduli spaces of holomorphic bundles on complex surfaces. The symplectic leaves of the latter are classified by restrictions of the bundles to certain divisors. This can be regarded as fixing a "complex analogue of the holonomy" of a connection along a "complex analogue of the boundary" in analogy with the real case.

  6. How to define the storage and loss moduli for a rheologically nonlinear material?

    Science.gov (United States)

    Argatov, Ivan; Iantchenko, Alexei; Kocherbitov, Vitaly

    2017-11-01

    A large amplitude oscillatory shear (LAOS) is considered in the strain-controlled regime, and the interrelation between the Fourier transform and the stress decomposition approaches is established. Several definitions of the generalized storage and loss moduli are examined in a unified conceptual scheme based on the Lissajous-Bowditch plots. An illustrative example of evaluating the generalized moduli from a LAOS flow is given.

  7. Effect of oxygen incorporation on the structure and elasticity of Ti-Al-O-N coatings synthesized by cathodic arc and high power pulsed magnetron sputtering

    Energy Technology Data Exchange (ETDEWEB)

    Hans, M., E-mail: hans@mch.rwth-aachen.de; Baben, M. to; Music, D.; Ebenhöch, J.; Schneider, J. M. [Materials Chemistry, RWTH Aachen University, Kopernikusstr. 10, D-52074 Aachen (Germany); Primetzhofer, D. [Department of Physics and Astronomy, Uppsala University, Lägerhyddsvägen 1, S-75120 Uppsala (Sweden); Kurapov, D.; Arndt, M.; Rudigier, H. [Oerlikon Balzers Coating AG, Iramali 18, LI-9496 Balzers, Principality of Liechtenstein (Liechtenstein)

    2014-09-07

    Ti-Al-O-N coatings were synthesized by cathodic arc and high power pulsed magnetron sputtering. The chemical composition of the coatings was determined by means of elastic recoil detection analysis and energy dispersive X-ray spectroscopy. The effect of oxygen incorporation on the stress-free lattice parameters and Young's moduli of Ti-Al-O-N coatings was investigated by X-ray diffraction and nanoindentation, respectively. As nitrogen is substituted by oxygen, implications for the charge balance may be expected. A reduction in equilibrium volume with increasing O concentration is identified by X-ray diffraction and density functional theory calculations of Ti-Al-O-N supercells reveal the concomitant formation of metal vacancies. Hence, the oxygen incorporation-induced formation of metal vacancies enables charge balancing. Furthermore, nanoindentation experiments reveal a decrease in elastic modulus with increasing O concentration. Based on ab initio data, two causes can be identified for this: First, the metal vacancy-induced reduction in elasticity; and second, the formation of, compared to the corresponding metal nitride bonds, relatively weak Ti-O and Al-O bonds.

  8. Effect of oxygen incorporation on the structure and elasticity of Ti-Al-O-N coatings synthesized by cathodic arc and high power pulsed magnetron sputtering

    International Nuclear Information System (INIS)

    Hans, M.; Baben, M. to; Music, D.; Ebenhöch, J.; Schneider, J. M.; Primetzhofer, D.; Kurapov, D.; Arndt, M.; Rudigier, H.

    2014-01-01

    Ti-Al-O-N coatings were synthesized by cathodic arc and high power pulsed magnetron sputtering. The chemical composition of the coatings was determined by means of elastic recoil detection analysis and energy dispersive X-ray spectroscopy. The effect of oxygen incorporation on the stress-free lattice parameters and Young's moduli of Ti-Al-O-N coatings was investigated by X-ray diffraction and nanoindentation, respectively. As nitrogen is substituted by oxygen, implications for the charge balance may be expected. A reduction in equilibrium volume with increasing O concentration is identified by X-ray diffraction and density functional theory calculations of Ti-Al-O-N supercells reveal the concomitant formation of metal vacancies. Hence, the oxygen incorporation-induced formation of metal vacancies enables charge balancing. Furthermore, nanoindentation experiments reveal a decrease in elastic modulus with increasing O concentration. Based on ab initio data, two causes can be identified for this: First, the metal vacancy-induced reduction in elasticity; and second, the formation of, compared to the corresponding metal nitride bonds, relatively weak Ti-O and Al-O bonds

  9. High-pressure single-crystal elasticity study of CO{sub 2} across phase I-III transition

    Energy Technology Data Exchange (ETDEWEB)

    Zhang, Jin S., E-mail: zhang72@illinois.edu; Bass, Jay D. [Department of Geology, University of Illinois, Urbana-Champaign, Illinois 61801 (United States); Shieh, Sean R. [Departments of Earth Sciences and Physics and Astronomy, University of Western Ontario, London, Ontario N6A 5B7 (Canada); Dera, Przemyslaw [Hawaii Institute of Geophysics and Planetology, University of Hawaii at Manoa, Honolulu, Hawaii 96822 (United States); Prakapenka, Vitali [Center for Advanced Radiation Sources, University of Chicago, Chicago, Illinois 60637 (United States)

    2014-04-07

    Sound velocities and elastic moduli of solid single-crystal CO{sub 2} were measured at pressures up to 11.7(3) GPa by Brillouin spectroscopy. The aggregate adiabatic bulk modulus (K{sub S}), shear modulus (G), and their pressure derivatives for CO{sub 2} Phase I are K{sub S0} = 3.4(6) GPa, G{sub 0} = 1.8(2) GPa, (dK{sub S}/dP){sub 0} = 7.8(3), (dG/dP){sub 0} = 2.5(1), (d{sup 2}K{sub S}/dP{sup 2}){sub 0} = −0.23(3) GPa{sup −1}, and (d{sup 2}G/dP{sup 2}){sub 0} = −0.10(1) GPa{sup −1}. A small increase of elastic properties was observed between 9.8(1) and 10.5(3) GPa, in agreement with the CO{sub 2} I-III transition pressure determined from previous x-ray diffraction experiments. Above the transition pressure P{sub T}, we observed a mixture dominated by CO{sub 2}-I, with minor CO{sub 2}-III. The CO{sub 2}-I + III mixture shows slightly increased sound velocities compared to pure CO{sub 2}-I. Elastic anisotropy calculated from the single-crystal elasticity tensor exhibits a decrease with pressure beginning at 7.9(1) GPa, which is lower than P{sub T}. Our results coincide with recent X-ray Raman observations, suggesting that a pressure-induced electronic transition is related to local structural and optical changes.

  10. Ab initio study of structural, elastic, and vibrational properties of transition-metal disilicides NbSi2 and TaSi2 in hexagonal C40 structure

    Science.gov (United States)

    Ertürk, Esra; Gürel, Tanju

    2018-05-01

    We present an ab initio study of structural, elastic and vibrational properties of transition-metal disilicides NbSi2 and TaSi2. The calculations have been carried out within the density-functional theory and linear-response formalism using norm-conserving pseudopotentials and a plane-wave basis. The calculated lattice parameters, bulk moduli, and elastic constants agree well with previous theoretical and experimental results. The calculated phonon frequencies at the Brillouin zone center are in good agreement with the reported Raman spectra and provide reference values for the future infrared and neutron phonon measurements. Phonon dispersion relations, mode Grüneisen parameters, and total and partial phonon density of states are also discussed. Mode Grüneisen parameters of NbSi2 and TaSi2 at Brillouin zone center show similar trends and all values are found to be positive. From phonon dispersion relations and phonon density of states, we have found a gap around 200 cm-1 for TaSi2, where the frequencies below this gap mainly belong to Ta vibrations and frequencies above the gap is mainly related with Si vibrations. In the case of NbSi2, there is no such gap and both Nb and Si atoms contribute to the phonon density of states in an energy range of 150-270 cm-1.

  11. Nanoscale elasticity mappings of micro-constituents of abalone shell by band excitation-contact resonance force microscopy

    Science.gov (United States)

    Li, Tao; Zeng, Kaiyang

    2014-01-01

    The macroscopic mechanical properties of the abalone shell have been studied extensively in the literature, but the in situ nanoscale elasticity of various micro-constituents in the shell have not been characterized and reported yet. In this study, the nanoscale elasticity mappings including different micro-constituents in abalone shell were observed by using the Contact Resonance Force Microscopy (CR-FM) technique. CR-FM is one of the advanced scanning probe microscopy techniques that is able to quantify the local elastic moduli of various materials in a non-destructive manner. Instead of an average value, an elasticity mapping that reveals the nanoscale variations of elastic moduli with location can be extracted and correlated with the topography of the structure. Therefore in this study, by adopting the CR-FM technique that is incorporated with the band excitation technique, the elasticity variations of the abalone shell caused by different micro-constituents and crystal orientations are reported, and the elasticity values of the aragonite and calcite nanograins are quantified.The macroscopic mechanical properties of the abalone shell have been studied extensively in the literature, but the in situ nanoscale elasticity of various micro-constituents in the shell have not been characterized and reported yet. In this study, the nanoscale elasticity mappings including different micro-constituents in abalone shell were observed by using the Contact Resonance Force Microscopy (CR-FM) technique. CR-FM is one of the advanced scanning probe microscopy techniques that is able to quantify the local elastic moduli of various materials in a non-destructive manner. Instead of an average value, an elasticity mapping that reveals the nanoscale variations of elastic moduli with location can be extracted and correlated with the topography of the structure. Therefore in this study, by adopting the CR-FM technique that is incorporated with the band excitation technique, the

  12. Environmental bias and elastic curves on surfaces

    International Nuclear Information System (INIS)

    Guven, Jemal; María Valencia, Dulce; Vázquez-Montejo, Pablo

    2014-01-01

    The behavior of an elastic curve bound to a surface will reflect the geometry of its environment. This may occur in an obvious way: the curve may deform freely along directions tangent to the surface, but not along the surface normal. However, even if the energy itself is symmetric in the curve's geodesic and normal curvatures, which control these modes, very distinct roles are played by the two. If the elastic curve binds preferentially on one side, or is itself assembled on the surface, not only would one expect the bending moduli associated with the two modes to differ, binding along specific directions, reflected in spontaneous values of these curvatures, may be favored. The shape equations describing the equilibrium states of a surface curve described by an elastic energy accommodating environmental factors will be identified by adapting the method of Lagrange multipliers to the Darboux frame associated with the curve. The forces transmitted to the surface along the surface normal will be determined. Features associated with a number of different energies, both of physical relevance and of mathematical interest, are described. The conservation laws associated with trajectories on surface geometries exhibiting continuous symmetries are also examined. (paper)

  13. Elastic Rock Heterogeneity Controls Brittle Rock Failure during Hydraulic Fracturing

    Science.gov (United States)

    Langenbruch, C.; Shapiro, S. A.

    2014-12-01

    For interpretation and inversion of microseismic data it is important to understand, which properties of the reservoir rock control the occurrence probability of brittle rock failure and associated seismicity during hydraulic stimulation. This is especially important, when inverting for key properties like permeability and fracture conductivity. Although it became accepted that seismic events are triggered by fluid flow and the resulting perturbation of the stress field in the reservoir rock, the magnitude of stress perturbations, capable of triggering failure in rocks, can be highly variable. The controlling physical mechanism of this variability is still under discussion. We compare the occurrence of microseismic events at the Cotton Valley gas field to elastic rock heterogeneity, obtained from measurements along the treatment wells. The heterogeneity is characterized by scale invariant fluctuations of elastic properties. We observe that the elastic heterogeneity of the rock formation controls the occurrence of brittle failure. In particular, we find that the density of events is increasing with the Brittleness Index (BI) of the rock, which is defined as a combination of Young's modulus and Poisson's ratio. We evaluate the physical meaning of the BI. By applying geomechanical investigations we characterize the influence of fluctuating elastic properties in rocks on the probability of brittle rock failure. Our analysis is based on the computation of stress fluctuations caused by elastic heterogeneity of rocks. We find that elastic rock heterogeneity causes stress fluctuations of significant magnitude. Moreover, the stress changes necessary to open and reactivate fractures in rocks are strongly related to fluctuations of elastic moduli. Our analysis gives a physical explanation to the observed relation between elastic heterogeneity of the rock formation and the occurrence of brittle failure during hydraulic reservoir stimulations. A crucial factor for understanding

  14. Computational Elastic Knots

    KAUST Repository

    Zhao, Xin

    2013-05-01

    Elastic rods have been studied intensively since the 18th century. Even now the theory of elastic rods is still developing and enjoying popularity in computer graphics and physical-based simulation. Elastic rods also draw attention from architects. Architectural structures, NODUS, were constructed by elastic rods as a new method of form-finding. We study discrete models of elastic rods and NODUS structures. We also develop computational tools to find the equilibria of elastic rods and the shape of NODUS. Applications of elastic rods in forming torus knot and closing Bishop frame are included in this thesis.

  15. Confocal Microscopy of Jammed Matter: From Elasticity to Granular Thermodynamics

    Science.gov (United States)

    Jorjadze, Ivane

    Packings of particles are ubiquitous in nature and are of interest not only to the scientific community but also to the food, pharmaceutical, and oil industries. In this thesis we use confocal microscopy to investigate packing geometry and stress transmission in 3D jammed particulate systems. By introducing weak depletion attraction we probe the accessible phase-space and demonstrate that a microscopic approach to jammed matter gives validity to statistical mechanics framework, which is intriguing because our particles are not thermally activated. We show that the fluctuations of the local packing parameters can be successfully captured by the recently proposed 'granocentric' model, which generates packing statistics according to simple stochastic processes. This model enables us to calculate packing entropy and granular temperature, the so-called 'compactivity', therefore, providing a basis for a statistical mechanics of granular matter. At a jamming transition point at which there are formed just enough number of contacts to guarantee the mechanical stability, theoretical arguments suggest a singularity which gives rise to the surprising scaling behavior of the elastic moduli and the microstructure, as observed in numerical simulations. Since the contact network in 3D is typically hidden from view, experimental test of the scaling law between the coordination number and the applied pressure is lacking in the literature. Our data show corrections to the linear scaling of the pressure with density which takes into account the creation of contacts. Numerical studies of vibrational spectra, in turn, reveal sudden features such as excess of low frequency modes, dependence of mode localization and structure on the pressure. Chapter four describes the first calculation of vibrational density of states from the experimental 3D data and is in qualitative agreement with the analogous computer simulations. We study the configurational role of the pressure and demonstrate

  16. Determination of the elastic constants of portlandite by Brillouin spectroscopy

    KAUST Repository

    Speziale, S.; Reichmann, H.J.; Schilling, F.R.; Wenk, H.R.; Monteiro, P.J.M.

    2008-01-01

    The single crystal elastic constants Cij and the shear and adiabatic bulk modulus of a natural portlandite (Ca(OH)2) crystal were determined by Brillouin spectroscopy at ambient conditions. The elastic constants, expressed in GPa, are: C11 = 102.0(± 2.0), C12 = 32.1(± 1.0), C13 = 8.4(± 0.4), C14 = 4.5(± 0.2), C33 = 33.6(± 0.7), C44 = 12.0(± 0.3), C66 = (C11-C12)/2 = 35.0(± 1.1), where the numbers in parentheses are 1σ standard deviations. The Reuss bounds of the adiabatic bulk and shear moduli are K0S = 26.0(± 0.3) GPa and G0 = 17.5(± 0.4) GPa, respectively, while the Voigt bounds of these moduli are K0S = 37.3(± 0.4) GPa and G0 = 24.4(± 0.3) GPa. The Reuss and Voigt bounds for the aggregate Young's modulus are 42.8(± 1.0) GPa and 60.0(± 0.8) GPa respectively, while the aggregate Poisson's ratio is equal to 0.23(± 0.01). Portlandite exhibits both large compressional elastic anisotropy with C11/C33 = 3.03(± 0.09) equivalent to that of the isostructural hydroxide brucite (Mg(OH)2), and large shear anisotropy with C66/C44 = 2.92(± 0.12) which is 11% larger than brucite. The comparison between the bulk modulus of portlandite and that of lime (CaO) confirms a systematic linear relationship between the bulk moduli of brucite-type simple hydroxides and the corresponding NaCl-type oxides. © 2008 Elsevier Ltd. All rights reserved.

  17. A-thermal elastic behavior of silicate glasses.

    Science.gov (United States)

    Rabia, Mohammed Kamel; Degioanni, Simon; Martinet, Christine; Le Brusq, Jacques; Champagnon, Bernard; Vouagner, Dominique

    2016-02-24

    Depending on the composition of silicate glasses, their elastic moduli can increase or decrease as function of the temperature. Studying the Brillouin frequency shift of these glasses versus temperature allows the a-thermal composition corresponding to an intermediate glass to be determined. In an intermediate glass, the elastic moduli are independent of the temperature over a large temperature range. For sodium alumino-silicate glasses, the a-thermal composition is close to the albite glass (NaAlSi3O8). The structural origin of this property is studied by in situ high temperature Raman scattering. The structure of the intermediate albite glass and of silica are compared at different temperatures between room temperature and 600 °C. When the temperature increases, it is shown that the high frequency shift of the main band at 440 cm(-1) in silica is a consequence of the cristobalite-like alpha-beta transformation of 6-membered rings. This effect is stronger in silica than bond elongation (anharmonic effects). As a consequence, the elastic moduli of silica increase as the temperature increases. In the albite glass, the substitution of 25% of Si(4+) ions by Al(3+) and Na(+) ions decreases the proportion of SiO2 6-membered rings responsible for the silica anomaly. The effects of the silica anomaly balance the anharmonicity in albite glass and give rise to an intermediate a-thermal glass. Different networks, formers or modifiers, can be added to produce different a-thermal glasses with useful mechanical or chemical properties.

  18. Elastic scattering of slow positrons by helium

    International Nuclear Information System (INIS)

    Amusia, M.Ya.; Cherepkov, N.A.; Chernysheva, L.V.; Shapiro, S.G.

    1976-01-01

    The s-, p-, d- and f-wave phaseshifts for elastic scattering of slow positrons by He are calculated using a simplified version of the random phase approximation with exchange, with virtual positronium formation effect taken into account. (author)

  19. Resonant Column Tests and Nonlinear Elasticity in Simulated Rocks

    Science.gov (United States)

    Sebastian, Resmi; Sitharam, T. G.

    2018-01-01

    Rocks are generally regarded as linearly elastic even though the manifestations of nonlinearity are prominent. The variations of elastic constants with varying strain levels and stress conditions, disagreement between static and dynamic moduli, etc., are some of the examples of nonlinear elasticity in rocks. The grain-to-grain contact, presence of pores and joints along with other compliant features induce the nonlinear behavior in rocks. The nonlinear elastic behavior of rocks is demonstrated through resonant column tests and numerical simulations in this paper. Resonant column tests on intact and jointed gypsum samples across varying strain levels have been performed in laboratory and using numerical simulations. The paper shows the application of resonant column apparatus to obtain the wave velocities of stiff samples at various strain levels under long wavelength condition, after performing checks and incorporating corrections to the obtained resonant frequencies. The numerical simulation and validation of the resonant column tests using distinct element method are presented. The stiffness reductions of testing samples under torsional and flexural vibrations with increasing strain levels have been analyzed. The nonlinear elastic behavior of rocks is reflected in the results, which is enhanced by the presence of joints. The significance of joint orientation and influence of joint spacing during wave propagation have also been assessed and presented using the numerical simulations. It has been found that rock joints also exhibit nonlinear behavior within the elastic limit.

  20. Role of architecture in the elastic response of semiflexible polymer and fiber networks

    Science.gov (United States)

    Heussinger, Claus; Frey, Erwin

    2007-01-01

    We study the elasticity of cross-linked networks of thermally fluctuating stiff polymers. As compared to their purely mechanical counterparts, it is shown that these thermal networks have a qualitatively different elastic response. By accounting for the entropic origin of the single-polymer elasticity, the networks acquire a strong susceptibility to polydispersity and structural randomness that is completely absent in athermal models. In extensive numerical studies we systematically vary the architecture of the networks and identify a wealth of phenomena that clearly show the strong dependence of the emergent macroscopic moduli on the underlying mesoscopic network structure. In particular, we highlight the importance of the polymer length, which to a large extent controls the elastic response of the network, surprisingly, even in parameter regions where it does not enter the macroscopic moduli explicitly. Understanding these subtle effects is only possible by going beyond the conventional approach that considers the response of typical polymer segments only. Instead, we propose to describe the elasticity in terms of a typical polymer filament and the spatial distribution of cross-links along its backbone. We provide theoretical scaling arguments to relate the observed macroscopic elasticity to the physical mechanisms on the microscopic and mesoscopic scales.