Anisotropic bias dependent transport property of defective phosphorene layer
Umar Farooq, M.; Hashmi, Arqum; Hong, Jisang
2015-01-01
Phosphorene is receiving great research interests because of its peculiar physical properties. Nonetheless, no systematic studies on the transport properties modified due to defects have been performed. Here, we present the electronic band structure, defect formation energy and bias dependent transport property of various defective systems. We found that the defect formation energy is much less than that in graphene. The defect configuration strongly affects the electronic structure. The band gap vanishes in single vacancy layers, but the band gap reappears in divacancy layers. Interestingly, a single vacancy defect behaves like a p-type impurity for transport property. Unlike the common belief, we observe that the vacancy defect can contribute to greatly increasing the current. Along the zigzag direction, the current in the most stable single vacancy structure was significantly increased as compared with that found in the pristine layer. In addition, the current along the armchair direction was always greater than along the zigzag direction and we observed a strong anisotropic current ratio of armchair to zigzag direction. PMID:26198318
Exceptional and Anisotropic Transport Properties of Photocarriers in Black Phosphorus.
He, Jiaqi; He, Dawei; Wang, Yongsheng; Cui, Qiannan; Bellus, Matthew Z; Chiu, Hsin-Ying; Zhao, Hui
2015-06-23
One key challenge in developing postsilicon electronic technology is to find ultrathin channel materials with high charge mobilities and sizable energy band gaps. Graphene can offer extremely high charge mobilities; however, the lack of a band gap presents a significant barrier. Transition metal dichalcogenides possess sizable and thickness-tunable band gaps; however, their charge mobilities are relatively low. Here we show that black phosphorus has room-temperature charge mobilities on the order of 10(4) cm(2) V(-1) s(-1), which are about 1 order of magnitude larger than silicon. We also demonstrate strong anisotropic transport in black phosphorus, where the mobilities along the armchair direction are about 1 order of magnitude larger than in the zigzag direction. A photocarrier lifetime as long as 100 ps is also determined. These results illustrate that black phosphorus is a promising candidate for future electronic and optoelectronic applications. PMID:25961945
NASA Astrophysics Data System (ADS)
Jin, Zhenghe; Mullen, Jeffrey; Kim, Ki Wook
We present an analysis of the electron(hole)-phonon scattering in monolayer and bilayer phosphorene using first principles. Density Functional Theory (DFT) and Density Functional Perturbation Theory (DFPT) are used to calculate the scattering matrix elements and full band Monte Carlo carrier transport simulation is employed to obtain the intrinsic electron/hole mobility. Room temperature mobility and saturation velocity in monolayer and bilayer phosphorene are extracted and significant layer number dependence in the mobility is revealed which results from the carrier-phonon interaction matrix elements. The transport properties are also varied with the crystal orientation with anisotropy mobility mostly attributed to the anisotropic band structure and effective masses. Our calculation reveals monolayer phosphorene has anisotropic hole transport property with the room temperature mobility in the armchair direction (458 cm2/Vs) about five times larger than in the zigzag direction (90 cm2/Vs). For bilayer phosphorene, the mobility on both directions increases to 1610 cm2/Vs and 760 cm2/Vs along armchair and zigzag direction respectively. The increased mobility in bilayer is consistent with the experiments which revealed low field mobility of over one thousand in multiple layer phosphorene structure, which provides optimal material for channel in field-effect transistor and a good opportunity for high-performance p-type device. 1This work was supported, in part, by SRC/NRI SWAN.
Su, Qing; Zhang, Wenrui; Lu, Ping; Fang, Shumin; Khatkhatay, Fauzia; Jian, Jie; Li, Leigang; Chen, Fanglin; Zhang, Xinghang; MacManus-Driscoll, Judith L; Chen, Aiping; Jia, Quanxi; Wang, Haiyan
2016-08-10
Ordered arrays of metallic nanopillars embedded in a ceramic matrix have recently attracted considerable interest for their multifunctionality in advanced devices. A number of hurdles need to be overcome for achieving practical devices, including selections of metal-ceramic combination, creation of tunable and ordered structure, and control of strain state. In this article, we demonstrate major advances to create such a fine nanoscale structure, i.e., epitaxial self-assembled vertically aligned metal-ceramic composite, in one-step growth using pulsed laser deposition. Tunable diameter and spacing of the nanopillars can be achieved by controlling the growth parameters such as deposition temperature. The magnetic metal-ceramic composite thin films demonstrate uniaxial anisotropic magnetic properties and enhanced coercivity compared to that of bulk metal. The system also presents unique anisotropic electrical transport properties under in-plane and out-of-plane directions. This work paves a new avenue to fabricate epitaxial metal-ceramic nanocomposites, which can simulate broader future explorations in nanocomposites with novel magnetic, optical, electrical, and catalytical properties. PMID:27438729
Anisotropic thermal transport property of defect-free GaN
NASA Astrophysics Data System (ADS)
Ju, Wenjing; Zhou, Zhongyuan; Wei, Zhiyong
2016-06-01
Non-equilibrium molecular dynamics (MD) simulation is performed to calculate the thermal conductivity of defect-free GaN along three high-symmetry directions. It is found that the thermal conductivity along [001] direction is about 25% higher than that along [100] or [120] direction. The calculated phonon dispersion relation and iso-energy surface from lattice dynamics show that the difference of the sound speeds among the three high-symmetry directions is quite small for the same mode. However, the variation of phonon irradiation with direction is qualitatively consistent with that of the calculated thermal conductivity. Our results indicate that the anisotropic thermal conductivity may partly result from the phonons in the low-symmetry region of the first Brillouin zone due to phonon focus effects, even though the elastic properties along the three high-symmetry directions are nearly isotropic. Thus, the phonon irradiation is able to better describe the property of thermal conductivity as compared to the commonly used phonon dispersion relation. The present investigations uncover the physical origin of the anisotropic thermal conductivity in defect-free GaN, which would provide an important guide for optimizing the thermal management of GaN-based device.
NASA Astrophysics Data System (ADS)
Jin, Zhenghe; Mullen, Jeffrey T.; Kim, Ki Wook
2016-08-01
The intrinsic carrier transport dynamics in phosphorene is theoretically examined. Utilizing a density functional theory treatment, the low-field mobility and the saturation velocity are characterized for both electrons and holes in the monolayer and bilayer structures. The analysis clearly elucidates the crystal orientation dependence manifested through the anisotropic band structure and the carrier-phonon scattering rates. In the monolayer, the hole mobility in the armchair direction is estimated to be approximately five times larger than in the zigzag direction at room temperature (460 cm2/V s vs. 90 cm2/V s). The bilayer transport, on the other hand, exhibits a more modest anisotropy with substantially higher mobilities (1610 cm2/V s and 760 cm2/V s, respectively). The calculations on the conduction-band electrons indicate a comparable dependence while the characteristic values are generally smaller by about a factor of two. The variation in the saturation velocity is found to be less pronounced. With the anticipated superior performance and the diminished anisotropy, few-layer phosphorene offers a promising opportunity particularly in p-type applications.
Anisotropic thermodynamic and transport properties of single-crystalline CaKFe4As4
NASA Astrophysics Data System (ADS)
Meier, W. R.; Kong, T.; Kaluarachchi, U. S.; Taufour, V.; Jo, N. H.; Drachuck, G.; Böhmer, A. E.; Saunders, S. M.; Sapkota, A.; Kreyssig, A.; Tanatar, M. A.; Prozorov, R.; Goldman, A. I.; Balakirev, Fedor F.; Gurevich, Alex; Bud'ko, S. L.; Canfield, P. C.
2016-08-01
Single-crystalline, single-phase CaKFe4As4 has been grown out of a high-temperature, quaternary melt. Temperature-dependent measurements of x-ray diffraction, anisotropic electrical resistivity, elastoresistivity, thermoelectric power, Hall effect, magnetization, and specific heat, combined with field-dependent measurements of electrical resistivity and field and pressure-dependent measurements of magnetization indicate that CaKFe4As4 is an ordered, stoichiometric, Fe-based superconductor with a superconducting critical temperature, Tc=35.0 ±0.2 K. Other than superconductivity, there is no indication of any other phase transition for 1.8 K≤T ≤300 K. All of these thermodynamic and transport data reveal striking similarities to those found for optimally or slightly overdoped (Ba1 -xKx )Fe2As2 , suggesting that stoichiometric CaKFe4As4 is intrinsically close to what is referred to as "optimal-doped" on a generalized, Fe-based superconductor, phase diagram. The anisotropic superconducting upper critical field, Hc 2(T ) , of CaKFe4As4 was determined up to 630 kOe. The anisotropy parameter γ (T ) =Hc2 ⊥/Hc2 ∥ , for H applied perpendicular and parallel to the c axis, decreases from ≃2.5 at Tc to ≃1.5 at 25 K, which can be explained by interplay of paramagnetic pair breaking and orbital effects. The slopes of d Hc2 ∥/d T ≃-44 kOe/K and d Hc2 ⊥/d T ≃-109 kOe/K at Tc yield an electron mass anisotropy of m⊥/m∥≃1 /6 and short Ginzburg-Landau coherence lengths ξ∥(0 ) ≃5.8 Å and ξ⊥(0 ) ≃14.3 Å . The value of Hc2 ⊥(0 ) can be extrapolated to ≃920 kOe, well above the BCS paramagnetic limit.
Large anisotropic thermal transport properties observed in bulk single crystal black phosphorus
NASA Astrophysics Data System (ADS)
Wang, Yue; Xu, Guizhou; Hou, Zhipeng; Yang, Bingchao; Zhang, Xiaoming; Liu, Enke; Xi, Xuekui; Liu, Zhongyuan; Zeng, Zhongming; Wang, Wenhong; Wu, Guangheng
2016-02-01
The anisotropy of thermal transport properties for bulk black phosphorus (BP) single crystal, which might be of particular interest in the fabrication of thermoelectric/optoelectronic devices, was investigated by using angular dependent thermal conductivity and Seebeck coefficient measurements at various temperatures. We found that the maximum thermal conductivities in x (zigzag), y (armchair), and z (perpendicular to the puckered layers) directions are 34, 17, and 5 W m-1 K-1, respectively, exhibiting large anisotropy. At temperature around 200 K, a large Seebeck coefficient up to +487 ± 10 μV/K has been obtained in x direction, which is 1.5 times higher than that in z direction. The large anisotropy of thermal transport properties can be understood from the crystal structure and bonding characters of BP. In addition, the energy gap has been obtained from nuclear spin lattice relaxation measurements, which is consistent with the value derived from temperature-dependent Seebeck coefficient measurements.
Anisotropic transport properties in a layered d+s-wave superconductor
Nicol, E.J.; Kim, Heesang; Palumbo, M.; Graf, M.J.
1996-11-01
Recent measurements of the penetration depth and optical conductivity in YBa{sub 2}Cu{sub 3}O{sub x} (YBCO) single crystals suggest the possibility of an order parameter with d+s-wave symmetry. The authors present results from calculations of both the anisotropic low temperature penetration depth and the frequency-dependent conductivity for a layered superconductor with such a pairing symmetry. The system is modelled as a stack of weakly coupled, two dimensional superconducting planes, and the effect of non-magnetic impurity scattering in both Born and unitarity limits is examined.
NASA Astrophysics Data System (ADS)
Thongnum, Anusit; Pinsook, Udomsilp
2015-03-01
Anisotropic transport properties of a two-dimensional electron gas in nonpolar m-plane AlN/GaN heterostructures with the interface roughness coupled anisotropic in-plane strain scattering were investigated theoretically using a path-integral framework. The scattering potential was composed of the interface roughness and the effective field from the electron charge and the net piezoelectric polarization. We showed that the anisotropic biaxial strains generate only the net piezoelectric polarization along the [0 0 0 1]-direction and cause anisotropy in electron mobility with a magnitude lower than the ≤ft[11\\bar{2}0\\right] -direction. We also showed that the anisotropy in electron mobility reduced with increasing electron density. Moreover, the anisotropic electron mobility disappeared when the anisotropic in-plane strain scattering was removed, and the relation for pure interface roughness scattering was reestablished. This formulation with existing roughness parameters gave a good description for the experimental results of polar c-plane AlN/GaN heterostructures.
Anisotropic transport properties in the phase-separated La0.67Ca0.33MnO3/NdGaO3 (001) films
NASA Astrophysics Data System (ADS)
Hong-Rui, Zhang; Yuan-Bo, Liu; Shuan-Hu, Wang; De-Shun, Hong; Wen-Bin, Wu; Ji-Rong, Sun
2016-07-01
The anisotropic transport property was investigated in a phase separation La0.67Ca0.33MnO3 (LCMO) film grown on (001)-oriented NdGaO3 (NGO) substrate. It was found that the resistivity along the b-axis is much higher than that along the a-axis. Two resistivity peaks were observed in the temperature dependent measurement along the b-axis, one located at 91 K and the other centered at 165 K. Moreover, we also studied the response of the resistivities along the two axes to various electric currents, magnetic fields, and light illuminations. The resistivities along the two axes are sensitive to the magnetic field. However, the electric current and light illumination can influence the resistivity along the b-axis obviously, but have little effect on the resistivity along the a-axis. Based on these results, we believe that an anisotropic-strain-controlled MnO6 octahedra shear-mode deformation may provide a mechanism of conduction filaments paths along the a-axis, which leads to the anisotropic transport property. Project supported by the National Basic Research Program of China (Grant Nos. 2011CB921801, 2012CB921403, and 2013CB921701) and the National Natural Science Foundation of China (Grant Nos. 11074285, 51372064, and 11134007).
NASA Astrophysics Data System (ADS)
Wang, H. P.; Wu, D. S.; Shi, Y. G.; Wang, N. L.
2016-07-01
We present anisotropic transport and optical spectroscopy studies on EuCd2As2 . The measurements reveal that EuCd2As2 is a low carrier density semimetal with moderate anisotropic resistivity ratio. The charge carriers experience very strong scattering from Eu magnetic moments, resulting in a Kondo-like increase of resistivity at low temperature. Below the antiferromagnetic transition temperature at TN=9.5 K, the resistivity drops sharply due to the reduced scattering from the ordered Eu moments. Nevertheless, the anisotropic ratio of ρc/ρa b keeps increasing, suggesting that the antiferromagnetic coupling is along the c axis. The optical spectroscopy measurement further reveals, besides an overdamped reflectance plasma edge at low energy, a strong coupling between phonon and electronic continuum. Our study suggests that EuCd2As2 is a promising candidate displaying intriguing interplay among charge, magnetism, and the underlying crystal lattice.
Anisotropic flow in transport + hydrodynamics hybrid approaches
NASA Astrophysics Data System (ADS)
Petersen, Hannah
2014-12-01
This contribution to the focus issue covers anisotropic flow in hybrid approaches. The historical development of hybrid approaches and their impact on the interpretation of flow measurements is reviewed. The major ingredients of a hybrid approach and the transition criteria between transport and hydrodynamics are discussed. The results for anisotropic flow in (event-by-event) hybrid approaches are presented. Some hybrid approaches rely on hadronic transport for the late stages for the reaction (so called afterburner) and others employ transport approaches for the early non-equilibrium evolution. In addition, there are ‘full’ hybrid calculations where a fluid evolution is dynamically embedded in a transport simulation. After demonstrating the success of hybrid approaches at high Relativistic Heavy Ion Collider and Large Hadron Collider energies, existing hybrid caluclations for collective flow observables at lower beam energies are discussed and remaining challenges outlined.
Intricate short-range ordering and strongly anisotropic transport properties of Li(1-x)Sn(2+x)As₂.
Lee, Kathleen; Kaseman, Derrick; Sen, Sabyasachi; Hung, Ivan; Gan, Zhehong; Gerke, Birgit; Pöttgen, Rainer; Feygenson, Mikhail; Neuefeind, Jörg; Lebedev, Oleg I; Kovnir, Kirill
2015-03-18
A new ternary compound, Li(1-x)Sn(2+x)As2, 0.2 < x < 0.4, was synthesized via solid-state reaction of elements. The compound crystallizes in a layered structure in the R3̅m space group (No. 166) with Sn-As layers separated by layers of jointly occupied Li/Sn atoms. The Sn-As layers are comprised of Sn3As3 puckered hexagons in a chair conformation that share all edges. Li/Sn atoms in the interlayer space are surrounded by a regular As6 octahedron. Thorough investigation by synchrotron X-ray and neutron powder diffraction indicate no long-range Li/Sn ordering. In contrast, the local Li/Sn ordering was revealed by synergistic investigations via solid-state (6,7)Li NMR spectroscopy, HRTEM, STEM, and neutron and X-ray pair distribution function analyses. Due to their different chemical natures, Li and Sn atoms tend to segregate into Li-rich and Sn-rich regions, creating substantial inhomogeneity on the nanoscale. The inhomogeneous local structure has a high impact on the physical properties of the synthesized compounds: the local Li/Sn ordering and multiple nanoscale interfaces result in unexpectedly low thermal conductivity and highly anisotropic resistivity in Li(1-x)Sn(2+x)As2. PMID:25702752
On the anisotropic elastic properties of hydroxyapatite.
NASA Technical Reports Server (NTRS)
Katz, J. L.; Ukraincik, K.
1971-01-01
Experimental measurements of the isotropic elastic moduli on polycrystalline specimens of hydroxyapatite and fluorapatite are compared with elastic constants measured directly from single crystals of fluorapatite in order to derive a set of pseudo single crystal elastic constants for hydroxyapatite. The stiffness coefficients thus derived are given. The anisotropic and isotropic elastic properties are then computed and compared with similar properties derived from experimental observations of the anisotropic behavior of bone.
Elastic properties of spherically anisotropic piezoelectric composites
NASA Astrophysics Data System (ADS)
Wei, En-Bo; Gu, Guo-Qing; Poon, Ying-Ming
2010-09-01
Effective elastic properties of spherically anisotropic piezoelectric composites, whose spherically anisotropic piezoelectric inclusions are embedded in an infinite non-piezoelectric matrix, are theoretically investigated. Analytical solutions for the elastic displacements and the electric potentials under a uniform external strain are derived exactly. Taking into account of the coupling effects of elasticity, permittivity and piezoelectricity, the formula is derived for estimating the effective elastic properties based on the average field theory in the dilute limit. An elastic response mechanism is revealed, in which the effective elastic properties increase as inclusion piezoelectric properties increase and inclusion dielectric properties decrease. Moreover, a piezoelectric response mechanism, of which the effective piezoelectric response vanishes due to the symmetry of spherically anisotropic composite, is also disclosed.
Transport of anisotropic chiral particles in a confined structure
NASA Astrophysics Data System (ADS)
Hu, Cai-tian; Ou, Ya-li; Wu, Jian-chun; Ai, Bao-quan
2016-03-01
Directed transport of anisotropic chiral particles is numerically investigated in the presence of the regular arrays of rigid half-circle obstacles. It is found that due to the rotational-translational coupling, the transport of anisotropic particles is considerably more complicated compared to the isotropic case. For isotropic chiral particles, the transport direction is completely determined by the chirality of particles. However, for anisotropic chiral particles, the competition between the chirality and the anisotropic degree determines the transport direction. For a given chirality, by suitably tailoring parameters (the anisotropic degree and the self-propulsion speed), particles with different anisotropic degrees (or self-propulsion speed) can move in different directions and can be separated.
Study on anisotropic quantum transport in graphene sheets by ESR
NASA Astrophysics Data System (ADS)
Yan, Liqin; Sun, Young; Huang, Jiao; Chen, Xiaolong
Quantum transport in graphene has attracted much attention due to its excellent thermal conductivity and high room-temperature electron mobility. Using the electron spin resonance (ESR) spectrometer for studying weak localization (WL) and weak antilocalization (WAL) effects, except for having the obvious advantage of no need for electrical contacts, differs from the electric transport measurement technique also in the dominant signal from the surface of the layer not from the bulk substrate. Here we have studied an experimental anisotropic quantum transport performed on an assemblage of vertical aligned graphene sheets from 5 to 300 K by a Bruker X-band (9.3 GHz). An anisotropic quantum transport is observed between b with WL and c with WAL axes at 5 - 50 K. With increasing temperature, the transport mechanism is changed along b and c axes. We use WL theory to fit all the spectra and obtain the coherence length Lϕ, long range scattering length Llr, intervalley scattering length Li and analyze the data. Our results indicate that ESR is a robust platform to study the intrinsic physical properties of graphene.
THE ANISOTROPIC TRANSPORT EFFECTS ON DILUTE PLASMAS
Devlen, Ebru
2011-04-20
We examine the linear stability analysis of a hot, dilute, and differentially rotating plasma by considering anisotropic transport effects. In dilute plasmas, the ion Larmor radius is small compared with its collisional mean free path. In this case, the transport of heat and momentum along the magnetic field lines becomes important. This paper presents a novel linear instability that may be more powerful and greater than ideal magnetothermal instability and ideal magnetorotational instability in the dilute astrophysical plasmas. This type of plasma is believed to be found in the intracluster medium (ICM) of galaxy clusters and radiatively ineffective accretion flows around black holes. We derive the dispersion relation of this instability and obtain the instability condition. There is at least one unstable mode that is independent of the temperature gradient direction for a helical magnetic field geometry. This novel instability is driven by the gyroviscosity coupled with differential rotation. Therefore, we call it gyroviscous-modified magnetorotational instability (GvMRI). We examine how the instability depends on signs of the temperature gradient and the gyroviscosity and also on the magnitude of the thermal frequency and on the values of the pitch angle. We provide a detailed physical interpretation of the obtained results. The GvMRI is applicable not only to the accretion flows and ICM but also to the transition region between cool dense gas and the hot low-density plasma in stellar coronae, accretion disks, and the multiphase interstellar medium because it is independent of the temperature gradient direction.
Numerical investigation of nanoparticles transport in anisotropic porous media.
Salama, Amgad; Negara, Ardiansyah; El Amin, Mohamed; Sun, Shuyu
2015-10-01
In this work the problem related to the transport of nanoparticles in anisotropic porous media is investigated numerically using the multipoint flux approximation. Anisotropy of porous media properties is an essential feature that exists almost everywhere in subsurface formations. In anisotropic media, the flux and the pressure gradient vectors are no longer collinear and therefore interesting patterns emerge. The transport of nanoparticles in subsurface formations is affected by several complex processes including surface charges, heterogeneity of nanoparticles and soil grain collectors, interfacial dynamics of double-layer and many others. We use the framework of the theory of filtration in this investigation. Processes like particles deposition, entrapment, as well as detachment are accounted for. From the numerical methods point of view, traditional two-point flux finite difference approximation cannot handle anisotropy of media properties. Therefore, in this work we use the multipoint flux approximation (MPFA). In this technique, the flux components are affected by more neighboring points as opposed to the mere two points that are usually used in traditional finite volume methods. We also use the experimenting pressure field approach which automatically constructs the global system of equations by solving multitude of local problems. This approach facilitates to a large extent the construction of the global system. A set of numerical examples is considered involving two-dimensional rectangular domain. A source of nanoparticles is inserted in the middle of the anisotropic layer. We investigate the effects of both anisotropy angle and anisotropy ratio on the transport of nanoparticles in saturated porous media. It is found that the concentration plume and porosity contours follow closely the principal direction of anisotropy of permeability of the central domain. PMID:26212784
Anisotropic distributions in a multiphase transport model
NASA Astrophysics Data System (ADS)
Zhou, You; Xiao, Kai; Feng, Zhao; Liu, Feng; Snellings, Raimond
2016-03-01
With a multiphase transport (AMPT) model we investigate the relation between the magnitude, fluctuations, and correlations of the initial state spatial anisotropy ɛn and the final state anisotropic flow coefficients vn in Au+Au collisions at √{s NN}=200 GeV. It is found that the relative eccentricity fluctuations in AMPT account for the observed elliptic flow fluctuations, both are in agreement with the elliptic flow fluctuation measurements from the STAR collaboration. In addition, the studies based on two- and multiparticle correlations and event-by-event distributions of the anisotropies suggest that the elliptic-power function is a promising candidate of the underlying probability density function of the event-by-event distributions of ɛn as well as vn. Furthermore, the correlations between different order symmetry planes and harmonics in the initial coordinate space and final state momentum space are presented. Nonzero values of these correlations have been observed. The comparison between our calculations and data will, in the future, shed new insight into the nature of the fluctuations of the quark-gluon plasma produced in heavy ion collisions.
Field dependent spin transport of anisotropic Heisenberg chain
NASA Astrophysics Data System (ADS)
Rezania, H.
2016-04-01
We have addressed the static spin conductivity and spin Drude weight of one-dimensional spin-1/2 anisotropic antiferromagnetic Heisenberg chain in the finite magnetic field. We have investigated the behavior of transport properties by means of excitation spectrum in terms of a hard core bosonic representation. The effect of in-plane anisotropy on the spin transport properties has also been studied via the bosonic model by Green's function approach. This anisotropy is considered for exchange constants that couple spin components perpendicular to magnetic field direction. We have found the temperature dependence of the spin conductivity and spin Drude weight in the gapped field induced spin-polarized phase for various magnetic field and anisotropy parameters. Furthermore we have studied the magnetic field dependence of static spin conductivity and Drude weight for various anisotropy parameters. Our results show the regular part of spin conductivity vanishes in isotropic case however Drude weight has a finite non-zero value and the system exhibits ballistic transport properties. We also find the peak in the static spin conductivity factor moves to higher temperature upon increasing the magnetic field at fixed anisotropy. The static spin conductivity is found to be monotonically decreasing with magnetic field due to increase of energy gap in the excitation spectrum. Furthermore we have studied the temperature dependence of spin Drude weight for different magnetic field and various anisotropy parameters.
Electromagnetic properties of anisotropic plasmonic metamaterials
NASA Astrophysics Data System (ADS)
Elser, Justin Lee
In this dissertation we study the electromagnetic properties of plasmonic metamaterials. We develop an analytical description to solve the fundamental problem of free-space scattering in planar plasmonic systems by utilizing anisotropic metamaterials. We show with exact numerical simulations that these manufactured materials do completely eliminate the scattering, and even in the case of fabrication defects the scattering is greatly minimized. We further show that the standard effective medium theory calculations for the cases of anisotropic metamaterials constructed of metal-dielectric layers fails to account for nonlocal effects in the cases where the constituent materials have large differences in permittivity. We show how it is possible to construct a plasmon waveguide out of such a structure and describe a new naming scheme based on the bulk plasmon modes that are supported. Finally, we study the effective medium theory applied to the case of plasmonic wires embedded in a dielectric host. We describe the effect the geometric properties of the structure has on effective permittivities. For example, we show that a 10% stretching/compression of the distance between nanowires can change the sign of elements of the permittivity tensor. These results can be applied to high-performance optical sensing, optical polarizers, novel lenses including the hyper- and superlenses, and subdiffraction imaging.
Transport equations for multicomponent anisotropic space plasmas - A review
NASA Technical Reports Server (NTRS)
Barakat, A. R.; Schunk, R. W.
1982-01-01
An attempt is made to present a unified approach to the study of transport phenomena in multicomponent anisotropic space plasmas. In particular, a system of generalized transport equations is presented that can be applied to widely different plasma flow conditions. The generalized transport equations can describe subsonic and supersonic flows, collision-dominated and collisionless flows, plasma flows in rapidly changing magnetic field configurations, multicomponent plasma flows with large temperature differences between the interacting species, and plasma flows that contain anisotropic temperature distributions. In addition, if Maxwell's equations of electricity and magnetism are added to the system of transport equations, they can be used to model electrostatic shocks, double layers, and magnetic merging processes. These transport equations also contain terms which act to regulate both the heat flow and temperature anisotropy, processes which appear to be operating in the solar wind.
Investigation of anisotropic thermal transport in cross-linked polymers
NASA Astrophysics Data System (ADS)
Simavilla, David Nieto
Thermal transport in lightly cross-linked polyisoprene and polybutadine subjected to uniaxial elongation is investigated experimentally. We employ two experimental techniques to assess the effect that deformation has on this class of materials. The first technique, which is based on Forced Rayleigh Scattering (FRS), allows us to measure the two independent components of the thermal diffusivity tensor as a function of deformation. These measurements along with independent measurements of the tensile stress and birefringence are used to evaluate the stress-thermal and stress-optic rules. The stress-thermal rule is found to be valid for the entire range of elongations applied. In contrast, the stress-optic rule fails for moderate to large stretch ratios. This suggests that the degree of anisotropy in thermal conductivity depends on both orientation and tension in polymer chain segments. The second technique, which is based on infrared thermography (IRT), allows us to measure anisotropy in thermal conductivity and strain induced changes in heat capacity. We validate this method measurements of anisotropic thermal conductivity by comparing them with those obtained using FRS. We find excellent agreement between the two techniques. Uncertainty in the infrared thermography method measurements is estimated to be about 2-5 %. The accuracy of the method and its potential application to non-transparent materials makes it a good alternative to extend current research on anisotropic thermal transport in polymeric materials. A second IRT application allows us to investigate the dependence of heat capacity on deformation. We find that heat capacity increases with stretch ratio in polyisoprene specimens under uniaxial extension. The deviation from the equilibrium value of heat capacity is consistent with an independent set of experiments comparing anisotropy in thermal diffusivity and conductivity employing FRS and IRT techniques. We identify finite extensibility and strain
Anisotropic Mesoscale Eddy Transport in Ocean General Circulation Models
NASA Astrophysics Data System (ADS)
Reckinger, S. J.; Fox-Kemper, B.; Bachman, S.; Bryan, F.; Dennis, J.; Danabasoglu, G.
2014-12-01
Modern climate models are limited to coarse-resolution representations of large-scale ocean circulation that rely on parameterizations for mesoscale eddies. The effects of eddies are typically introduced by relating subgrid eddy fluxes to the resolved gradients of buoyancy or other tracers, where the proportionality is, in general, governed by an eddy transport tensor. The symmetric part of the tensor, which represents the diffusive effects of mesoscale eddies, is universally treated isotropically in general circulation models. Thus, only a single parameter, namely the eddy diffusivity, is used at each spatial and temporal location to impart the influence of mesoscale eddies on the resolved flow. However, the diffusive processes that the parameterization approximates, such as shear dispersion, potential vorticity barriers, oceanic turbulence, and instabilities, typically have strongly anisotropic characteristics. Generalizing the eddy diffusivity tensor for anisotropy extends the number of parameters to three: a major diffusivity, a minor diffusivity, and the principal axis of alignment. The Community Earth System Model (CESM) with the anisotropic eddy parameterization is used to test various choices for the newly introduced parameters, which are motivated by observations and the eddy transport tensor diagnosed from high resolution simulations. Simply setting the ratio of major to minor diffusivities to a value of five globally, while aligning the major axis along the flow direction, improves biogeochemical tracer ventilation and reduces global temperature and salinity biases. These effects can be improved even further by parameterizing the anisotropic transport mechanisms in the ocean.
Anisotropic mesoscale eddy transport in ocean general circulation models
NASA Astrophysics Data System (ADS)
Reckinger, Scott; Fox-Kemper, Baylor; Bachman, Scott; Bryan, Frank; Dennis, John; Danabasoglu, Gokhan
2014-11-01
In modern climate models, the effects of oceanic mesoscale eddies are introduced by relating subgrid eddy fluxes to the resolved gradients of buoyancy or other tracers, where the proportionality is, in general, governed by an eddy transport tensor. The symmetric part of the tensor, which represents the diffusive effects of mesoscale eddies, is universally treated isotropically. However, the diffusive processes that the parameterization approximates, such as shear dispersion and potential vorticity barriers, typically have strongly anisotropic characteristics. Generalizing the eddy diffusivity tensor for anisotropy extends the number of parameters from one to three: major diffusivity, minor diffusivity, and alignment. The Community Earth System Model (CESM) with the anisotropic eddy parameterization is used to test various choices for the parameters, which are motivated by observations and the eddy transport tensor diagnosed from high resolution simulations. Simply setting the ratio of major to minor diffusivities to a value of five globally, while aligning the major axis along the flow direction, improves biogeochemical tracer ventilation and reduces temperature and salinity biases. These effects can be improved by parameterizing the oceanic anisotropic transport mechanisms.
Infrared properties of an anisotropically stirred fluid
NASA Technical Reports Server (NTRS)
Rubinstein, Robert; Barton, J. Michael
1987-01-01
A renormalization group is developed for the Navier-Stokes equations driven by an anisotropically correlated random stirring force. The stirring force generates homogeneous turbulence with a preferred direction. The force correlation is the sum of a small anisotropic perturbation and an isotropic correlation chosen, so that the fixed point of renormalization group has a k exp -5/3 energy spectrum. Fixed points for the anisotropic correlation are found near this isotropic fixed point. Two types of anisotropy are analyzed. when the additional stirring is in the plane perpendicular to the preferred direction, the renormalized viscosity is increased. When it is aligned with the preferred direction, the viscosity is decreased. A possible connection with the inverse energy cascade of two-dimensional turbulence is discussed.
Anisotropic magnetization and transport properties of RAgSb{sub 2} (R=Y, La-Nd, Sm, Gd-Tm)
Myers, Kenneth D.
1999-11-08
This study of the RAgSb{sub 2} series of compounds arose as part of an investigation of rare earth intermetallic compounds containing antimony with the rare earth in a position with tetragonal point symmetry. Materials with the rare earth in a position with tetragonal point symmetry frequently manifest strong anisotropies and rich complexity in the magnetic properties, and yet are simple enough to analyze. Antimony containing intermetallic compounds commonly possess low carrier densities and have only recently been the subject of study. Large single grain crystals were grown of the RAgSb{sub 2} (R=Y, La-Nd, Sm, Gd-Tm) series of compounds out of a high temperature solution. This method of crystal growth, commonly known as flux growth is a versatile method which takes advantage of the decreasing solubility of the target compound with decreasing temperature. Overall, the results of the crystal growth were impressive with the synthesis of single crystals of LaAgSb{sub 2} approaching one gram. However, the sample yield diminishes as the rare earth elements become smaller and heavier. Consequently, no crystals could be grown with R=Yb or Lu. Furthermore, EuAgSb{sub 2} could not be synthesized, likely due to the divalency of the Eu ion. For most of the RAgSb{sub 2} compounds, strong magnetic anisotropies are created by the crystal electric field splitting of the Hund's rule ground state. This splitting confines the local moments to lie in the basal plane (easy plane) for the majority of the members of the series. Exceptions to this include ErAgSb{sub 2} and TmAgSb{sub 2}, which have moments along the c-axis (easy axis) and CeAgSb{sub 2}, which at intermediate temperatures has an easy plane, but exchange coupling at low temperatures is anisotropic with an easy axis. Additional anisotropy is also observed within the basal plane of DyAgSb{sub 2}, where the moments are restricted to align along one of the {l_angle}110{r_angle} axes. Most of the RAgSb{sub 2} compounds
An engineered anisotropic nanofilm with unidirectional wetting properties.
Malvadkar, Niranjan A; Hancock, Matthew J; Sekeroglu, Koray; Dressick, Walter J; Demirel, Melik C
2010-12-01
Anisotropic textured surfaces allow water striders to walk on water, butterflies to shed water from their wings and plants to trap insects and pollen. Capturing these natural features in biomimetic surfaces is an active area of research. Here, we report an engineered nanofilm, composed of an array of poly(p-xylylene) nanorods, which demonstrates anisotropic wetting behaviour by means of a pin-release droplet ratchet mechanism. Droplet retention forces in the pin and release directions differ by up to 80 μN, which is over ten times greater than the values reported for other engineered anisotropic surfaces. The nanofilm provides a microscale smooth surface on which to transport microlitre droplets, and is also relatively easy to synthesize by a bottom-up vapour-phase technique. An accompanying comprehensive model successfully describes the film's anisotropic wetting behaviour as a function of measurable film morphology parameters. PMID:20935657
Effective Dirac Hamiltonian for anisotropic honeycomb lattices: Optical properties
NASA Astrophysics Data System (ADS)
Oliva-Leyva, M.; Naumis, Gerardo G.
2016-01-01
We derive the low-energy Hamiltonian for a honeycomb lattice with anisotropy in the hopping parameters. Taking the reported Dirac Hamiltonian for the anisotropic honeycomb lattice, we obtain its optical conductivity tensor and its transmittance for normal incidence of linearly polarized light. Also, we characterize its dichroic character due to the anisotropic optical absorption. As an application of our general findings, which reproduce the previous case of uniformly strained graphene, we study the optical properties of graphene under a nonmechanical distortion.
NASA Astrophysics Data System (ADS)
Dai, C. J.; Yan, X. H.; Xiao, Y.; Guo, Y. D.
2015-04-01
By means of the density functional theory combined with non-equilibrium Green's function method, ballistic transport properties of one-dimensional noncollinear magnetic monatomic chains were investigated using the single-atomic Mn chains as a model system. Fano resonances are found to exist in the monatomic Mn chains with spin-spiral structure. Furthermore, in the monatomic Mn chains with magnetic soliton lattice, Fano resonances are enhanced and cause the conductance splitting in the transmission spectra. The Fano resonances in the noncollinear magnetic single-atomic Mn chains are arising from the coupling of the localized d-states and the extended states of the quantum channels. By constructing a theoretical model and calculating its conductance, it is found that the phenomena of Fano resonances and the accompanying conductance splitting exist universally in the superlattice of one-dimensional noncollinear magnetic barriers, due to the interference of the incident waves and reflected waves by the interfaces between the neighboring barriers. Moreover, the band structures of the ferromagnetic and spin-spiral monatomic Mn chains exhibit a strong dependence on the spatial arrangement of the magnetic moments of Mn atoms when spin-orbit coupling is considered.
The anisotropic properties of high temperature superconductors - an ARPES study
NASA Astrophysics Data System (ADS)
Kaminski, Adam; Fretwell, Helen; Mesot, Joel; Rozenkrantz, Stephan; Djendjinovic, Marin; Campuzano, Juan; Randeria, Mohit; Norman, Michael; Sato, Takafumi; Takahashi, Takashi; Kadowaki, Kazuo; Hinks, David; Raffy, Helen
2001-03-01
It is now well established that cuprates are d-wave superconductors. Natural question arises concerning the symmetry of other electronic properties in these materials and their relation to anisotropic order parameter. We present our recent ARPES measurements of these properties performed on a the same sample of single cristal BISCO 2212.
Anisotropic Tribological Properties of Silicon Carbide
NASA Technical Reports Server (NTRS)
Miyoshi, K.; Buckley, D. H.
1980-01-01
The anisotropic friction, deformation and fracture behavior of single crystal silicon carbide surfaces were investigated in two categories. The categories were called adhesive and abrasive wear processes, respectively. In the adhesive wear process, the adhesion, friction and wear of silicon carbide were markedly dependent on crystallographic orientation. The force to reestablish the shearing fracture of adhesive bond at the interface between silicon carbide and metal was the lowest in the preferred orientation of silicon carbide slip system. The fracturing of silicon carbide occurred near the adhesive bond to metal and it was due to primary cleavages of both prismatic (10(-1)0) and basal (0001) planes.
Analytical properties of the anisotropic cubic Ising model
Hansel, D.; Maillard, J.M.; Oitmaa, J.; Velgakis, M.J.
1987-07-01
The authors combine an exact functional relation, the inversion relation, with conventional high-temperature expansions to explore the analytic properties of the anisotropic Ising model on both the square and simple cubic lattice. In particular, they investigate the nature of the singularities that occur in partially resummed expansions of the partition function and of the susceptibility.
Anisotropic tribological properties of silicon carbide
NASA Technical Reports Server (NTRS)
Miyoshi, K.; Buckley, D. H.
1981-01-01
The effects of crystallographic orientation on the tribological properties of single-crystal silicon carbide surfaces in contact with various solids are investigated for adhesive and abrasive wear processes. In the adhesive wear process, the adhesion and wear of silicon carbide is found to be markedly dependent on crystallographic orientation. The force resisting shearing fracture of the adhesive bonds at the interface is lower in preferred crystallographic direction of slip. In the abrasive wear process, the 1 0 -1 0 direction on the basal plane of silicon carbide exhibits the lowest coefficient of friction and the greatest resistance to abrasion.
TOPICAL REVIEW: Textured silicon nitride: processing and anisotropic properties
NASA Astrophysics Data System (ADS)
Zhu, Xinwen; Sakka, Yoshio
2008-07-01
Textured silicon nitride (Si3N4) has been intensively studied over the past 15 years because of its use for achieving its superthermal and mechanical properties. In this review we present the fundamental aspects of the processing and anisotropic properties of textured Si3N4, with emphasis on the anisotropic and abnormal grain growth of β-Si3N4, texture structure and texture analysis, processing methods and anisotropic properties. On the basis of the texturing mechanisms, the processing methods described in this article have been classified into two types: hot-working (HW) and templated grain growth (TGG). The HW method includes the hot-pressing, hot-forging and sinter-forging techniques, and the TGG method includes the cold-pressing, extrusion, tape-casting and strong magnetic field alignment techniques for β-Si3N4 seed crystals. Each processing technique is thoroughly discussed in terms of theoretical models and experimental data, including the texturing mechanisms and the factors affecting texture development. Also, methods of synthesizing the rodlike β-Si3N4 single crystals are presented. Various anisotropic properties of textured Si3 N4 and their origins are thoroughly described and discussed, such as hardness, elastic modulus, bending strength, fracture toughness, fracture energy, creep behavior, tribological and wear behavior, erosion behavior, contact damage behavior and thermal conductivity. Models are analyzed to determine the thermal anisotropy by considering the intrinsic thermal anisotropy, degree of orientation and various microstructure factors. Textured porous Si3N4 with a unique microstructure composed of oriented elongated β-Si3N4 and anisotropic pores is also described for the first time, with emphasis on its unique mechanical and thermal-mechanical properties. Moreover, as an important related material, textured α-Sialon is also reviewed, because the presence of elongated α-Sialon grains allows the production of textured α-Sialon using the
Identifying Heterogeneous Anisotropic Properties in Cerebral Aneurysms: A Pointwise Approach
Zhao, Xuefeng; Raghavan, Madhavan L.; Lu, Jia
2014-01-01
The traditional approaches of estimating heterogeneous properties in a soft tissue structure using optimization based inverse methods often face difficulties because of the large number of unknowns to be simultaneously determined. This article proposes a new method for identifying the heterogeneous anisotropic nonlinear elastic properties in cerebral aneurysms. In this method, the local properties are determined directly from the pointwise stress-strain data, thus avoiding the need for simultaneously optimizing for the property values at all points/regions in the aneurysm. The stress distributions needed for a pointwise identification are computed using an inverse elastostatic method without invoking the material properties in question. This paradigm is tested numerically through simulated inflation tests on an image-based cerebral aneurysm sac. The wall tissue is modeled as an eight-ply laminate whose constitutive behavior is described by an anisotropic hyperelastic strain-energy function containing four parameters. The parameters are assumed to vary continuously in the sac. Deformed configurations generated from forward finite element analysis are taken as input to inversely establish the parameter distributions. The delineated and the assigned distributions are in excellent agreement. A forward verification is conducted by comparing the displacement solutions obtained from the delineated and the assigned material parameters at a different pressure. The deviations in nodal displacements are found to be within 0.2% in most part of the sac. The study highlights some distinct features of the proposed method, and demonstrates the feasibility of organ level identification of the distributive anisotropic nonlinear properties in cerebral aneurysms. PMID:20490886
Anisotropic mechanical properties of graphene: a molecular dynamics study
NASA Astrophysics Data System (ADS)
Yu, Ming; Zeng, Anna; Zeng, Kevin
2014-03-01
The anisotropic mechanical properties of monolayer graphene with different shapes have been studied using an efficient quantum mechanics molecular dynamics scheme based on a semi-empirical Hamiltonian (refereed as SCED-LCAO) [PRB 74, 15540; PHYSE 42, 1]. We have found the anisotropic nature of the membrane stress. The stresses along the armchair direction are slightly stronger than that along the zigzag direction, showing strong direction selectivity. The graphene with the rectangular shape could sustain strong load (i . e ., 20%) in both armchair and zigzag directions. The graphene with the rhombus shape show large difference in the strain direction: it will quickly crack after 18 % of strain in armchair the direction, but slowly destroyed after 20% in the zigzag direction. The obtained 2D Young's modulus at infinitesimal strain and the third-order (effective nonlinear) elastic modulus are in good consistent with the experimental observation.
Anisotropic linear elastic properties of fractal-like composites.
Carpinteri, Alberto; Cornetti, Pietro; Pugno, Nicola; Sapora, Alberto
2010-11-01
In this work, the anisotropic linear elastic properties of two-phase composite materials, made up of square inclusions embedded in a matrix, are investigated. The inclusions present a fractal hierarchical distribution and are supposed to have the same Poisson's ratio as the matrix but a different Young's modulus. The effective elastic moduli of the medium are computed at each fractal iteration by coupling a position-space renormalization-group technique with a finite element analysis. The study allows to obtain and generalize some fundamental properties of fractal composite materials. PMID:21230552
Structural, anisotropic and electronic properties of C96 under pressure
NASA Astrophysics Data System (ADS)
Xing, Mengjiang; Li, Binhua; Yu, Zhengtao; Chen, Qi
2016-01-01
An investigation of the structural, elastic, electronic and anisotropic properties of C96 under high pressure has been calculated using first-principles calculations based on density functional theory, as implemented in the Cambridge Serial Total Energy Package code. At elevated pressures, the elastic constants and shear modulus, Young's modulus and Poisson's ratio for C96 increase with pressure increasing. The anisotropy studies of Young's modulus, shear modulus, Poisson's ratio, Zener anisotropy index, the universal elastic anisotropy index AU and hardness show that C96 exhibits a small anisotropy. The sound velocities, Debye temperature and band gap of C96 under high pressure are also calculated.
Anisotropic thermal property of magnetically oriented carbon nanotube polymer composites
NASA Astrophysics Data System (ADS)
Li, Bin; Dong, Shuai; Wang, Caiping; Wang, Xiaojie; Fang, Jun
2016-04-01
This paper proposes a method for preparing multi-walled carbon nanotubea/polydimethylsiloxane (MWCNTs/PDMS) composites with enhanced thermal properties by using a high magnetic field (up to 10T). The MWCNT are oriented magnetically inside a silicone by in-situ polymerization method. The anisotropic structure would be expected to produce directional thermal conductivity. This study will provide a new approach to the development of anisotropic thermal-conductive polymer composites. Systematic studies with the preparation of silicone/graphene composites corresponding to their thermal and mechanical properties are carried out under various conditions: intensity of magnetic field, time, temperature, fillings. The effect of MWCNT/graphene content and preparation procedures on thermal conductivity of composites is investigated. Dynamic mechanical analysis (DMA) is used to reveal the mechanical properties of the composites in terms of the filling contents and magnetic field strength. The scanning electron microscope (SEM) is used to observe the micro-structure of the MWCNT composites. The alignment of MWCNTs in PDMS matrix is also studied by Raman spectroscopy. The thermal conductivity measurements show that the magnetically aligned CNT-composites feature high anisotropy in thermal conductivity.
Anisotropic MRI contrast reveals enhanced ionic transport in plastic crystals.
Romanenko, Konstantin; Jin, Liyu; Madsen, Louis A; Pringle, Jennifer M; O'Dell, Luke A; Forsyth, Maria
2014-11-01
Organic ionic plastic crystals (OIPCs) are attractive as solid-state electrolytes for electrochemical devices such as lithium-ion batteries and solar and fuel cells. OIPCs offer high ionic conductivity, nonflammability, and versatility of molecular design. Nevertheless, intrinsic ion transport behavior of OIPCs is not fully understood, and their measured properties depend heavily on thermal history. Solid-state magnetic resonance imaging experiments reveal a striking image contrast anisotropy sensitive to the orientation of grain boundaries in polycrystalline OIPCs. Probing triethyl(methyl)phosphonium bis(fluorosulfonyl)imide (P1222FSI) samples with different thermal history demonstrates vast variations in microcrystallite alignment. Upon slow cooling from the melt, microcrystallites exhibit a preferred orientation throughout the entire sample, leading to an order of magnitude increase in conductivity as probed using impedance spectroscopy. This investigation describes both a new conceptual window and a new characterization method for understanding polycrystalline domain structure and transport in plastic crystals and other solid-state conductors. PMID:25312993
NASA Astrophysics Data System (ADS)
Crowgey, Benjamin Reid
for characterization of a sample filling the cross-section of a waveguide. Due to the rectangular nature of the waveguide, typically three different samples are manufactured from the same material in order to characterize the six complex material parameters. The second technique for measuring the electromagnetic properties of a biaxially anisotropic material sample uses a reduced-aperture waveguide sample holder designed to accommodate a cubical sample. All the tensor material parameters can then be determined by measuring the reflection and transmission coefficients of a single sample placed into several orientations. The parameters are obtained using a root-searching algorithm by comparing theoretically computed and measured reflection and transmission coefficients. The theoretical coefficients are determined using a mode matching technique. The first technique for characterizing the electromagnetic properties of gyromagnetic materials considers requires filling the cross-section of a waveguide. The material parameters are extracted from the measured reflection and transmission coefficients. Since the cross-sectional dimensions of waveguides become prohibitively large at low frequencies, and it is at these frequencies that the gyromagnetic properties are most pronounced, sufficiently large samples may not be available. Therefore, the second technique uses a reduced-aperture sample holder that does not require the sample to fill the entire cross section of the guide. The theoretical reflection and transmission coefficients for both methods are determined using a mode matching technique. A nonlinear least squares method is employed to extract the gyromagnetic material parameters. Finally, this dissertation introduces a waveguide standard that acts as a surrogate material with both electric and magnetic properties and is useful for verifying systems designed to characterize engineered materials using the NRW technique. A genetic algorithm is used to optimize the all
Anisotropic Elastic Properties of Muscle-like Nematic Elastomers
NASA Astrophysics Data System (ADS)
Ratna, Banahalii; Thomseniii, Donald L.; Shenoy, Devanand; Srinivasan, Amritha; Keller, Patrick
2001-03-01
De Gennes suggested in 1997 that the liquid crystal elastomers are an excellent framework to mimic muscular action. We have prepared anisotropic freestanding films of nematic elastomers from laterally attached side-chain polymers that show muscle-like mechanical properties. The orientational order of the liquid crystal side groups imposes a conformational anisotropy in the polymer backbone. When the order parameter drops at the nematic-isotropic phase transition, there is a concomitant loss of order in the backbone which results in a contraction of the film in the direction of the director orientation. Dynamic mechanical data along directions parallel and perpendicular to the optic axis, show anisotropic stress-strain behavior. The film exhibits soft elasticity when strained in the perpendicular direction when the liquid crystal mesogens reorient without appreciable stress build up. Thermostrictive studies in the parallel direction show 40constriction at the nematic-isotropic phase transition. Isometric studies show that the elastic energy stored is purely entropic in origin and the elastomer acts like a spring with unusually large spring constant at the NI transition. The maximum stress measured is 300kPa. A strain rate of 5s-1 is estimated from shear relaxation studies.
Anisotropic magnetic properties of EuAl2Si2
NASA Astrophysics Data System (ADS)
Maurya, Arvind; Kulkarni, Ruta; Thamizhavel, A.; Bonville, P.; Dhar, S. K.
2015-03-01
EuAl2Si2 is known to crystallize in the CaAl2Si2-type trigonal structure. We have grown single crystals of EuAl2Si2 by flux method, using Al-Si eutectic (87.8% Al) as self-flux, and investigated their anisotropic magnetic properties by means of magnetization, electrical resistivity and heat capacity in zero and applied magnetic fields, and 151Eu Mössbauer spectroscopy. Magnetic susceptibility data show an antiferromagnetic transition at TN = 33.3 K in agreement with the previously reported value on polycrystalline sample. The isothermal magnetization at 2 K measured along and perpendicular to the c-axis shows anisotropic behaviour, which is rather unexpected as Eu2+ is an S-state ion. The spin flip fields along the two directions are 2.8 and 4.8 T, respectively, while two closely spaced spin-flop transitions in the ab-plane are observed near 1.4 and 1.6 T. The electrical resistivity shows an upturn between TN and 60 K as the temperature is lowered below ~ 60 K, suggesting the presence of antiferromagnetic correlations in the paramagnetic state. Magnetoresistivity at 2 K in 14 T is nearly 1070 % for H // [0001]. The results of heat capacity and 151Eu Mössbauer spectroscopy are in conformity with a bulk transition at 33.3 K.
NASA Astrophysics Data System (ADS)
Blasevski, D.; Del-Castillo-Negrete, D.
2012-10-01
Heat transport in magnetized plasmas is a problem of fundamental interest in controlled fusion. In Ref.footnotetext D. del-Castillo-Negrete, and L. Chac'on, Phys. Rev. Lett., 106, 195004 (2011); Phys. Plasmas 19, 056112 (2012). we proposed a Lagrangian-Green's function (LG) method to study this problem in the strongly anisotropic (χ=0) regime. The LG method bypasses the need to discretize the transport operators on a grid and it is applicable to general parallel flux closures and 3-D magnetic fields. Here we apply the LG method to parallel transport (with local and nonlocal parallel flux closures) in reversed shear magnetic field configurations known to exhibit robust transport barriers in the vicinity of the extrema of the q-profile. By shearless Cantori (SC) we mean the invariant Cantor sets remaining after the destruction of toroidal flux surfaces with zero magnetic shear, q^'=0. We provide numerical evidence of the role of SC in the anomalously slow relaxation of radial temperature gradients in chaotic magnetic fields with no transport barriers. The spatio-temporal evolution of temperature pulses localized in the reversed shear region exhibits non-diffusive self-similar evolution and nonlocal effective radial transport.
Shape-Dependent Nonlinear Optical Properties of Anisotropic Gold Nanoparticles.
Hua, Yi; Chandra, Kavita; Dam, Duncan Hieu M; Wiederrecht, Gary P; Odom, Teri W
2015-12-17
This Letter reports the shape-dependent third-order nonlinear optical properties of anisotropic gold nanoparticles. We characterized the nonlinear absorption coefficients of nanorods, nanostars, and nanoshells using femtosecond Z-scan measurements. By comparing nanoparticle solutions with a similar linear extinction at the laser excitation wavelength, we separated shape effects from that of the localized surface plasmon wavelength. We found that the nonlinear response depended on particle shape. Using pump-probe spectroscopy, we measured the ultrafast transient response of nanoparticles, which supported the strong saturable absorption observed in nanorods and weak nonlinear response in nanoshells. We found that the magnitude of saturable absorption as well as the ultrafast spectral responses of nanoparticles were affected by the linear absorption of the nanoparticles. PMID:26595327
Anisotropic Elastic Resonance Scattering model for the Neutron Transport equation
Mohamed Ouisloumen; Abderrafi M. Ougouag; Shadi Z. Ghrayeb
2014-11-24
The resonance scattering transfer cross-section has been reformulated to account for anisotropic scattering in the center-of-mass of the neutron-nucleus system. The main innovation over previous implementations is the relaxation of the ubiquitous assumption of isotropic scattering in the center-of-mass and the actual effective use of scattering angle distributions from evaluated nuclear data files in the computation of the angular moments of the resonant scattering kernels. The formulas for the high order anisotropic moments in the laboratory system are also derived. A multi-group numerical formulation is derived and implemented into a module incorporated within the NJOY nuclear data processing code. An ultra-fine energy mesh cross section library was generated using these new theoretical models and then was used for fuel assembly calculations with the PARAGON lattice physics code. The results obtained indicate a strong effect of this new model on reactivity, multi-group fluxes and isotopic inventory during depletion.
Tan, Jinwang; Tartakovsky, Alexandre M.; Ferris, Kim F.; Ryan, Emily M.
2016-01-01
Dendrite formation on the electrode surface of high energy density lithium (Li) batteries causes safety problems and limits their applications. Suppressing dendrite growth could significantly improve Li battery performance. Dendrite growth and morphology is a function of the mixing in the electrolyte near the anode interface. Most research into dendrites in batteries focuses on dendrite formation in isotropic electrolytes (i.e., electrolytes with isotropic diffusion coefficient). In this work, an anisotropic diffusion reaction model is developed to study the anisotropic mixing effect on dendrite growth in Li batteries. The model uses a Lagrangian particle-based method to model dendrite growth in an anisotropic electrolyte solution. The model is verified by comparing the numerical simulation results with analytical solutions, and its accuracy is shown to be better than previous particle-based anisotropic diffusion models. Several parametric studies of dendrite growth in an anisotropic electrolyte are performed and the results demonstrate the effects of anisotropic transport on dendrite growth and morphology, and show the possible advantages of anisotropic electrolytes for dendrite suppression.
NASA Astrophysics Data System (ADS)
Liu, Bilu; Zhou, Chongwu
2D layered materials with diverse properties have attracted significant interest in the past decade. The layered materials discovered so far have covered a wide, yet discontinuous electromagnetic spectral range from semimetallic graphene, insulating boron nitride, to semiconductors with bandgaps from middle infrared to visible light. Here, we introduce new layered semiconductors, black arsenic-phosphorus (b-AsP), with highly tunable chemical compositions and electronic and optical properties. Transport and infrared absorption studies demonstrate the semiconducting nature of b-AsP with tunable bandgaps, ranging from 0.3 to 0.15 eV. These bandgaps fall into long-wavelength infrared (LWIR) regime and cannot be readily reached by other layered materials. Moreover, polarization-resolved infrared absorption and Raman studies reveal in-plane anisotropic properties of b-AsP. This family of layered b-AsP materials extend the electromagnetic spectra covered by 2D layered materials to the LWIR regime, and may find unique applications for future all 2D layered material based devices. Ref. Liu, B., et al., Black Arsenic-Phosphorus: Layered Anisotropic Infrared Semiconductors with Highly Tunable Compositions and Properties. Adv. Mater., 2015, 27, 4423-4429.
NASA Astrophysics Data System (ADS)
Blazevski, Daniel; del-Castillo-Negrete, Diego
2013-06-01
A study of anisotropic heat transport in reversed shear (nonmonotonic q-profile) magnetic fields is presented. The approach is based on a recently proposed Lagrangian-Green's function method that allows an efficient and accurate integration of the parallel (i.e., along the magnetic field) heat transport equation. The magnetic field lines are described by a nontwist Hamiltonian system, known to exhibit separatrix reconnection and robust shearless (dq/dr=0) transport barriers. The changes in the magnetic field topology due to separatrix reconnection lead to bifurcations in the equilibrium temperature distribution. For perturbations of moderate amplitudes, magnetic chaos is restricted to bands flanking the shearless region. As a result, the temperature flattens in the chaotic bands and develops a very sharp radial gradient at the shearless region. For perturbations with larger amplitude, shearless Cantori (i.e., critical magnetic surfaces located at the minimum of the q profile) give rise to anomalous temperature relaxation involving widely different time scales. The first stage consists of the relatively fast flattening of the radial temperature profile in the chaotic bands with negligible flux across the shearless region that, for practical purposes, on a short time scale acts as an effective transport barrier despite the lack of magnetic flux surfaces. In the long-time scale, heat starts to flow across the shearless region, albeit at a comparatively low rate. The transport of a narrow temperature pulse centered at the reversed shear region exhibits weak self-similar scaling with non-Gaussian scaling functions indicating that transport at this scale cannot be modeled as a diffusive process with a constant diffusivity. Evidence of nonlocal effective radial transport is provided by the existence of regions with nonzero heat flux and zero temperature gradient. Parametric flux-gradient plots exhibit multivalued loops that question the applicability of the Fourier
Blazevski, Daniel; del-Castillo-Negrete, Diego
2013-06-01
A study of anisotropic heat transport in reversed shear (nonmonotonic q-profile) magnetic fields is presented. The approach is based on a recently proposed Lagrangian-Green's function method that allows an efficient and accurate integration of the parallel (i.e., along the magnetic field) heat transport equation. The magnetic field lines are described by a nontwist Hamiltonian system, known to exhibit separatrix reconnection and robust shearless (dq/dr=0) transport barriers. The changes in the magnetic field topology due to separatrix reconnection lead to bifurcations in the equilibrium temperature distribution. For perturbations of moderate amplitudes, magnetic chaos is restricted to bands flanking the shearless region. As a result, the temperature flattens in the chaotic bands and develops a very sharp radial gradient at the shearless region. For perturbations with larger amplitude, shearless Cantori (i.e., critical magnetic surfaces located at the minimum of the q profile) give rise to anomalous temperature relaxation involving widely different time scales. The first stage consists of the relatively fast flattening of the radial temperature profile in the chaotic bands with negligible flux across the shearless region that, for practical purposes, on a short time scale acts as an effective transport barrier despite the lack of magnetic flux surfaces. In the long-time scale, heat starts to flow across the shearless region, albeit at a comparatively low rate. The transport of a narrow temperature pulse centered at the reversed shear region exhibits weak self-similar scaling with non-Gaussian scaling functions indicating that transport at this scale cannot be modeled as a diffusive process with a constant diffusivity. Evidence of nonlocal effective radial transport is provided by the existence of regions with nonzero heat flux and zero temperature gradient. Parametric flux-gradient plots exhibit multivalued loops that question the applicability of the Fourier
Nanostructured SnS with inherent anisotropic optical properties for high photoactivity
NASA Astrophysics Data System (ADS)
Patel, Malkeshkumar; Chavda, Arvind; Mukhopadhyay, Indrajit; Kim, Joondong; Ray, Abhijit
2016-01-01
In view of the worldwide energy challenge in the 21st century, the technology of semiconductor-based photoelectrochemical (PEC) water splitting has received considerable attention as an alternative approach for solar energy harvesting and storage. Two-dimensional (2D) structures such as nanosheets have the potential to tap the solar energy by unlocking the functional properties at the nanoscale. Tin(ii) sulfide is a fascinating solar energy material due to its anisotropic material properties. In this manuscript, we report on exploiting the 2D structure modulated optical properties of nanocrystalline SnS thin film synthesized by chemical spray pyrolysis using ambient transport in the harvesting of solar energy. We obtained the nanostructured SnS with well-preserved dimensions and morphologies with one step processing. The work demonstrates that the intrinsically ordered SnS nanostructure on FTO coated glass can tap the incident radiation in an efficient manner. The structure-property relationship to explain the photo-response in nanocrystalline-SnS is verified experimentally and theoretically. The novel design scheme for antireflection coating along with the anisotropic properties of SnS is conceived for realizing a PEC cell. The developed PEC cell consists of a SnS photoanode which shows considerably high photocurrent density of 7 mA cm-2 with aqueous media under AM 1.5G, 100 mW cm-2 exposure with notably stable operation. Electrochemical impedance spectroscopy revealed that a non-ideal capacitive behavior as well as drift assisted transport across the solid-state interface is responsible for such a high photo-current density in the nanocrystalline-SnS photoanode.In view of the worldwide energy challenge in the 21st century, the technology of semiconductor-based photoelectrochemical (PEC) water splitting has received considerable attention as an alternative approach for solar energy harvesting and storage. Two-dimensional (2D) structures such as nanosheets have the
Anisotropic electronic, mechanical, and optical properties of monolayer WTe2
NASA Astrophysics Data System (ADS)
Torun, E.; Sahin, H.; Cahangirov, S.; Rubio, A.; Peeters, F. M.
2016-02-01
Using first-principles calculations, we investigate the electronic, mechanical, and optical properties of monolayer WTe2. Atomic structure and ground state properties of monolayer WTe2 (Td phase) are anisotropic which are in contrast to similar monolayer crystals of transition metal dichalcogenides, such as MoS2, WS2, MoSe2, WSe2, and MoTe2, which crystallize in the H-phase. We find that the Poisson ratio and the in-plane stiffness is direction dependent due to the symmetry breaking induced by the dimerization of the W atoms along one of the lattice directions of the compound. Since the semimetallic behavior of the Td phase originates from this W-W interaction (along the a crystallographic direction), tensile strain along the dimer direction leads to a semimetal to semiconductor transition after 1% strain. By solving the Bethe-Salpeter equation on top of single shot G0W0 calculations, we predict that the absorption spectrum of Td-WTe2 monolayer is strongly direction dependent and tunable by tensile strain.
Nanostructured SnS with inherent anisotropic optical properties for high photoactivity.
Patel, Malkeshkumar; Chavda, Arvind; Mukhopadhyay, Indrajit; Kim, Joondong; Ray, Abhijit
2016-01-28
In view of the worldwide energy challenge in the 21(st) century, the technology of semiconductor-based photoelectrochemical (PEC) water splitting has received considerable attention as an alternative approach for solar energy harvesting and storage. Two-dimensional (2D) structures such as nanosheets have the potential to tap the solar energy by unlocking the functional properties at the nanoscale. Tin(ii) sulfide is a fascinating solar energy material due to its anisotropic material properties. In this manuscript, we report on exploiting the 2D structure modulated optical properties of nanocrystalline SnS thin film synthesized by chemical spray pyrolysis using ambient transport in the harvesting of solar energy. We obtained the nanostructured SnS with well-preserved dimensions and morphologies with one step processing. The work demonstrates that the intrinsically ordered SnS nanostructure on FTO coated glass can tap the incident radiation in an efficient manner. The structure-property relationship to explain the photo-response in nanocrystalline-SnS is verified experimentally and theoretically. The novel design scheme for antireflection coating along with the anisotropic properties of SnS is conceived for realizing a PEC cell. The developed PEC cell consists of a SnS photoanode which shows considerably high photocurrent density of 7 mA cm(-2) with aqueous media under AM 1.5G, 100 mW cm(-2) exposure with notably stable operation. Electrochemical impedance spectroscopy revealed that a non-ideal capacitive behavior as well as drift assisted transport across the solid-state interface is responsible for such a high photo-current density in the nanocrystalline-SnS photoanode. PMID:26745636
Measurement of anisotropic thermophysical properties of cylindrical Li-ion cells
NASA Astrophysics Data System (ADS)
Drake, S. J.; Wetz, D. A.; Ostanek, J. K.; Miller, S. P.; Heinzel, J. M.; Jain, A.
2014-04-01
Cylindrical Li-ion cells have demonstrated among the highest power density of all Li-ion cell types and typically employ a spiral electrode assembly. This spiral assembly is expected to cause large anisotropy in thermal conductance between the radial and axial directions due to the large number of interfaces between electrode and electrolyte layers in the radial conduction path, which are absent in the axial direction. This paper describes a novel experimental technique to measure the anisotropic thermal conductivity and heat capacity of Li-ion cells using adiabatic unsteady heating. Analytical modeling of the method is presented and is shown to agree well with finite-element simulation models. Experimental measurements indicate that radial thermal conductivity is two orders of magnitude lower than axial thermal conductivity for cylindrical 26650 and 18650 LiFePO4 cells. Due to the strong influence of temperature on cell performance and behavior, accounting for this strong anisotropy is critical when modeling battery behavior and designing battery cooling systems. This work improves the understanding of thermal transport in Li-ion cells, and presents a simple method for measuring anisotropic thermal transport properties in cylindrical cells.
Modeling anisotropic flow and heat transport by using mimetic finite differences
NASA Astrophysics Data System (ADS)
Chen, Tao; Clauser, Christoph; Marquart, Gabriele; Willbrand, Karen; Büsing, Henrik
2016-08-01
Modeling anisotropic flow in porous or fractured rock often assumes that the permeability tensor is diagonal, which means that its principle directions are always aligned with the coordinate axes. However, the permeability of a heterogeneous anisotropic medium usually is a full tensor. For overcoming this shortcoming, we use the mimetic finite difference method (mFD) for discretizing the flow equation in a hydrothermal reservoir simulation code, SHEMAT-Suite, which couples this equation with the heat transport equation. We verify SHEMAT-Suite-mFD against analytical solutions of pumping tests, using both diagonal and full permeability tensors. We compare results from three benchmarks for testing the capability of SHEMAT-Suite-mFD to handle anisotropic flow in porous and fractured media. The benchmarks include coupled flow and heat transport problems, three-dimensional problems and flow through a fractured porous medium with full equivalent permeability tensor. It shows firstly that the mimetic finite difference method can model anisotropic flow both in porous and in fractured media accurately and its results are better than those obtained by the multi-point flux approximation method in highly anisotropic models, secondly that the asymmetric permeability tensor can be included and leads to improved results compared the symmetric permeability tensor in the equivalent fracture models, and thirdly that the method can be easily implemented in existing finite volume or finite difference codes, which has been demonstrated successfully for SHEMAT-Suite.
Anisotropic vanadium dioxide sculptured thin films with superior thermochromic properties.
Sun, Yaoming; Xiao, Xiudi; Xu, Gang; Dong, Guoping; Chai, Guanqi; Zhang, Hua; Liu, Pengyi; Zhu, Hanmin; Zhan, Yongjun
2013-01-01
VO2 (M) STF through reduction of V2O5 STF was prepared. The results illustrate that V2O5 STF can be successfully obtained by oblique angle thermal evaporation technique. After annealing at 550 °C/3 min, the V2O5 STF deposited at 85° can be easily transformed into VO2 STF with slanted columnar structure and superior thermochromic properties. After deposition SiO2 antireflective layer, Tlum of VO2 STF is enhanced 26% and ΔTsol increases 60% compared with that of normal VO2 thin films. Due to the anisotropic microstructure of VO2 STF, angular selectivity transmission of VO2 STF is observed and the solar modulation ability is further improved from 7.2% to 8.7% when light is along columnar direction. Moreover, the phase transition temperature of VO2 STF can be depressed into 54.5 °C without doping. Considering the oblique incidence of sunlight on windows, VO2 STF is more beneficial for practical application as smart windows compared with normal homogenous VO2 thin films. PMID:24067743
Anisotropic vanadium dioxide sculptured thin films with superior thermochromic properties
Sun, Yaoming; Xiao, Xiudi; Xu, Gang; Dong, Guoping; Chai, Guanqi; Zhang, Hua; Liu, Pengyi; Zhu, Hanmin; Zhan, Yongjun
2013-01-01
VO2 (M) STF through reduction of V2O5 STF was prepared. The results illustrate that V2O5 STF can be successfully obtained by oblique angle thermal evaporation technique. After annealing at 550°C/3 min, the V2O5 STF deposited at 85° can be easily transformed into VO2 STF with slanted columnar structure and superior thermochromic properties. After deposition SiO2 antireflective layer, Tlum of VO2 STF is enhanced 26% and ΔTsol increases 60% compared with that of normal VO2 thin films. Due to the anisotropic microstructure of VO2 STF, angular selectivity transmission of VO2 STF is observed and the solar modulation ability is further improved from 7.2% to 8.7% when light is along columnar direction. Moreover, the phase transition temperature of VO2 STF can be depressed into 54.5°C without doping. Considering the oblique incidence of sunlight on windows, VO2 STF is more beneficial for practical application as smart windows compared with normal homogenous VO2 thin films. PMID:24067743
Effects of anisotropic thermal conduction on wind properties in hot accretion flow
NASA Astrophysics Data System (ADS)
Bu, De-Fu; Wu, Mao-Chun; Yuan, Ye-Fei
2016-06-01
Previous works have clearly shown the existence of winds from black hole hot accretion flow and investigated their detailed properties. In extremely low accretion rate systems, the collisional mean-free path of electrons is large compared with the length-scale of the system, thus thermal conduction is dynamically important. When the magnetic field is present, the thermal conduction is anisotropic and energy transport is along magnetic field lines. In this paper, we study the effects of anisotropic thermal conduction on the wind production in hot accretion flows by performing two-dimensional magnetohydrodynamic simulations. We find that thermal conduction has only moderate effects on the mass flux of wind. But the energy flux of wind can be increased by a factor of ˜10 due to the increase of wind velocity when thermal conduction is included. The increase of wind velocity is because of the increase of driving forces (e.g. gas pressure gradient force and centrifugal force) when thermal conduction is included. This result demonstrates that thermal conduction plays an important role in determining the properties of wind.
Quantum transport in Dirac materials: Signatures of tilted and anisotropic Dirac and Weyl cones
NASA Astrophysics Data System (ADS)
Trescher, Maximilian; Sbierski, Björn; Brouwer, Piet W.; Bergholtz, Emil J.
2015-03-01
We calculate conductance and noise for quantum transport at the nodal point for arbitrarily tilted and anisotropic Dirac or Weyl cones. Tilted and anisotropic dispersions are generic in the absence of certain discrete symmetries, such as particle-hole and lattice point group symmetries. Whereas anisotropy affects the conductance g , but leaves the Fano factor F (the ratio of shot noise power and current) unchanged, a tilt affects both g and F . Since F is a universal number in many other situations, this finding is remarkable. We apply our general considerations to specific lattice models of strained graphene and a pyrochlore Weyl semimetal.
Willert, Jeffrey; Park, H.; Taitano, William
2015-10-12
High-order/low-order (or moment-based acceleration) algorithms have been used to significantly accelerate the solution to the neutron transport k-eigenvalue problem over the past several years. Recently, the nonlinear diffusion acceleration algorithm has been extended to solve fixed-source problems with anisotropic scattering sources. In this paper, we demonstrate that we can extend this algorithm to k-eigenvalue problems in which the scattering source is anisotropic and a significant acceleration can be achieved. Lastly, we demonstrate that the low-order, diffusion-like eigenvalue problem can be solved efficiently using a technique known as nonlinear elimination.
Spatial frequency analysis of anisotropic drug transport in tumor samples
Russell, Stewart; Samkoe, Kimberley S.; Gunn, Jason R.; Hoopes, P. Jack; Nguyen, Thienan A.; Russell, Milo J.; Alfano, Robert R.; Pogue, Brian W.
2014-01-01
Abstract. Directional Fourier spatial frequency analysis was used on standard histological sections to identify salient directional bias in the spatial frequencies of stromal and epithelial patterns within tumor tissue. This directional bias is shown to be correlated to the pathway of reduced fluorescent tracer transport. Optical images of tumor specimens contain a complex distribution of randomly oriented aperiodic features used for neoplastic grading that varies with tumor type, size, and morphology. The internal organization of these patterns in frequency space is shown to provide a precise fingerprint of the extracellular matrix complexity, which is well known to be related to the movement of drugs and nanoparticles into the parenchyma, thereby identifying the characteristic spatial frequencies of regions that inhibit drug transport. The innovative computational methodology and tissue validation techniques presented here provide a tool for future investigation of drug and particle transport in tumor tissues, and could potentially be used a priori to identify barriers to transport, and to analyze real-time monitoring of transport with respect to therapeutic intervention. PMID:24395585
Spatial frequency analysis of anisotropic drug transport in tumor samples
NASA Astrophysics Data System (ADS)
Russell, Stewart; Samkoe, Kimberley S.; Gunn, Jason R.; Hoopes, P. Jack; Nguyen, Thienan A.; Russell, Milo J.; Alfano, Robert R.; Pogue, Brian W.
2014-01-01
Directional Fourier spatial frequency analysis was used on standard histological sections to identify salient directional bias in the spatial frequencies of stromal and epithelial patterns within tumor tissue. This directional bias is shown to be correlated to the pathway of reduced fluorescent tracer transport. Optical images of tumor specimens contain a complex distribution of randomly oriented aperiodic features used for neoplastic grading that varies with tumor type, size, and morphology. The internal organization of these patterns in frequency space is shown to provide a precise fingerprint of the extracellular matrix complexity, which is well known to be related to the movement of drugs and nanoparticles into the parenchyma, thereby identifying the characteristic spatial frequencies of regions that inhibit drug transport. The innovative computational methodology and tissue validation techniques presented here provide a tool for future investigation of drug and particle transport in tumor tissues, and could potentially be used a priori to identify barriers to transport, and to analyze real-time monitoring of transport with respect to therapeutic intervention.
Anisotropic Electron transport and device applications of atomically thin ReS2
NASA Astrophysics Data System (ADS)
Liu, Erfu; Fu, Yajun; Wang, Yaojia; Feng, Yanqing; Liu, Huimei; Wan, Xiangang; Zhou, Wei; Wang, Baigeng; Zeng, Junwen; Ho, Ching-Hwa; Huang, Ying-Sheng; Yuan, Hongtao; Hwang, Harold Y.; Cui, Yi; Xing, Dingyu; Miao, Feng
Semiconducting two-dimensional transition metal dichalcogenides are emerging as top candidates for post-silicon electronics. While most of them exhibit isotropic behavior, lowering the lattice symmetry could induce anisotropic properties, which are both scientifically interesting and potentially useful. In this talk, we will present atomically thin rhenium disulfide (ReS2) flakes with unique distorted 1T structure, which exhibit in-plane anisotropic properties. We first fabricated mono- and few-layer ReS2 field effect transistors, which exhibit competitive performance with large current on/off ratios (~107) and low subthreshold swings (100 mV dec-1) . The observed anisotropic ratio along two principle axes reaches up to 3.1. Furthermore, we successfully demonstrated an integrated digital inverter with good performance by utilizing two ReS2 anisotropic field effect transistors, suggesting the promising implementation of large-scale two-dimensional logic circuits. Recent results on ultra-high responsivity (as high as 88,600 A W-1) phototransistors based on few-layer ReS2 will also be discussed. Our results underscore the unique properties of two-dimensional semiconducting materials with low crystal symmetry for future electronic and optoelectronic applications.
Ilegbusi, Olusegun; Li, Ziang; Min, Yugang; Meeks, Sanford; Kupelian, Patrick; Santhanam, Anand P
2012-01-01
The aim of this paper is to model the airflow inside lungs during breathing and its fluid-structure interaction with the lung tissues and the lung tumor using subject-specific elastic properties. The fluid-structure interaction technique simultaneously simulates flow within the airway and anisotropic deformation of the lung lobes. The three-dimensional (3D) lung geometry is reconstructed from the end-expiration 3D CT scan datasets of humans with lung cancer. The lung is modeled as a poro-elastic medium with anisotropic elastic property (non-linear Young's modulus) obtained from inverse lung elastography of 4D CT scans for the same patients. The predicted results include the 3D anisotropic lung deformation along with the airflow pattern inside the lungs. The effect is also presented of anisotropic elasticity on both the spatio-temporal volumetric lung displacement and the regional lung hysteresis. PMID:22356987
Anisotropic Pressure, Transport, and Shielding of Magnetic Perturbations
H.E. Mynick and A.H. Boozer
2008-05-23
We compute the effect on a tokamak of applying a nonaxisymmetric magnetic perturbation δΒ. An equilibrium with scalar pressure p yields zero net radial current, and therefore zero torque. Thus, the usual approach, which assumes scalar pressure, is not self-consistent, and masks the close connection which exists between that radial current and the in-surface currents, which provide shielding or amplification of δΒ. Here, we analytically compute the pressure anisoptropy, anisoptropy, pll, p⊥ ≠ p, and from this, both the radial and in-surface currents. The surface-average of the radial current recovers earlier expressions for ripple transport, while the in-surface currents provide an expression for the amount of self-consistent shielding the plasma provides.
Anisotropic charge transport in flavonoids as organic semiconductors
NASA Astrophysics Data System (ADS)
Hou, Chunyuan; Chen, Xin
2015-03-01
A quantum mechanical approach has been used to investigate on the potential for using two naturally occurring flavonoids: quercetin and luteolin as candidates for organic semiconductor. Selection of flavonoids enables to evaluate the effects of hydroxyl group structural features. The relationship between molecular packing and charge transport in flavonoids is presented. The calculated results indicate that quercetin should be an ideal candidate as high-performance p-type organic semiconductor material, while luteolin is predicted as n-type organic semiconductor material. The predicted maximum electron mobility value of quercetin is 0.075 cm2 V-1 s-1, which appears at the orientation angle near 91°/271° of conducting channel on the reference planes b-c. Theoretical investigation of natural semiconductors is helpful for designing higher performance electronic materials used in biochemical and industrial field to replace expensive and rare organic materials.
An Algorithm for the Transport of Anisotropic Neutrons
NASA Technical Reports Server (NTRS)
Tweed, J.
2005-01-01
One major obstacle to human space exploration is the possible limitations imposed by the adverse effect of long-term exposure to the space environment. Even before human spaceflight began, the potentially brief exposure of astronauts to the very intense random solar particle events (SPE) were of great concern. A new challenge appears in deep space exploration from exposure to the low-intensity heavy-ion flux of the galactic cosmic rays (GCR) since the missions are of long duration and the accumulated GCR exposures can be high. Because cancer induction rates increase behind low to rather large thicknesses of aluminum shielding, according to available biological data on mammalian exposures to GCR like ions, the shield requirements for a Mars mission are prohibitively expensive in terms of mission launch costs. Therefore, a critical issue in the Human Exploration and Development of Space enterprise is cost effective mitigation of risk associated with ionizing radiation exposure. In order to estimate astronaut risk to GCR exposure and associated cancer risks and health hazards, it is necessary to do shield material studies. To determine an optimum radiation shield material it is necessary to understand nuclear interaction processes such as fragmentation and secondary particle production which is a function of energy dependent cross sections. This requires knowledge of material transmission characteristics either through laboratory testing or improved theoretical modeling. Here ion beam transport theory is of importance in that testing of materials in the laboratory environment generated by particle accelerators is a necessary step in materials development and evaluation for space use. The approximations used in solving the Boltzmann transport equation for the space setting are often not sufficient for laboratory work and those issues are a major emphasis of the present work.
Effective Transport Properties
NASA Astrophysics Data System (ADS)
Mauri, Roberto
In this chapter we study a particular case of multiphase systems, namely two-phase materials in which one of the phases is randomly dispersed in the other, so that the composite can be viewed on a macroscale as an effective continuum, with well defined properties. In general, the theoretical determination of the parameter for an effective medium requires, as a rule, the solution of a corresponding transport problem at the microscale, which takes into account the morphology of the system and its evolution. As the mathematical problem is well-posed on a microscale, this can be accomplished using, for example, the multiple scale approach shown in Chap.
Sofer, Zdeněk; Sedmidubský, David; Huber, Štěpán; Luxa, Jan; Bouša, Daniel; Boothroyd, Chris; Pumera, Martin
2016-03-01
Layered elemental materials, such as black phosphorus, exhibit unique properties originating from their highly anisotropic layered structure. The results presented herein demonstrate an anomalous anisotropy for the electrical, magnetic, and electrochemical properties of black phosphorus. It is shown that heterogeneous electron transfer from black phosphorus to outer- and inner-sphere molecular probes is highly anisotropic. The electron-transfer rates differ at the basal and edge planes. These unusual properties were interpreted by means of calculations, manifesting the metallic character of the edge planes as compared to the semiconducting properties of the basal plane. This indicates that black phosphorus belongs to a group of materials known as topological insulators. Consequently, these effects render the magnetic properties highly anisotropic, as both diamagnetic and paramagnetic behavior can be observed depending on the orientation in the magnetic field. PMID:26822395
Smith, R.W.; Schafer, A.L.
1999-07-01
Although transport calculations are often formulated in terms of mass-based isotropic distribution coefficients, it is the abundance of reactive surface areas of subsurface materials that controls contaminant adsorption. In water-saturated homogeneous systems devoid of advective fluxes (e.g., batch experiments), the available reactive surface area is similar to the total surface area (as measured by conventional methods such as BET gas adsorption). However, in physically and chemically heterogeneous systems with advective fluxes, the effective reactive surface area (i.e., the surface area that a packet of advecting water interacts with) is smaller than the laboratory measured surface area and is a complex function of advective velocity and the correlation structures of the physical and chemical heterogeneities. Theoretical derivations for an important but simple type of heterogeneity (fine-scale horizontal layering) suggest that the effective reactive surface area is an anisotropic property of the medium and is inversely correlated with the anisotropy in hydraulic conductivity. The implications of reactive transport anisotropy include the concept that the retardation factor should be treated as a directional property rather than being treated as a constant. Furthermore, because of the inverse relationship between effective reactive surface area and hydraulic conductivity, batch adsorption experiments tend to overestimate the retention of contaminants relative to intact natural materials.
Zhang, Rujing; Chen, Qiao; Zhen, Zhen; Jiang, Xin; Zhong, Minlin; Zhu, Hongwei
2015-09-01
Assembling particular building blocks into composites with diverse targeted structures has attracted considerable interest for understanding its new properties and expanding the potential applications. Anisotropic organization is considered as a frequently used targeted architecture and possesses many peculiar properties because of its unusual shapes. Here, we show that anisotropic graphene monoliths (AGMs), three-dimensional architectures of well-aligned graphene sheets obtained by a dip-coating method using cellulose acetate fibers as templates show thermal-insulating, fire-retardant, and anisotropic properties. They exhibit a feature of higher mechanical strength and thermal/electrical conductivities in the axial direction than in the radial direction. Elastic polymer resins are then introduced into the pores of the AGMs to form conductive and flexible composites. The composites, as AGMs, retain the unique anisotropic properties, revealing opposite resistance change under compressions in different directions. The outstanding anisotropic properties of AGMs make them possible to be applied in the fields of thermal insulation, integrated circuits, and electromechanical devices. PMID:26284380
NASA Astrophysics Data System (ADS)
Xing, Xiangzhuo; Zhou, Wei; Zhou, Nan; Yuan, Feifei; Pan, Yongqiang; Zhao, Haijun; Xu, Xiaofeng; Shi, Zhixiang
2016-05-01
High-quality single crystal Ca0.8La0.2Fe0.98Co0.02As2 has been successfully synthesized using a self-flux method. The magnetization measurement reveals a second peak effect and high critical current density {J}c exceeding 2 × 106 A cm-2 at 5 K (self-field). The upper critical field anisotropy was systematically studied by measuring the electrical resistivity under various magnetic fields and angles. The angle-dependent magnetoresistance, by choosing an appropriate anisotropy parameter within the framework of the anisotropic Ginzburg-Landau (AGL) theory, can be scaled onto one single curve. In the normal state, the negative Hall coefficient shows strong but nonmonotonic T-dependence through a minimum at ˜175 K. Moreover, it is shown that the magnetoresistance apparently violates the semiclassical Kohler’s rule below ˜175 K but can be well scaled by the Hall angle instead. This suggests either a change of carriers with T or exotic anisotropic scattering in the system.
Anisotropic gold nanoparticles: synthesis, properties, applications, and toxicity.
Li, Na; Zhao, Pengxiang; Astruc, Didier
2014-02-10
Anisotropic gold nanoparticles (AuNPs) have attracted the interest of scientists for over a century, but research in this field has considerably accelerated since 2000 with the synthesis of numerous 1D, 2D, and 3D shapes as well as hollow AuNP structures. The anisotropy of these nonspherical, hollow, and nanoshell AuNP structures is the source of the plasmon absorption in the visible region as well as in the near-infrared (NIR) region. This NIR absorption is especially sensitive to the AuNP shape and medium and can be shifted towards the part of the NIR region in which living tissue shows minimum absorption. This has led to crucial applications in medical diagnostics and therapy ("theranostics"), especially with Au nanoshells, nanorods, hollow nanospheres, and nanocubes. In addition, Au nanowires (AuNWs) can be synthesized with longitudinal dimensions of several tens of micrometers and can serve as plasmon waveguides for sophisticated optical devices. The application of anisotropic AuNPs has rapidly spread to optical, biomedical, and catalytic areas. In this Review, a brief historical survey is given, followed by a summary of the synthetic modes, variety of shapes, applications, and toxicity issues of this fast-growing class of nanomaterials. PMID:24421264
Chacon, Luis; del-Castillo-Negrete, Diego; Hauck, Cory D.
2014-09-01
We propose a Lagrangian numerical algorithm for a time-dependent, anisotropic temperature transport equation in magnetized plasmas in the large guide field regime. The approach is based on an analytical integral formal solution of the parallel (i.e., along the magnetic field) transport equation with sources, and it is able to accommodate both local and non-local parallel heat flux closures. The numerical implementation is based on an operator-split formulation, with two straightforward steps: a perpendicular transport step (including sources), and a Lagrangian (field-line integral) parallel transport step. Algorithmically, the first step is amenable to the use of modern iterative methods, while the second step has a fixed cost per degree of freedom (and is therefore scalable). Accuracy-wise, the approach is free from the numerical pollution introduced by the discrete parallel transport term when the perpendicular to parallel transport coefficient ratio X_{⊥} /X_{∥} becomes arbitrarily small, and is shown to capture the correct limiting solution when ε = X⊥L^{2}_{∥}/X1L^{2}_{⊥} → 0 (with L∥∙ L⊥ , the parallel and perpendicular diffusion length scales, respectively). Therefore, the approach is asymptotic-preserving. We demonstrate the capabilities of the scheme with several numerical experiments with varying magnetic field complexity in two dimensions, including the case of transport across a magnetic island.
Synthesis and optical properties of anisotropic metal nanoparticles.
Hao, Encai; Schatz, George C; Hupp, Joseph T
2004-07-01
In this paper we overview our recent studies of anisotropic noble metal (e.g. gold and silver) nanoparticles, in which a combination of theory and experiment has been used to elucidate the extinction spectra of the particles, as well as information related to their surface enhanced Raman spectroscopy. We used wet-chemical methods to generate several structurally well-defined nanostructures other than solid spheres, including silver nanodisks and triangular nanoprisms, and gold nanoshells and multipods. When solid spheres are transformed into one of these shapes, the surface plasmon resonances in these particles are strongly affected, typically red-shifting and even splitting into distinctive dipole and quadrupole plasmon modes. In parallel, we have developed computational electrodynamics methods based on the discrete dipole approximation (DDA) method to determine the origins of these intriguing optical features. This has resulted in considerable insight concerning the variation of plasmon wavelength with nanoparticle size, shape and dielectric environment, as well as the use of these particles for optical sensing applications. PMID:15617376
Anisotropic properties of RFe_2Ge2 single crystals
NASA Astrophysics Data System (ADS)
Avila, M. A.; Bud'Ko, S. L.; Canfield, P. C.
2003-03-01
We have grown RFe_2Ge2 single crystals for R = Y and ten members of the lanthanide series (Pr, Nd, Sm, Gd-Tm, Lu) using Sn flux as the solvent. The method yields clean, high quality crystal plates as evidenced by residual resistivities and RRR values in the range of 3-12 μΩ cm and 20-70 respectively. The crystals are also virtually free of magnetic impurities or secondary phases, allowing the study of the intrinsic anisotropic magnetic behavior of each compound. Characterization was made with X-Ray diffraction, temperature and field dependent magnetization, specific heat and resistivity. Strong anisotropies arising mostly from CEF effects were observed for all magnetic rare earths except Gd. Anti-ferromagnetic ordering occurred at temperatures between 16.5 K (Nd) and 1.25 K (Ho) and for some members there are further well-defined metamagnetic transitions. The calculated effective moments per rare earth atom tend to be larger than the expected values at high temperatures while smaller at low temperatures, probably indicating temperature-dependent contributions of d-band electrons to the magnetic behavior. We acknowledge the help of R. A. Ribeiro and C. Petrovic in the X-Ray diffraction measurements, and K. Myers in the early development and characterization of the crystals. Ames Laboratory is operated for the US Department of Energy by Iowa State University under Contract No. W-7405-Eng-82. This work was supported by the Director for Energy Research, Office of Basic Energy Sciences.
Anisotropic magnetic properties of the KMo4O6
NASA Astrophysics Data System (ADS)
Andrade, M.; Maffei, M. L.; Dos Santos, C. A. M.; Ferreira, B.; Sartori, A. F.
2012-02-01
Electrical resistivity measurements in the tetragonal KMo4O6 single crystals show a metal-insulator transition (MIT) near 100K. Magnetization measurements as a function of temperature show no evidence of magnetic ordering at this MIT [1]. Single crystals of KMo4O6 were obtained by electrolysis of a melt with a molar ratio of K2MoO4:MoO3 = 6:1. The process were carried out at 930 C with a current of 20-25mA for 52h in argon atmosphere. After that, electrodes were removed from the melt alloying the crystals to cool down to room temperature rapidly. Scanning Electron Microscopy (SEM) showed that the black single crystals were grown on the platinum cathode. Typical dimensions of the single crystals are 1x0.2x0.2mm^3. X-ray diffractometry confirmed that the single crystals have KMo4O6 tetragonal crystalline structure with space group P4. Magnetization measurements were performed parallel and perpendicular to the c-axis from 2 to 300K. The results show anisotropic behavior between both directions. Furthermore, the temperature independence of the magnetization at high temperature and the upturn at low temperature are observed in agreement with previous results [1]. MxH curves measured at several temperatures show nonlinear behavior and a small magnetic ordering. The magnetic ordering seems to be related to the MIT near 100K. This material is based upon support by FAPESP (2009/14524-6 and 2009/54001-6) and CNPq/NSF (490182/2009-7). M. Andrade is CAPES fellow and C.A.M. dos Santos is CNPq fellow. [4pt] [1] K. V. Ramanujachary et al., J. Sol. State Chem.102 (1993) 69.
Multimodel analysis of anisotropic diffusive tracer-gas transport in a deep arid unsaturated zone
NASA Astrophysics Data System (ADS)
Green, Christopher T.; Walvoord, Michelle A.; Andraski, Brian J.; Striegl, Robert G.; Stonestrom, David A.
2015-08-01
Gas transport in the unsaturated zone affects contaminant flux and remediation, interpretation of groundwater travel times from atmospheric tracers, and mass budgets of environmentally important gases. Although unsaturated zone transport of gases is commonly treated as dominated by diffusion, the characteristics of transport in deep layered sediments remain uncertain. In this study, we use a multimodel approach to analyze results of a gas-tracer (SF6) test to clarify characteristics of gas transport in deep unsaturated alluvium. Thirty-five separate models with distinct diffusivity structures were calibrated to the tracer-test data and were compared on the basis of Akaike Information Criteria estimates of posterior model probability. Models included analytical and numerical solutions. Analytical models provided estimates of bulk-scale apparent diffusivities at the scale of tens of meters. Numerical models provided information on local-scale diffusivities and feasible lithological features producing the observed tracer breakthrough curves. The combined approaches indicate significant anisotropy of bulk-scale diffusivity, likely associated with high-diffusivity layers. Both approaches indicated that diffusivities in some intervals were greater than expected from standard models relating porosity to diffusivity. High apparent diffusivities and anisotropic diffusivity structures were consistent with previous observations at the study site of rapid lateral transport and limited vertical spreading of gas-phase contaminants. Additional processes such as advective oscillations may be involved. These results indicate that gases in deep, layered unsaturated zone sediments can spread laterally more quickly, and produce higher peak concentrations, than predicted by homogeneous, isotropic diffusion models.
Multimodel analysis of anisotropic diffusive tracer-gas transport in a deep arid unsaturated zone
Green, Christopher T.; Walvoord, Michelle Ann; Andraski, Brian J.; Striegl, Rob; Stonestrom, David A.
2015-01-01
Gas transport in the unsaturated zone affects contaminant flux and remediation, interpretation of groundwater travel times from atmospheric tracers, and mass budgets of environmentally important gases. Although unsaturated zone transport of gases is commonly treated as dominated by diffusion, the characteristics of transport in deep layered sediments remain uncertain. In this study, we use a multimodel approach to analyze results of a gas-tracer (SF6) test to clarify characteristics of gas transport in deep unsaturated alluvium. Thirty-five separate models with distinct diffusivity structures were calibrated to the tracer-test data and were compared on the basis of Akaike Information Criteria estimates of posterior model probability. Models included analytical and numerical solutions. Analytical models provided estimates of bulk-scale apparent diffusivities at the scale of tens of meters. Numerical models provided information on local-scale diffusivities and feasible lithological features producing the observed tracer breakthrough curves. The combined approaches indicate significant anisotropy of bulk-scale diffusivity, likely associated with high-diffusivity layers. Both approaches indicated that diffusivities in some intervals were greater than expected from standard models relating porosity to diffusivity. High apparent diffusivities and anisotropic diffusivity structures were consistent with previous observations at the study site of rapid lateral transport and limited vertical spreading of gas-phase contaminants. Additional processes such as advective oscillations may be involved. These results indicate that gases in deep, layered unsaturated zone sediments can spread laterally more quickly, and produce higher peak concentrations, than predicted by homogeneous, isotropic diffusion models.
Qian Chen
2008-08-18
The generation, motion, and interaction of dislocations play key roles during the plastic deformation process of crystalline solids. 3D Dislocation Dynamics has been employed as a mesoscale simulation algorithm to investigate the collective and cooperative behavior of dislocations. Most current research on 3D Dislocation Dynamics is based on the solutions available in the framework of classical isotropic elasticity. However, due to some degree of elastic anisotropy in almost all crystalline solids, it is very necessary to extend 3D Dislocation Dynamics into anisotropic elasticity. In this study, first, the details of efficient and accurate incorporation of the fully anisotropic elasticity into 3D discrete Dislocation Dynamics by numerically evaluating the derivatives of Green's functions are described. Then the intrinsic properties of perfect dislocations, including their stability, their core properties and disassociation characteristics, in newly discovered rare earth-based intermetallics and in conventional intermetallics are investigated, within the framework of fully anisotropic elasticity supplemented with the atomistic information obtained from the ab initio calculations. Moreover, the evolution and interaction of dislocations in these intermetallics as well as the role of solute segregation are presented by utilizing fully anisotropic 3D dislocation dynamics. The results from this work clearly indicate the role and the importance of elastic anisotropy on the evolution of dislocation microstructures, the overall ductility and the hardening behavior in these systems.
Computing Thermodynamic And Transport Properties
NASA Technical Reports Server (NTRS)
Mcbride, B.; Gordon, Sanford
1993-01-01
CET89 calculates compositions in chemical equilibrium and properties of mixtures of any chemical system for which thermodynamic data available. Provides following options: obtains chemical-equilibrium compositions and corresponding thermodynamic mixture properties for assigned thermodynamic states; calculates dilute-gas transport properties of complex chemical mixtures; obtains Chapman-Jouguet detonation properties for gaseous mixtures; calculates properties of incident and reflected shocks in terms of assigned velocities; and calculates theoretical performance of rocket for both equilibrium and frozen compositions during expansion. Rocket performance based on optional models of finite or infinite area combustor.
NASA Astrophysics Data System (ADS)
Chacon, Luis; Del-Castillo-Negrete, Diego; Hauck, Cory
2012-10-01
Modeling electron transport in magnetized plasmas is extremely challenging due to the extreme anisotropy between parallel (to the magnetic field) and perpendicular directions (χ/χ˜10^10 in fusion plasmas). Recently, a Lagrangian Green's function approach, developed for the purely parallel transport case,footnotetextD. del-Castillo-Negrete, L. Chac'on, PRL, 106, 195004 (2011)^,footnotetextD. del-Castillo-Negrete, L. Chac'on, Phys. Plasmas, 19, 056112 (2012) has been extended to the anisotropic transport case in the tokamak-ordering limit with constant density.footnotetextL. Chac'on, D. del-Castillo-Negrete, C. Hauck, JCP, submitted (2012) An operator-split algorithm is proposed that allows one to treat Eulerian and Lagrangian components separately. The approach is shown to feature bounded numerical errors for arbitrary χ/χ ratios, which renders it asymptotic-preserving. In this poster, we will present the generalization of the Lagrangian approach to arbitrary magnetic fields. We will demonstrate the potential of the approach with various challenging configurations, including the case of transport across a magnetic island in cylindrical geometry.
Transport properties of uranium dioxide
Fink, J.K.; Chasanov, M.G.; Leibowitz, L.
1981-04-01
In order to provide reliable and consistent data on the thermophysical properties of reactor materials for reactor safety studies, this revision is prepared for the transport properties of the uranium dioxide portion of the fuel property section of the report Properties for LMFBR Safety Analysis. Since the original report was issued in 1976, measurements of thermal diffusivity and emissivity have been made. In addition to incorporating this new data, new equations have been derived to fit the thermal diffusivity and thermal conductivity data. This analysis is consistent with the analysis of enthalpy and heat capacity. A new form of equation for the emissivity is also given. The present report comprises the transport part of the UO/sub 2/ portion of section A of the planned complete revision of Properties for LMFBR Safety Analysis.
Picosecond Acoustic Measurement of Anisotropic Properties of Thin Films
Perton, M.; Rossignol, C.; Chigarev, N.; Audoin, B.
2007-03-21
Properties of thin metallic films have been studied extensively by means of laser-picosecond ultrasonics. Generation of longitudinal and shear waves via thermoelastic mechanism and large source has been only demonstrated for waves vectors along the normal to the interface. However, such measurements cannot provide complete information about elastic properties of films. As it has been already shown for nanosecond ultrasonics, the knowledge of group or phase velocities in several directions for sources with small lateral size allows determining the stiffness tensor coefficients of a sample. The experimental set-up was prepared to obtain the thinnest size for the source to achieve acoustic diffraction. The identification of the stiffness tensor components, based on the inversion of the bulk waves phase velocities, is applied to signals simulated and experimentally recorded for a material with hexagonal properties. First estimation of stiffness tensor coefficients for thin metallic film 2.1 {mu}m has been performed.
Anisotropic properties of human cortical bone with osteogenesis imperfecta.
Katti, Kalpana S; Gu, Chunju; Katti, Dinesh R
2016-02-01
The heterogeneity of bone shape and size variation is modulated by genetic, mechanical, nutritional, and hormonal patterning throughout its lifetime. Microstructural changes across cross sections are a result of mechanistic optimization that results over the years of evolution while being based on universal, time-invariant ingredients and patterns. Here we report changes across anatomical sections of bone with osteogenesis imperfecta (OI) that undermines the work of evolution through genetic mutation. This work examines the microstructure and molecular composition of different anatomical positions (anterior, medial, posterior, and lateral regions) in the diaphysis of an OI human tibia. The study shows that although there is no significant microstructural difference, molecular changes are observed using FTIR revealing differences in molecular composition of the four anatomical positions. In addition, the nanomechanical properties of anterior section of OI bone seem more heterogeneous. The nanomechanical properties of interstitial lamellae in all these bone samples are consistently greater than those of osteonal lamellae. The nanomechanical properties of bone depend on its anatomical section and on the measurement direction as well. Variations in molecular structure with anatomical positions and also corresponding differences in nanomechanical properties are reported. These are compared to those observed typically in healthy bone illustrating the unique influence of OI on bone multiscale behavior which results from an evolutionary process lasting for many years. PMID:26399513
Spin transport in the frustrated anisotropic two-dimensional ferromagnet in the square lattice
NASA Astrophysics Data System (ADS)
Lima, L. S.
2016-08-01
We use the SU(3) Schwinger boson formalism together with the Kubo theory of the linear response to study the spin transport in the two-dimensional S=1 frustrated anisotropic Heisenberg ferromagnet in a square lattice with easy-plane single-ion anisotropy and considering the second-neighbor interaction in the diagonal and the third-neighbor interaction (J1-J2-J3 model). The AC spin conductivity σreg(ω) is determined for several values of the critical single-ion parameter D, and the frustration parameters J2 and J3. We have calculated the dynamic structure factor too, S(q → , ω), for this model and obtained a behaviour exponentially decreasing for the damping Γq with the decreasing of q = | q → | towards q → 0.
Nonlinear and Anisotropic Tensile Properties of Graft Materials used in Soft Tissue Applications
Yoder, Jonathon H; Elliott, Dawn M
2010-01-01
Background The mechanical properties of extracellular matrix grafts that are intended to augment or replace soft tissues should be comparable to the native tissue. Such grafts are often used in fiber-reinforced tissue applications that undergo multi-axial loading and therefore knowledge of the anisotropic and nonlinear properties are needed, including the moduli and Poisson's ratio in two orthogonal directions within the plane of the graft. The objective of this study was to measure the tensile mechanical properties of several marketed grafts: Alloderm, Restore, CuffPatch, and OrthADAPT. Methods The degree of anisotropy and nonlinearity within each graft was evaluated from uniaxial tensile tests and compared to their native tissue. Results The Alloderm graft was anisotropic in both the toe and linear-region of the stress-strain response, was highly nonlinear, and generally had low properties. The Restore and CuffPatch grafts had similar stress-strain responses, were largely isotropic, had a linear-region modulus of 18 MPa, and were nonlinear. OrthADAPT was anisotropic in the linear region (131 vs 47 MPa) and was highly nonlinear. The Poisson ratio for all grafts was between 0.4 and 0.7, except for the parallel orientation of Restore which was greater than 1.0. Interpretation Having an informed understanding of how the available grafts perform mechanically will allow for better assessment by the physician for which graft to apply depending upon its application. PMID:20129728
Transport properties in the atmosphere of Jupiter
NASA Technical Reports Server (NTRS)
Biolsi, L., Jr.
1979-01-01
The computer program used to obtain transport properties for the Hulburt-Hirschfelder potential was tested. Transport properties for the C-C interaction were calculated. Rough estimates for transport properties for the important ablation species were obtained as well as estimates of transport properties for some of the species associated with photochemical smog. The results are discussed.
Blow-up properties in the parabolic problems with anisotropic nonstandard growth conditions
NASA Astrophysics Data System (ADS)
Liu, Bingchen; Yang, Jie
2016-03-01
In this paper, we study the parabolic problems with anisotropic nonstandard growth nonlinearities. We first give the existence and uniqueness of weak solutions in variable Sobolev spaces. Second, we use the energy methods to show the existence of blow-up solutions with negative or positive initial energy, respectively. Both the variable exponents and the coefficients make important roles in Fujita blow-up phenomena. Moreover, asymptotic properties of the blow-up solutions are determined.
Interventional nerve visualization via the intrinsic anisotropic optical properties of the nerves
NASA Astrophysics Data System (ADS)
Chin, Kenneth W.; Meijerink, Andries; Chin, Patrick T. K.
2015-07-01
We present an optical concept to visualize nerves during surgical interventions. The concept relies on the anisotropic optical properties of the nerves which allows for specific switching of the optical reflection by the nervous tissue. Using a low magnification polarized imaging system we are able to visualize the on and off switching of the optical reflection of the nervous tissue, enabling a non-invasive nerve specific real-time nerve visualization during surgery.
Phonon heat conduction in layered anisotropic crystals
NASA Astrophysics Data System (ADS)
Minnich, A. J.
2015-02-01
The thermal properties of anisotropic crystals are of both fundamental and practical interest, but transport phenomena in anisotropic materials such as graphite remain poorly understood because solutions of the Boltzmann equation often assume isotropy. Here, we extend an analytic solution of the transient, frequency-dependent Boltzmann equation to highly anisotropic solids and examine its predictions for graphite. We show that this simple model predicts key results, such as long c -axis phonon mean free paths and a negative correlation of cross-plane thermal conductivity with in-plane group velocity, that were previously observed with computationally expensive molecular-dynamics simulations. Further, using our analytic solution, we demonstrate a method to reconstruct the anisotropic mean free path spectrum of crystals with arbitrary dispersion relations without any prior knowledge of their harmonic or anharmonic properties using observations of quasiballistic heat conduction. These results provide a useful analytic framework to understand thermal transport in anisotropic crystals.
Anisotropic mechanical properties of a polymer nematic liquid crystal
NASA Astrophysics Data System (ADS)
Taratuta, Victor G.; Lonberg, Franklin; Meyer, Robert B.
1988-03-01
A concentration dependence of elastic and viscous properties of nematic poly-γ-benzyl glutamate (PBG) was studied experimentally. The splay and bend constants are similar in magnitude, both linear in concentration. The twist constant is much smaller and constant. Viscosities exhibit large anisotropies. γ1 and ηc are roughly quadratic in concentration, ηa is linear, while ηb is constant. The data are self-consistently interpreted in terms of the theoretical models for nematics of semi flexible chains rather than those of rigid rods.
Analysis of anisotropic viscoelastoplastic properties of cortical bone tissues.
Abdel-Wahab, Adel A; Alam, Khurshid; Silberschmidt, Vadim V
2011-07-01
Bone fractures affect the health of many people and have a significant social and economic effect. Often, bones fracture due to impacts, sudden falls or trauma. In order to numerically model the fracture of a cortical bone tissue caused by an impact it is important to know parameters characterising its viscoelastoplastic behaviour. These parameters should be measured for various orientations in a bone tissue to assess bone's anisotropy linked to its microstructure. So, the first part of this study was focused on quantification of elastic-plastic behaviour of cortical bone using specimens cut along different directions with regard to the bone axis-longitudinal (axial) and transverse. Due to pronounced non-linearity of the elastic-plastic behaviour of the tissue, cyclic loading-unloading uniaxial tension tests were performed to obtain the magnitudes of elastic moduli not only from the initial loading part of the cycle but also from its unloading part. Additional tests were performed with different deformation rates to study the bone's strain-rate sensitivity. The second part of this study covered creep and relaxation properties of cortical bone for two directions and four different anatomical positions-anterior, posterior, medial and lateral-to study the variability of bone's properties. Since viscoelastoplasticity of cortical bone affects its damping properties due to energy dissipation, the Dynamic Mechanical Analysis (DMA) technique was used in the last part of our study to obtain magnitudes of storage and loss moduli for various frequencies. Based on analysis of elastic-plastic behaviour of the bovine cortical bone tissue, it was found that magnitudes of the longitudinal Young's modulus for four cortical positions were in the range of 15-24 GPa, while the transversal modulus was lower--between 10 and 15 GPa. Axial strength for various anatomical positions was also higher than transversal strength with significant differences in magnitudes for those positions
Modeling anisotropic properties of media with oriented fractures
NASA Astrophysics Data System (ADS)
Chergoleishvili, T. T.; Balabuyev, A. A.; Mandzhgaladze, P. F.
1984-05-01
Fracture formation at the focus of an impending earthquake occurs along a definite orientation governed by tectonic shears. The effectiveness of the many methods used in the theoretical computation of the elastic properties of such media was assessed in laboratory experiments using models with controllable parameters. The propagation velocity of longitudinal and transverse waves were investigated. Experimental results are compared with computations made by different methods. The curves corresponding to different theories quantitatively differ greatly from one another but there is a satisfactory correspondence of the shape of both the theoretical and experimental curves, revealing a uniformity of the dependence of wave propagation velocity on angle of approach to the oriented system of fractures. An attempt is made to resolve various discrepancies.
Perylenetetracarboxylic-metal assemblies and anisotropic charge transport in a CuII assembly
NASA Astrophysics Data System (ADS)
Bai, Linyi; Xia, Youyi; Jana, Avijit; Ang, Chung Yen; Zhao, Lingzhi; Fan, Zhi; Zhao, Yanli
2016-04-01
Structural diversity and uniformity of nanomaterials are usually prerequisites for many practical applications involving the oriented fabrication of various devices with full control over their desired physiochemical properties. Particularly in the optoelectronic field, ordered assembly inside cells is required not only for obtaining attractive configurations but also for playing an important role in the characteristics of photoconduction and conductivity. Here, we present a synergetic self-assembly driven by coordination and intermolecular interactions for the construction of organic-inorganic hybrids with multi-morphologies and tunable physical properties. 3,4,9,10-Perylenetetracarboxylic dianhydride was treated with base to produce various assemblies by coordination with metal ions, showing morphologies of nanowires, nanosheets, nanoribbons and nanorods. The organic π-spacer affords an extension in different directions through the suitable incorporation of metal ions with different coordination modes for the formation of metal-ligand complexes. Interestingly, the obtained nanorods were twisted rods with obvious screw threads on the rod wall, supporting the synergetic self-assembly. Then, anisotropic mobility measurements of the obtained Cu2+-ligand assembly were carried out to show the importance of the size- and shape-confined synthesis of the hybrids. By presenting a series of ordered metal-ligand complex superstructures driven by synergetic self-assembly, this work is expected to pave the way for future anisotropic measurements of complex assemblies.Structural diversity and uniformity of nanomaterials are usually prerequisites for many practical applications involving the oriented fabrication of various devices with full control over their desired physiochemical properties. Particularly in the optoelectronic field, ordered assembly inside cells is required not only for obtaining attractive configurations but also for playing an important role in the
Optical Properties of Anisotropic Polycrystalline Ce+3 activated LSO
Roy, Sudesna; Lingertat, Helmut; Brecher, Charles; Sarin, Vinod
2012-01-01
Polycrystalline cerium activated lutetium oxyorthosilicate (LSO:Ce) is highly desirable technique to make cost effective and highly reproducible radiation detectors for medical imaging. In this article methods to improve transparency in polycrystalline LSO:Ce were explored. Two commercially available powders of different particulate sizes (average particle size 30 and 1500 nm) were evaluated for producing dense LSO:Ce by pressure assisted densification routes, such as hot pressing and hot isostatic pressing. Consolidation of the powders at optimum conditions produced three polycrystalline ceramics with average grain sizes of 500 nm, 700 and 2000 nm. Microstructural evolution studies showed that for grain sizes larger than 1 µm, anisotropy in thermal expansion coefficient and elastic constants of LSO, resulted in residual stress at grain boundaries and triple points that led to intragranular microcracking. However, reducing the grain size below 1 µm effectively avoids microcracking, leading to more favorable optical properties. The optical scattering profiles generated by a Stover scatterometer, measured by a He-Ne laser of wavelength 633 nm, showed that by reducing the grain size from 2 µm to 500 nm, the in-line transmission increased by a factor of 103. Although these values were encouraging and showed that small changes in grain size could increase transmission by almost 3 orders of magnitude, even smaller grain sizes need to be achieved in order to get truly transparent material with high in-line transmission. PMID:23505329
A Numerical Model of Anisotropic Mass Transport Through Grain Boundary Networks
NASA Astrophysics Data System (ADS)
Wang, Yibo
Tin (Sn) thin films are commonly used in electronic circuit applications as coatings on contacts and solders for joining components. It is widely observed, for some such system, that whiskers---long, thin crystalline structures---emerge and grow from the film. The Sn whisker phenomenon has become a highly active research area since Sn whiskers have caused a large amount of damage and loss in manufacturing, military, medical and power industries. Though lead (Pb) addition to Sn has been used to solve this problem for over five decades, the adverse environmental and health effects of Pb have motivated legislation to severely constrain Pb use in society. People are researching and seeking the reasons which cause whiskers and corresponding methods to solve the problem. The contributing factors to cause a Sn whisker are potentially many and much still remains unknown. Better understanding of fundamental driving forces should point toward strategies to improve (a) the accuracy with which we can predict whisker formation, and (b) our ability to mitigate the phenomenon. This thesis summarizes recent important research achievements in understanding Sn whisker formation and growth, both experimentally and theoretically. Focus is then placed on examining the role that anisotropy in grain boundary diffusivity plays in determining whisker characteristics (specifically, whether they form and, if so, where on a surface). To study this aspect of the problem and to enable future studies on stress driven grain boundary diffusion, this thesis presents a numerical anisotropic mass transport model. In addition to presenting details of the model and implementation, model predictions for a set of increasingly complex grain boundary networks are discussed. Preliminary results from the model provide evidence that anisotropic grain boundary diffusion may be a primary driving mechanism in whisker formation.
Transport Properties for Combustion Modeling
Brown, N.J.; Bastein, L.; Price, P.N.
2010-02-19
This review examines current approximations and approaches that underlie the evaluation of transport properties for combustion modeling applications. Discussed in the review are: the intermolecular potential and its descriptive molecular parameters; various approaches to evaluating collision integrals; supporting data required for the evaluation of transport properties; commonly used computer programs for predicting transport properties; the quality of experimental measurements and their importance for validating or rejecting approximations to property estimation; the interpretation of corresponding states; combination rules that yield pair molecular potential parameters for unlike species from like species parameters; and mixture approximations. The insensitivity of transport properties to intermolecular forces is noted, especially the non-uniqueness of the supporting potential parameters. Viscosity experiments of pure substances and binary mixtures measured post 1970 are used to evaluate a number of approximations; the intermediate temperature range 1 < T* < 10, where T* is kT/{var_epsilon}, is emphasized since this is where rich data sets are available. When suitable potential parameters are used, errors in transport property predictions for pure substances and binary mixtures are less than 5 %, when they are calculated using the approaches of Kee et al.; Mason, Kestin, and Uribe; Paul and Warnatz; or Ern and Giovangigli. Recommendations stemming from the review include (1) revisiting the supporting data required by the various computational approaches, and updating the data sets with accurate potential parameters, dipole moments, and polarizabilities; (2) characterizing the range of parameter space over which the fit to experimental data is good, rather than the current practice of reporting only the parameter set that best fits the data; (3) looking for improved combining rules, since existing rules were found to under-predict the viscosity in most cases; (4
NASA Astrophysics Data System (ADS)
Link, Frederik; Rümpker, Georg; Kaviani, Ayoub; Singh, Manvendra
2016-04-01
The well-known H-κ-stacking method of Zhu and Kanamori (2000) has developed into a standard tool to infer the thickness of the crust, H, and the average P to S-wave velocity ratio, κ. The stacking approach allows for the largely automated analysis of teleseismic waveforms recorded in the distance range between 30° and 95° . Here, we present an extension of the method to include the inversion for anisotropic crustal properties. For a single anisotropic crustal layer, this involves the computation of delay times and amplitudes for 20 P-to-S converted phases and their crustal reverberations, instead of (up to) five phases in the isotropic case (Kaviani and Rümpker, 2015). The delay times and amplitudes exhibit a complex dependency on slowness and backazimuth. They can be calculated semi-analytically from the eigenvalues and eigenvectors of the system matrix, as defined by Woodhouse (1974). A comparison of the calculated delay times and amplitudes with those obtained by similar methods (Frederiksen and Bostock, 2000) shows a very good agreement between the results. In our approach, the crust exhibits hexagonal anisotropy with a horizontal symmetry axis, such that the anisotropic properties are defined by two parameters: the orientation of the symmetry axis w.r.t. North, φ, and the percentage of anisotropy, a. The inversion, thus, involves a grid search in a 4-dimensional parameter space (H, κ, φ, a) and the stacking of both radial and transverse receiver functions. Known input parameters are the average P-wave velocity of the crust, and the slowness vector (as given by the event-receiver configuration and a global 1D-velocity model). The computations are performed by the new software package AnStack which is based on MATLAB. Synthetic test show that the extended anisotropic stacking has advantages compared to the conventional H-κ stacking as it may allow for inversions at even higher noise levels. We further test for the effect of the azimuthal distribution of
Turbulent anomalous transport and anisotropic electron heating in a return current system
Lee, Kuang Wu; Buechner, Joerg
2011-02-15
Anisotropic electron heating due to self-generated electromagnetic turbulences is observed in collisionless return current plasmas. The corresponding energy conversion, electron heating, and associated anomalous momentum transport are investigated by means of a two-dimensional electromagnetic particle-in-cell simulation code. The return current model consists of two counterstreaming electron beams with different temperatures and a stationary ion background. First, a general multifluid dispersion analyzer is presented in a clear matrix form that allows to study electron streaming instabilities. The numerical simulation confirms the predicted electrostatic electron-electron acoustic instability. Generating electromagnetic waves, the system evolves into a nonlinear stage. As a result, the electron drifts are slowed down due to turbulence-induced anomalous momentum exchange. Localized electric and magnetic field fluctuations play major roles in the energy conversion. Perpendicular electron heating follows the growth of magnetic field perturbations and the slowing of the electron drifts. Parallel and perpendicular electron heating occurs at different time scales. It is shown that the longer lasting perpendicular electron heating is caused by preheated parallel electron flows. The deflection of the preheated parallel electron flows in the localized turbulences, which is essentially a two-dimensional effect, leads to perpendicular electron heating even after the saturation of parallel electron heating. We conclude that the self-generated magnetic turbulence dominates the anomalous transport process in the late stage of return current system evolution.
Anisotropic superconducting properties of nanowires at the LaAlO3/SrTiO3 (110) interface
NASA Astrophysics Data System (ADS)
Huang, Mengchen; Annadi, Anil; Gopinadhan, Kalon; Venkatesan, Thirumalai; Ariando, Ariando; Cheng, Guanglei; Irvin, Patrick; Levy, Jeremy
Quasi-1D nanowires are created using conductive AFM (c-AFM) lithography at the LaAlO3/SrTiO3 (110) interface along the (001) and (1 1 0) crystallographic directions. The superconducting properties of nanowires were investigated under transport measurements with respect to the crystallography and orbital hierarchy. We observe anisotropic superconductivity where the upper critical magnetic field along the (001) and (1 1 0) directions are markedly different with a superconducting dome that is shifted for the two orientations as a function of gate voltages. The superconducting dome shift can be explained by anisotropic band structures along the two different directions combined with the Lifshitz transition. We gratefully acknowledge support for this work from NSF DMR-1124131 and DMR-1104191 (JL), AFOSR FA9550-12-1-0057 and FA9550-12-1-0268 (JL), ONR N00014-15-1-2847 (JL), CRP Award NRF-CRP 8-2011-06 and 10-2012-02 (TV, A) and NUS FRC R-144-000-346-11 (TV. A).
Transport properties of ceramic composites
Starr, T.L.; Hablutzel, N.
1996-08-01
Instrumentation and procedures have been completed for measurement of gas permeability and mass diffusivity of fiber preforms and porous materials. Results are reported for composites reinforced with Nicalon fiber in cloth lay-up and 3-D weave and with Nextel fiber in multi-layer braid. Measured permeability values range from near 100 to less than 0.1 darcies. Mass diffusivity is reported as a structure factor relating the diffusion through the porous material to that in free space. This measure is independent of the diffusing species and depends only on the pore structure of the material. Measurements are compared to predictions of a node-bond model for gas transport. Model parameters adjusted to match measured transport properties relate to physical microstructure features of the different architectures. Combination of this transport model with the CVI process model offers a predictive method to evaluate the densification behavior of various fiber preforms.
Transport properties in the atmosphere of Jupiter
NASA Technical Reports Server (NTRS)
Biolsi, L., Jr.
1978-01-01
The calculation of transport properties near the surface of a probe entering the atmosphere of Jupiter is discussed for (1) transport properties in the pure Jovian atmosphere, (2) transport properties for collisions between monatomic carbon atoms, including the effect of excited electronic states, (3) transport properties at the boundaries for mixing of the pure Jovian atmosphere and the atmosphere due to the injection of gaseous ablation products, and (4) transport properties for interactions involving some of the molecular ablation products. The transport properties were calculated using the kinetic theory of gases. Transport collision integrals were calculated for only a limited set of empirical and semiempirical interaction potentials. Since the accuracy of the fit of these empirical potentials to the true potential usually determines the accuracy of the calculation of the transport properties, the various interaction potentials used in these calculations are discussed.
Landau levels and magneto-transport property of monolayer phosphorene
Zhou, X. Y.; Zhang, R.; Sun, J. P.; Zou, Y. L.; Zhang, D.; Lou, W. K.; Cheng, F.; Zhou, G. H.; Zhai, F.; Chang, Kai
2015-01-01
We investigate theoretically the Landau levels (LLs) and magneto-transport properties of phosphorene under a perpendicular magnetic field within the framework of the effective k·p Hamiltonian and tight-binding (TB) model. At low field regime, we find that the LLs linearly depend both on the LL index n and magnetic field B, which is similar with that of conventional semiconductor two-dimensional electron gas. The Landau splittings of conduction and valence band are different and the wavefunctions corresponding to the LLs are strongly anisotropic due to the different anisotropic effective masses. An analytical expression for the LLs in low energy regime is obtained via solving the decoupled Hamiltonian, which agrees well with the numerical calculations. At high magnetic regime, a self-similar Hofstadter butterfly (HB) spectrum is obtained by using the TB model. The HB spectrum is consistent with the LL fan calculated from the effective k·p theory in a wide regime of magnetic fields. We find the LLs of phosphorene nanoribbon depend strongly on the ribbon orientation due to the anisotropic hopping parameters. The Hall and the longitudinal conductances (resistances) clearly reveal the structure of LLs. PMID:26159856
NASA Astrophysics Data System (ADS)
Hallberg, Håkan; Zhu, Yaochan
2015-10-01
In the present study, mesoscale simulations of grain growth in UO2 are performed using a 2D level set representation of the polycrystal grain boundary network, employed in a finite element setting. Anisotropic grain boundary properties are considered by evaluating how grain boundary energy and mobility varies with local grain boundary character. This is achieved by considering different formulations of the anisotropy of grain boundary properties, for example in terms of coincidence site lattice (CSL) correspondence. Such modeling approaches allow tracing of the stability of a number of characteristic low-Σ boundaries in the material during grain growth. The present simulations indicate that anisotropic grain boundary properties have negligible influence on the grain growth rate. However, considering the evolution of grain boundary character distribution and the grain size distribution, it is found that neglecting anisotropic boundary properties will strongly bias predictions obtained from numerical simulations.
Filippov, V. V.; Bormontov, E. N.
2013-07-15
A macroscopic model of the Hall effects and magnetoresistance in anisotropic semiconductor wafers is developed. The results obtained by solving the electrodynamic boundary problem allow the potential and eddy currents in anisotropic semiconductors to be calculated at different current-contact locations, depending on the parameters of the sample material's anisotropy. The results of this study are of great practical importance for investigating the physical properties of anisotropic semiconductors and simulating the electron-transport phenomena in devices based on anisotropic semiconductors.
NASA Astrophysics Data System (ADS)
Krook, Nadia; Meth, Jeffrey; Murray, Christopher; Riggleman, Robert; Composto, Russell
During common processing methods, anisotropic fillers in polymer nanocomposites align in the direction of flow, parallel to the surfaces, thus enhancing properties in the plane of the substrate. This research aims to create thin film nanocomposites with perpendicularly aligned anisotropic particles to improve properties in the out-of-plane direction. The demonstrated work explores vertical orientation of rare-earth fluoride nanoplates in lamellar-forming poly(styrene- b-methyl methacrylate) to establish a platform that controls the alignment of any planar particle. Currently, gadolinium fluoride (GdF3) rhombus nanoplates with the longest and shortest diagonal dimensions of ~30 nm and ~25 nm, respectively, have been specially synthesized with the potential to intercalate the block copolymer (BCP) domains. By employing a ternary brush blend layer to neutralize silicon substrates to both BCP domains, vertical lamellae orientation has been enabled with an optimum film thickness of ~110 nm. The GdF3 surfaces are chemically modified to drive the plates to a specific BCP domain. After surface modification, the dispersion of GdF3 in homopolymer will first be shown followed by morphology results from integrating GdF3 into the BCP using scanning and transmission electron microscopy.
Telschow, Kenneth Louis; Deason, Vance Albert
2002-12-01
An important material property in the paper industry is the anisotropic stiffness distribution due to the fibrous microstructure of paper and to processing procedures. Ultrasonic methods offer a means of determining the stiffness of sheets of paper from the anisotropic propagation characteristics of elastic Lamb waves along the machine direction and the cross direction. That is, along and perpendicular to the direction of paper production. Currently, piezoelectric ultrasonic methods are employed in the industry to measure the elastic polar diagram of paper through multiple contacting measurements made in all directions. This paper describes a new approach utilizing the INEEL Laser Ultrasonic Camera to provide a complete image of the elastic waves traveling in all directions in the plane of the paper sheet. This approach is based on optical dynamic holographic methods that record the out of plane ultrasonic motion over the entire paper surface simultaneously without scanning. The full-field imaging technique offers great potential for increasing the speed of the measurement and it ultimately provides a substantial amount of information concerning local property variations and flaws in the paper. This report shows the success of the method and the manner in which it yields the elastic polar diagram for the paper from the dispersive flexural or antisymmetric Lamb wave.
Anisotropic mechanical properties of hexagonal SiC sheet: a molecular dynamics study
NASA Astrophysics Data System (ADS)
Yu, Ming; Liu, Emily; Zhang, Congyan
2015-03-01
The anisotropic mechanical properties of hexagonal SiC sheet have been studied using an efficient quantum mechanics molecular dynamics scheme based on a robust semi-empirical Hamiltonian (refereed as SCED-LCAO) [PRB 74, 15540; PHYSE 42, 1]. It was found that the SiC sheet could sustain the heavy load up to about 20 %. In particular, it was found that the SiC sheet also shows large difference in the strain direction. It will quickly crack after 20 % of strain in armchair the direction, but it will be slowly destroyed after 30% in the zigzag direction, indicating the anisotropic nature of the mechanical properties of the SiC sheet. The nominal and 2D membrane stresses will be analyzed, from where we will obtain the 2D Young's modulus at infinitesimal strain and the third-order (effective nonlinear) elastic modulus for the SiC sheet. The detail results and discussions will be reported in the presentation.
Anisotropic optical properties of YBa sub 2 Cu sub 3 O sub 7
Nee, T. )
1992-06-15
Based upon the published results of YBa{sub 2}Cu{sub 3}O{sub 7} single-crystal reflectance spectra measured at room temperature, the empirical anisotropic spectral density functions and quasidielectric functions {epsilon}{sub 1{ital j}}+{ital i}{epsilon}{sub 2{ital j}} ({ital j}={ital a},{ital b},{ital c}) are determined in the 0.05 to 6 eV spectral range. These functions are an excellent fit to the reflectance spectra of samples in single-crystal, twin-crystal, and polycrystalline forms; they agree well with the published anisotropic transport and ellipsometry data. For polarizations along the {ital a} and {ital b} axes, the numerically determined empirical spectral density functions have shown two interband absorption peaks at 2.5 and 5 eV. For energy above 3 eV, the spectral density functions do not agree with the published theoretical interband conductivities that are derived from the band structure calculations.
NASA Astrophysics Data System (ADS)
Wu, Ruikang; Hu, Run; Luo, Xiaobing
2016-04-01
In this study, we developed a first-principle-based full-dispersion Monte Carlo simulation method to study the anisotropic phonon transport in wurtzite GaN thin film. The input data of thermal properties in MC simulations were calculated based on the first-principle method. The anisotropy of thermal conductivity in bulk wurtzite GaN is found to be strengthened by isotopic scatterings and reduced temperature, and the anisotropy reaches 40.08% for natural bulk GaN at 100 K. With the GaN thin film thickness decreasing, the anisotropy of the out-of-plane thermal conductivity is heavily reduced due to both the ballistic transport and the less importance of the low-frequency phonons with anisotropic group velocities. On the contrary, it is observed that the in-plane thermal conductivity anisotropy of the GaN thin film is strengthened by reducing the film thickness. And the anisotropy reaches 35.63% when the natural GaN thin film thickness reduces to 50 nm at 300 K with the degree of specularity being zero. The anisotropy is also improved by increasing the surface roughness of the GaN thin film.
NASA Astrophysics Data System (ADS)
Lima, L. S.
2016-08-01
We study the influence of the site disorder in the long range order and in the spin transport in the two-dimensional Heisenberg antiferromagnet with ion-single anisotropy, in the square lattice in T=0 using the SU(3) Schwinger boson theory. We analyze these properties in the regime of Bose-Einstein condensation, where the bosons tz are condensed:
NASA Astrophysics Data System (ADS)
Kuznetsov, Vladimir; Dzhalilov, Namig
As confirmed by observations, the temperature anisotropy relative to the magnetic field and the thermal fluxes are typical characteristics of the collisionless and magnetized plasma of the solar corona and solar wind. The properties of such plasma are described in terms of the anisotropic magnetohydrodynamics based on the kinetic equation under the 16-moment approximation. MHD waves and instabilities in the collisionless solar plasma have been analyzed under the aforementioned approximation taking into account the anisotropy of the plasma pressure along and across the magnetic field and the thermal flux along the field. It is established that the thermal flux results in the asymmetry of phase velocities of the compressible wave modes with respect to the outer magnetic field, in a strong interaction between the modes (particularly, between the retrograde modes propagating against the magnetic field), and in oscillatory in-stability of these modes. The thresholds of the mirror and fire-hose instabilities coincide with their kinetic expressions; the increments coincide qualitatively. At a certain propagation angle, the resonance interaction of three retrograde modes (fast sound, slow magnetosound, and slow sound ones) under the occurrence conditions of the classical aperiodic fire-hose instability gives rise to the oscillatory "fire-hose" instability of compressible modes, whose maximum increment may exceed the maximum increment of the classical fire-hose instability. A good agreement of the results obtained in terms of anisotropic MHD with the low-frequency limit of the kinetic description allows us to consider the applied approximation adequate for the description of large-scale dynamics of collisionless anisotropic solar plasma and to use it in the study of waves and instabilities in magnetic tubes and other magnetic features in the solar corona, magnetic reconnection, etc.
Anisotropic thermal transport in Weyl semimetal TaAs: a first principles calculation.
Ouyang, Tao; Xiao, Huaping; Tang, Chao; Hu, Ming; Zhong, Jianxin
2016-06-22
A fundamental understanding of the phonon transport property is crucial to predict the thermal management performance in micro/nano-electronic devices. By combining first principle calculations and Boltzmann phonon transport equation, we investigate thermal transport in TaAs-a typical Weyl semimetal. The lattice thermal conductivity of TaAs at room temperature was found to be 39.26 W mK(-1) and 24.78 W mK(-1) along the a(b) and c crystal axis, respectively, showing obvious anisotropy. Detailed analyses of the mode level phonon properties further revealed that the three acoustic phonon modes dominate the overall thermal transport and the major phonon scattering channels in this typical Weyl semimetal were TA1/TA2/LA + O ↔ O and A + A ↔ O. The representative phonon mean free path of TaAs was also calculated in this paper, which provide helpful guidance for the thermal management of TaAs-based electronic devices. PMID:27271203
NASA Astrophysics Data System (ADS)
Lu, Wanglin; Ma, Xiaomeng; Fei, Zhen; Zhou, Jianguang; Zhang, Zhiyong; Jin, Chuanhong; Zhang, Ze
2015-07-01
In this study, we correlated the angular dependence of the Raman response of black phosphorus to its crystallographic orientation by using transmission electron microscopy and Raman spectroscopy. It was found that the intensity of the Ag 2 mode reached a maximum when the polarization direction of the incident light was parallel to the zigzag crystallographic orientation. Notably, it was further confirmed that the zigzag crystallographic direction exhibited superior conductance and carrier mobility. Because of the lattice extension along the armchair direction, an intensification of the anisotropic Raman response was observed. This work provides direct evidence of the correlation between anisotropic properties and crystallographic direction and represents a turning point in the discussion of the angular-dependent electronic properties of black phosphorus.
Tan, Yang; Shyam, Amit; Choi, Wanhuk Brian; Lara-Curzio, Edgar; Sampath, Sanjay
2010-01-01
The determination of elastic properties of plasma-sprayed ceramic and metallic coatings is difficult due to their complex microstructure, which involves a myriad array of pores, interfaces and other defects. Furthermore, the splat-based build-up of the coating results in transverse anisotropy in the elastic properties. In this paper, we report on the anisotropic elastic properties of these coatings determined by resonant ultrasound spectroscopy (RUS). This approach along with the analysis presented enables, for the first time, the determination of elastic properties as a function of direction and temperature for these complex systems with concomitant implications for design. The coating systems investigated included plasma-sprayed yttria-stabilized zirconia (YSZ) and nickel. An additional nickel coating deposited by high-velocity oxygen-fuel process was investigated and its elastic properties were compared to those of plasma-sprayed nickel. Average Young s moduli of the coatings were independently measured by using the instrumented indentation method. The elastic properties determined from the RUS and indentation methodologies allowed description of the microstructure elastic property relationships in the coatings.
Anisotropic Mechanical and Giant Magneto-Impedance Properties of Cobalt-Rich Amorphous Ribbons
NASA Astrophysics Data System (ADS)
Tran, H. T.; Devkota, J.; Eggers, T.; Wingo, J.; Cai, W.; Skorvanek, I.; Srikanth, H.; Phan, M. H.
2016-04-01
A comparative study was performed on the mechanical and giant magneto-impedance (GMI) properties in the longitudinal and transverse directions of Co69Fe4Ni1Mo2B12Si12 amorphous ribbons. Both mechanical and GMI properties were found to be anisotropic. Kerr microscopy shows the presence of a stripe-type domain structure with the magnetic easy axis parallel to the longitudinal direction. The fracture strength, elastic modulus, and fracture toughness in the transverse direction was higher than those in the longitudinal direction. A larger GMI response was achieved in the transverse direction at a frequency range where both the domain wall motion and spin rotation dominantly contributed to the effective permeability and hence the magneto-impedance. The current study paves the way for designing Co-rich amorphous ribbons as desirable components in electronics such as magnetic sensors.
Dispersion properties of transverse anisotropic liquid crystal core photonic crystal fibers
NASA Astrophysics Data System (ADS)
Karasawa, Naoki
2016-04-01
The dispersion properties of liquid crystal core photonic crystal fibers for different core diameters have been calculated by a full vectorial finite difference method. In calculations, air holes are assumed to be arranged in a regular hexagonal array in fused silica and a central hole is filled with liquid crystal to create a core. In this study, three types of transverse anisotropic configurations, where liquid crystal molecules are oriented in a transverse plane, and a planar configuration, where liquid crystal molecules are oriented in a propagation direction, are considered. The large changes of the dispersion properties are found when the orientation of the liquid crystal molecules is changed from a planar configuration to a uniform configuration, where all molecules are oriented in the same direction in a transverse plane. Since the orientation of liquid crystal molecules may be controlled by applying an electric field, it could be utilized for various applications including the spectral control of supercontinuum generation.
Abbasi, Mostafa; Barakat, Mohammed S; Vahidkhah, Koohyar; Azadani, Ali N
2016-09-01
Computational modeling has an important role in design and assessment of medical devices. In computational simulations, considering accurate constitutive models is of the utmost importance to capture mechanical response of soft tissue and biomedical materials under physiological loading conditions. Lack of comprehensive three-dimensional constitutive models for soft tissue limits the effectiveness of computational modeling in research and development of medical devices. The aim of this study was to use inverse finite element (FE) analysis to determine three-dimensional mechanical properties of bovine pericardial leaflets of a surgical bioprosthesis under dynamic loading condition. Using inverse parameter estimation, 3D anisotropic Fung model parameters were estimated for the leaflets. The FE simulations were validated using experimental in-vitro measurements, and the impact of different constitutive material models was investigated on leaflet stress distribution. The results of this study showed that the anisotropic Fung model accurately simulated the leaflet deformation and coaptation during valve opening and closing. During systole, the peak stress reached to 3.17MPa at the leaflet boundary while during diastole high stress regions were primarily observed in the commissures with the peak stress of 1.17MPa. In addition, the Rayleigh damping coefficient that was introduced to FE simulations to simulate viscous damping effects of surrounding fluid was determined. PMID:27173827
Study of the Anisotropic Properties of Argillite Under Moisture and Mechanical Loads
NASA Astrophysics Data System (ADS)
Yang, Diansen; Chanchole, Serge; Valli, Pierre; Chen, Liufeng
2013-03-01
Due to various factors, such as sedimentation, layered morphology of clay minerals, in situ stress, etc., argillite rocks often exhibit anisotropic behavior. In order to study the anisotropic properties of the Callovo-Oxfordian (COx) argillite of the Meuse-Haute-Marne site in France considered as a possible host rock for high-level radioactive nuclear waste repository, a series of tests including uniaxial compression and dehydration and hydration at different constant applied stress levels are carried out. In this study, a specific setup combining moisture and mechanical loading with optical observation is used and it allows to continuously capture surface images from which the full-field strains are determined by using Digital Image Correlation techniques. The results show evidence of the mechanical and hydric anisotropy of the material. The anisotropy parameters are identified, assuming the studied argillite as transversely isotropic. The shrinkage and swelling depend on the applied stress and the angle with respect to the vertical direction of the mechanical load and the stratification plane, and this dependence is quantified. The non-linearity and the hysteresis observed during dehydration and hydration cycles are discussed.
Transport properties of ceramic composites
Starr, T.L.
1995-08-01
This project involves experimental and modeling investigation of the transport properties of chemical vapor infiltration (CVI) preforms and densified composites, with particular emphasis on gas permeability and mass diffusivity. The results of this work will be useful both for on-going CVI process development and for evaluation and optimization of composite materials for fossil energy applications. With preforms made with 500 filaments/tow Nicalon at 40 vol% fiber loading, permeability values are similar for square-weave cloth layup and 3-D weave at low density. At greater densification the 3-D weave permeability is lower and approaches zero with significantly more closed porosity than the cloth layup. For filament wound preforms we were unable to make reliable measurements with the available materials. A model for gas transport in these materials utilizes percolation theory concepts. The ultimate achievable density is related to the closing of a continuous gas path through the preform. As the density approaches this limit the gas permeability and diffusivity vanish exponentially. The value of this limit is controlled primarily by the preform fiber architecture. The observed difference between the cloth layup and 3-D weave materials is due to the larger pores at tow crossing points found in the 3-D weave.
NASA Astrophysics Data System (ADS)
Ganapol, B. D.; Mostacci, D.; Previti, A.
2016-07-01
We present highly accurate solutions to the neutral particle transport equation in a half-space. While our initial motivation was in response to a recently published solution based on Chandrasekhar's H-function, the presentation to follow has taken on a more comprehensive tone. The solution by H-functions certainly did achieved high accuracy but was limited to isotropic scattering and emission from spatially uniform and linear sources. Moreover, the overly complicated nature of the H-function approach strongly suggests that its extension to anisotropic scattering and general sources is not at all practical. For this reason, an all encompassing theory for the determination of highly precise benchmarks, including anisotropic scattering for a variety of spatial source distributions, is presented for particle transport in a half-space. We illustrate the approach via a collection of cases including tables of 7-place flux benchmarks to guide transport methods developers. The solution presented can be applied to a considerable number of one and two half-space transport problems with variable sources and represents a state-of-the-art benchmark solution.
Cheng, Mingjian; Guo, Lixin; Li, Jiangting; Huang, Qingqing
2016-08-01
Rytov theory was employed to establish the transmission model for the optical vortices carried by Bessel-Gaussian (BG) beams in weak anisotropic turbulence based on the generalized anisotropic von Karman spectrum. The influences of asymmetry anisotropic turbulence eddies and source parameters on the signal orbital angular momentum (OAM) mode detection probability of partially coherent BG beams in anisotropic turbulence were discussed. Anisotropic characteristics of the turbulence could enhance the OAM mode transmission performance. The spatial partially coherence of the beam source would increase turbulent aberration's effect on the optical vortices. BG beams could dampen the influences of the turbulence because of their nondiffraction and self-healing characteristics. PMID:27505641
NASA Astrophysics Data System (ADS)
Hoffmeister, Brentley Keith
1995-01-01
This thesis seeks to contribute to a better understanding of the physics of interaction of ultrasonic waves with inhomogeneous and anisotropic media, one example of which is the human heart. The clinical success of echocardiography has generated a considerable interest in the development of ultrasonic techniques to measure the elastic properties of heart tissue. It is hypothesized that the elastic properties of myocardium are influenced by the interstitial content and organization of collagen. Collagen, which is the main component of tendon, interconnects the muscle cells of the heart to form locally unidirectional myofibers. This thesis therefore employs ultrasonic techniques to characterize the linear elastic properties of both heart and tendon. The linear elastic properties of tissues possessing a unidirectional arrangement of fibers may be described in terms of five independent elastic stiffness coefficients. Three of these coefficients were determined for formalin fixed specimens of bovine Achilles tendon and human myocardium by measuring the velocity of longitudinal mode ultrasonic pulses as a function of angle of propagation relative to the fiber axis of the tissue. The remaining two coefficients were determined by measuring the velocity of transverse mode ultrasonic waves through these tissues. To overcome technical difficulties associated with the extremely high attenuation of transverse mode waves at low megahertz frequencies, a novel measurement system was developed based on the sampled continuous wave technique. Results of these measurements were used to assess the influence of interstitial collagen, and to model the mechanical properties of heart wall.
Anisotropic mechanical properties of zircon and the effect of radiation damage
Beirau, Tobias; Nix, William D.; Bismayer, Ulrich; Boatner, Lynn A.; Isaacson, Scott G.; Ewing, Rodney C.
2016-06-02
Our study provides new insights into the relationship between radiation-dose-dependent structural damage, due to natural U and Th impurities, and the anisotropic mechanical properties (Poisson s ratio, elastic modulus and hardness) of zircon. Natural zircon samples from Sri Lanka (see Muarakami et al. 1991) and synthetic samples, covering a dose range of zero up to 6.8 x 1018 -decays/g, have been studied by nanoindentation. Measurements along the [100] crystallographic direction and calculations, based on elastic stiffness constants determined by zkan (1976), revealed a general radiation-induced decrease in stiffness (~ 54 %) and hardness (~ 48 %) and an increase ofmore » the Poisson s ratio (~ 54 %) with increasing dose. Additional indentations on selected samples along the [001] allowed one to follow the amorphization process to the point that the mechanical properties are isotropic. This work shows that the radiation-dose-dependent changes of the mechanical properties of zircon can be directly correlated with the amorphous fraction as determined by previous investigations with local and global probes (Rios et al. 2000a; Farnan and Salje 2001; Zhang and Salje 2001). This agreement, revealed by the different methods, indicates a huge influence of structural and even local phenomena on the macroscopic mechanical properties.« less
Naff, R.L.
1998-01-01
The late-time macrodispersion coefficients are obtained for the case of flow in the presence of a small-scale deterministic transient in a three-dimensional anisotropic, heterogeneous medium. The transient is assumed to affect only the velocity component transverse to the mean flow direction and to take the form of a periodic function. For the case of a highly stratified medium, these late-time macrodispersion coefficients behave largely as the standard coefficients used in the transport equation. Only in the event that the medium is isotropic is it probable that significant deviations from the standard coefficients would occur.
Anisotropic Mechanical Properties of Ovine Femoral Periosteum and the Effects of Cryopreservation
McBride, Sarah H.; Evans, Sarah F.; Tate, Melissa L. Knothe
2013-01-01
The mechanical properties of periosteum are not well characterized. An understanding of these properties is critical to predict the environment of pluripotent and osteochondroprogenitor cells that reside within the periosteum and that have been shown recently to exhibit a remarkably rapid capacity to generate bone de novo. Furthermore, the effects of cryopreservation on periosteal mechanical properties are currently unknown. We hypothesized that the periosteum is pre-stressed in situ and that the periosteum exhibits anisotropic material properties, e.g. the elastic modulus of the periosteum depends significantly on the direction of loading. We measured the change in area, axial length, and circumferential length of anterior, posterior, medial, and lateral fresh periosteal samples removed from underlying bone (t = 0–16 hrs) as well as the average strain in axially and circumferentially oriented anterior periosteal samples subjected to tensile strain (0.004 mm/s) until failure. The elastic modulus was calculated from the resulting stress-strain curves. Tensile testing was repeated with axially aligned samples that had been slowly cryopreserved for comparison to fresh samples. Periosteal samples from all aspects immediate shrank 44–54%, 33–47%, and 9–19% in area, axial length, and circumferential length, respectively. At any given time, the periosteum shrank significantly more in the axial direction than the circumferential direction. Tensile testing showed that the periosteum is highly anisotropic. When loaded axially, a compliant toe region of the stress-strain curve (1.93±0.14 MPa) is followed by a stiffer region until failure (25.67±6.87 MPa). When loaded circumferentially, no toe region is observable and the periosteum remained compliant until failure (4.41±1.21 MPa). Cryopreservation had no significant effect on the elastic modulus of the periosteum. As the periosteum serves as the bounding envelope of the femur, anisotropy in periosteal properties
Kong, Tai; Bud'ko, Sergey L.; Canfield, Paul C.
2015-01-30
We present a detailed study of single crystalline K2Cr3As3 and analyze its thermodynamic and transport properties, anisotropic Hc2(T), and initial pressure dependence of Tc. In zero field, the temperature-dependent resistivity is metallic. Deviation from a linear temperature dependence is evident below 100 K and a T3 dependence is roughly followed from just above Tc (~10K) to ~40K. Anisotropic Hc2(T) data were measured up to 140 kOe with field applied along and perpendicular to the rodlike crystals. For the applied field perpendicular to the rod, Hc2(T) is linear with a slope ~–70 kOe/K. For field applied along the rod, the slopemore » is about –120 kOe/K below 70 kOe. Above 70 kOe, the magnitude of the slope decreases to ~–70 kOe/K. The electronic specific heat coefficient γ, just above Tc, is 73 mJ/mol K2; the Debye temperature ΘD is 220 K. As a result, the specific heat jump at the superconducting transition ΔC~2.2γTc. Finally, for hydrostatic pressures up to ~7 kbar, Tc decreases under pressure linearly at a rate of –0.034K/kbar.« less
NASA Astrophysics Data System (ADS)
Zhubayev, Alimzhan; Houben, Maartje; Smeulders, David; Barnhoorn, Auke
2014-05-01
The Posidonia Shale Formation (PSF) is one of the possible resource shales for unconventional gas in Northern Europe and currently is of great interest to hydrocarbon exploration and production. Due to low permeability of shales, economically viable production requires hydraulic fracturing of the reservoir. The design of hydrofractures requires an estimate of stress state within the reservoir and geomechanical properties such as Young's modulus and Poisson's ratio. Shales are often highly anisotropic and the models which neglect shale anisotropy may fail to predict the behaviour of hydrofractures. Seismic attenuation anisotropy, on the other hand, can play a key role in quantitative rock characterization. Where the attenuation anisotropy can potentially be linked to anisotropic permeability of shales, its fluid/gas saturation and preferred development of anisotropic fracture orientations. In this research, by utilizing the so-called Thomsen's notations, the elastic anisotropy of our (fractured and unfractured) shales has been investigated using a pulse transmission technique in the ultrasonic frequency range (0.3-1 MHz). Assuming transverse isotropy of the shales, and taking the axis x3 as the axis of rotational symmetry, directional Young's moduli and Poisson's ratios were obtained. The Young's modulus measured parallel to bedding (E1) is found to be larger than the Young's modulus measured orthogonal to bedding (E3). In case of the Poisson's ratios, we found that ν31 is larger than ν12, where νijrelates elastic strain in xj direction to stress applied in xi direction. Finally, attenuation anisotropy in dry and layer-parallel fractured Posidonia shale samples has been studied in the same frequency range. The attenuation of compressional (QP-1) and shear (QS-1) waves increases substantially with a macro (or wavelength) fracture introduction, especially for P and S waves propagating orthogonal to the bedding. In non-fractured and fractured dry shales, QP-1 is
Anisotropic superconducting properties of nanowires at the LaAlO3/SrTiO3 (110) interface
NASA Astrophysics Data System (ADS)
Irvin, Patrick; Huang, Mengcheng; Annadi, Anil; Cheng, Guanglei; Levy, Jeremy; Gopinadhan, Kalon; Venkatesan, Thirumalai; Ariando, Ariando
2015-03-01
The superconducting properties of nanowires created on anisotropic SrTiO3 (110) surfaces were investigated. Nanowires are created using conductive AFM (c-AFM) lithography at the LaAlO3/SrTiO3(110) interface along the (001) and (1 1 0) crystallographic directions. In these devices we observe anisotropic superconductivity. The upper critical magnetic field along the (001) and (1 1 0) directions are found to be markedly different with a superconducting dome that is shifted for the two orientations. These observations can be explained by anisotropic orbital binding of Ti and O atoms or the differences in the spin-orbit coupling along the two different directions. We gratefully acknowledge support for this work from NSF (DMR-1124131, DMR-1104191), AFOSR (FA9550-12-1-0057, FA9550-12-1-0268), and CRP-NRF (Tailoring Oxide Electronics).
The Transport Properties of Activated Carbon Fibers
DOE R&D Accomplishments Database
di Vittorio, S. L.; Dresselhaus, M. S.; Endo, M.; Issi, J-P.; Piraux, L.
1990-07-01
The transport properties of activated isotropic pitch-based carbon fibers with surface area 1000 m{sup 2}/g have been investigated. We report preliminary results on the electrical conductivity, the magnetoresistance, the thermal conductivity and the thermopower of these fibers as a function of temperature. Comparisons are made to transport properties of other disordered carbons.
The transport properties of activated carbon fibers
di Vittorio, S.L. . Dept. of Materials Science and Engineering); Dresselhaus, M.S. . Dept. of Electrical Engineering and Computer Science Massachusetts Inst. of Tech., Cambridge, MA . Dept. of Physics); Endo, M. . Dept. of Electrical Engineering); Issi, J-P.; Piraux, L.
1990-07-01
The transport properties of activated isotropic pitch-based carbon fibers with surface area 1000 m{sup 2}/g have been investigated. We report preliminary results on the electrical conductivity, the magnetoresistance, the thermal conductivity and the thermopower of these fibers as a function of temperature. Comparisons are made to transport properties of other disordered carbons. 19 refs., 4 figs.
TRANSPORT PROPERTY MEASUREMENTS OF HFC-236EA
The report gives results of an evaluation of transport properties of 1, 1, 1, 2, 3, 3-hexafluoropropane (HFC-236ea), with liquid viscosity and thermal conductivity being the two main transport properties of interest. In addition, the specific heat and density of refrigerant/lubri...
TRANSPORT PROPERTY MEASUREMENTS OF HFC-236EA
The report gives results of an evaluation of transport properties of 1,1,1,2,3,3,-hexafluoropropane (HFC-236ea), with liquid viscosity and thermal conductivity being the two main transport properties of interest. In addition, the specific heat and density of refrigerant/lubrican...
NASA Astrophysics Data System (ADS)
Taratuta, Victor Gregory
An experimental investigation of macroscopic mechanical properties of a polymer nematic liquid crystal was conducted on nematic solutions formed from rigid or semiflexible main chain polymers that are fully extended in a solution. The particular system under investigation is a poly-(gamma) -benzyl glutamate (PBG) which belongs to a class of synthetic polypeptides. Quasielastic Rayleigh light scattering on well aligned nematic single crystals of PBG was used to measure the elastic constants and the anisotropic viscosities as a function of concentration. The elastic constants are measured from the intensity of the scattered light which is determined by the amplitude of thermally excited director fluctuations. That amplitude depends on the energy of the fluctuation which is proportional to the appropriate elastic constant. The viscosities associated with the elastic deformation modes are computed from the characteristic relaxation times of the fluctuations by measuring their temporal autocorrelation function. The splay and bend elastic constants were found to be very similar in magnitude; both showed a linear dependence on concentration. The twist elastic constant was much smaller than either splay or bend and showed only a weak concentration dependence. Four out of five independent Leslie viscosities were measured (except the elongational flow viscosity (alpha)(,1)). The viscosities were found to exhibit very large anisotropies. Different types of viscosities showed distinctly different patterns of concentration dependence. (gamma)(,1) and (eta)(,c) were quadratic in concentration, (eta)(,a) was linear in concentration, and (eta)(,b) did not show any strong concentration dependence. The viscosity data indicate that even at a moderate length to diameter ratio studied (L/D - 30), the PBG approaches a behavior predicted for a system composed of infinitely long molecular chains. The concentration dependence data for the elastic constants and the anisotropic viscosities
Transport properties of fission product vapors
Im, K.H.; Ahluwalia, R.K.
1983-07-01
Kinetic theory of gases is used to calculate the transport properties of fission product vapors in a steam and hydrogen environment. Provided in tabular form is diffusivity of steam and hydrogen, viscosity and thermal conductivity of the gaseous mixture, and diffusivity of cesium iodide, cesium hydroxide, diatomic tellurium and tellurium dioxide. These transport properties are required in determining the thermal-hydraulics of and fission product transport in light water reactors.
NASA Astrophysics Data System (ADS)
Gao, Li-Lan; Chen, Xu; Gao, Hong
2012-07-01
Mechanical properties of anisotropic conductive adhesive film (ACF) were investigated experimentally under various environmental conditions. The temperature sweep test was conducted to investigate the effects of temperature on dynamical mechanical properties of the ACF. The ACF exhibited transitions to the glass state, viscoelastic state, and rubber state with increasing temperature, and its glass-transition temperature ( T g) was determined to be 149°C. The creep-recovery behaviors of the ACF were investigated, and it was found that the initial strains, instantaneous strains, and creep or recovery rates increased with increasing temperature. No obvious creep phenomenon was observed at low temperatures (≤0°C). The creep strain and creep rates at any time decreased with increasing hygrothermal aging time. The uniaxial tensile behaviors of the ACF were also investigated under hygrothermal aging and thermal cycling. The results show that the Young's modulus and tensile strength of the ACF decrease with increasing hygrothermal aging time; however, they increase at first and then decrease with increasing thermal cycling time. T g decreases slightly for the ACF after hygrothermal aging; however, it increases after thermal cycling.
Anisotropic optical properties of few-layer transition metal dichalcogenide ReS2
NASA Astrophysics Data System (ADS)
Li, Zhenglu; Cao, Ting; da Jornada, Felipe H.; Wu, Meng; Louie, Steven G.
We present first-principles (DFT, GW and GW-BSE) calculations of the electronic and optical properties of few-layer rhenium disulfide (ReS2). Monolayer ReS2 shows strong many-electron effects with a fundamental quasiparticle band gap of 2.38 eV based on G0W0 calculation and a large exciton binding energy of 690 meV based on solving the Bethe-Salpeter equation. Highly anisotropic linear-polarized optical absorptions are revealed for few-layer and bulk ReS2. The band gap shows a decreasing trend with the optical polarization direction near the absorption edge gradually rotating from around 67 degree in the monolayer to 85 degree in the bulk, referencing to the Re-chain. Our calculations are consistent with recent experimental data and theoretical studies, and provide a systematic understanding of the electronic and optical properties in few-layer ReS2. This work was supported by National Science Foundation Grant No. DMR15-1508412 and the U.S. Department of Energy under Contract No. DE-AC02-05CH11231. Computational resources have been provided by DOE at Lawrence Berkeley National Laboratory's NERSC facility.
NASA Astrophysics Data System (ADS)
Derzhko, Oleg; Richter, Johannes; Krokhmalskii, Taras; Zaburannyi, Oles'
2004-06-01
Using the Jordan-Wigner transformation and continued fractions we calculate rigorously the thermodynamic quantities for the spin- 1 /2 transverse Ising chain with periodically varying intersite interactions and/or on-site fields. We consider in detail the properties of the chains having a period of the transverse field modulation equal to 3. The regularly alternating transverse Ising chain exhibits several quantum phase transition points, where the number of transition points for a given period of alternation strongly depends on the specific set of the Hamiltonian parameters. The critical behavior in most cases is the same as for the uniform chain. However, for certain sets of the Hamiltonian parameters the critical behavior may be changed and weak singularities in the ground-state quantities appear. Due to the regular alternation of the Hamiltonian parameters the transverse Ising chain may exhibit plateaulike steps in the zero-temperature dependence of the transverse magnetization vs transverse field and many-peak temperature profiles of the specific heat. We compare the ground-state properties of regularly alternating transverse Ising and transverse XX chains and of regularly alternating quantum and classical chains. Making use of the corresponding unitary transformations we extend the elaborated approach to the study of thermodynamics of regularly alternating spin- 1 /2 anisotropic XY chains without field. We use the exact expression for the ground-state energy of such a chain of period 2 to discuss how the exchange interaction anisotropy destroys the spin-Peierls dimerized phase.
ODonnell, J.; Onellion, M.; Rzchowski, M.S.; Eckstein, J.N.; Bozovic, I.
1997-04-01
We show that both the magnetoresistance and magnetism in tetragonal MBE-grown films of La{sub 1{minus}x}Ca{sub x}MnO{sub 3} show anisotropic effects that depend on both temperature and magnetic field. We show that the {open_quotes}colossal{close_quotes} magnetoresistance depends on the angle between the magnetization and the transport current and that the size of this effect is temperature-dependent. Below the Curie temperature this results in an unusual upturn in the magnetoresistance for small magnetic fields normal to the plane of the film as the magnetization rotates out of the plane. Low-field hysteresis of the in-plane magnetoresistance is also observed, and also shows an anisotropy with respect to the current and magnetization directions. We also find an in-plane biaxial magnetocrystalline anisotropy with easy axes along the {l_brace}100{r_brace} (Mn{endash}O) crystal directions, and evidence for {ital c}-axis magnetocrystalline anisotropy. {copyright} {ital 1997 American Institute of Physics.}
Anisotropic mechanical properties of zircon and the effect of radiation damage
NASA Astrophysics Data System (ADS)
Beirau, Tobias; Nix, William D.; Bismayer, Ulrich; Boatner, Lynn A.; Isaacson, Scott G.; Ewing, Rodney C.
2016-06-01
This study provides new insights into the relationship between radiation-dose-dependent structural damage due to natural U and Th impurities and the anisotropic mechanical properties (Poisson's ratio, elastic modulus and hardness) of zircon. Natural zircon samples from Sri Lanka (see Muarakami et al. in Am Mineral 76:1510-1532, 1991) and synthetic samples, covering a dose range of zero up to 6.8 × 1018 α-decays/g, have been studied by nanoindentation. Measurements along the [100] crystallographic direction and calculations, based on elastic stiffness constants determined by Özkan (J Appl Phys 47:4772-4779, 1976), revealed a general radiation-induced decrease in stiffness (~54 %) and hardness (~48 %) and an increase in the Poisson's ratio (~54 %) with increasing dose. Additional indentations on selected samples along the [001] allowed one to follow the amorphization process to the point that the mechanical properties are isotropic. This work shows that the radiation-dose-dependent changes of the mechanical properties of zircon can be directly correlated with the amorphous fraction as determined by previous investigations with local and global probes (Ríos et al. in J Phys Condens Matter 12:2401-2412, 2000a; Farnan and Salje in J Appl Phys 89:2084-2090, 2001; Zhang and Salje in J Phys Condens Matter 13:3057-3071, 2001). The excellent agreement, revealed by the different methods, indicates a large influence of structural and even local phenomena on the macroscopic mechanical properties. Therefore, this study indicates the importance of acquiring better knowledge about the mechanical long-term stability of radiation-damaged materials.
NASA Astrophysics Data System (ADS)
Yousef, B. M.; Angus, D. A.
2016-06-01
Fractures are pervasive features within the Earth's crust and they have a significant influence on the multi-physical response of the subsurface. The presence of coherent fracture sets often leads to observable seismic anisotropy enabling seismic techniques to remotely locate and characterise fracture systems. In this study, we confirm the general scale-dependence of seismic anisotropy and provide new results specific to shear-wave splitting (SWS). We find that SWS develops under conditions when the ratio of wavelength to fracture size (λS / d) is greater than 3, where Rayleigh scattering from coherent fractures leads to an effective anisotropy such that effective medium model (EMM) theory is qualitatively valid. When 1 <λS / d < 3 there is a transition from Rayleigh to Mie scattering, where no effective anisotropy develops and hence the SWS measurements are unstable. When λS / d < 1 we observe geometric scattering and begin to see behaviour similar to transverse isotropy. We find that seismic anisotropy is more sensitive to fracture density than fracture compliance ratio. More importantly, we observe that the transition from scattering to an effective anisotropic regime occurs over a propagation distance between 1 and 2 wavelengths depending on the fracture density and compliance ratio. The existence of a transition zone means that inversion of seismic anisotropy parameters based on EMM will be fundamentally biased. More importantly, we observe that linear slip EMM commonly used in inverting fracture properties is inconsistent with our results and leads to errors of approximately 400% in fracture spacing (equivalent to fracture density) and 60% in fracture compliance. Although EMM representations can yield reliable estimates of fracture orientation and spatial location, our results show that EMM representations will systematically fail in providing quantitatively accurate estimates of other physical fracture properties, such as fracture density and compliance
NASA Astrophysics Data System (ADS)
Bhattacharjee, A.; Smith, C.; Vasquez, B.
2010-11-01
There has been a steady accumulation of observational evidence that the solar wind may be thought of as spaghetti: a network of individual magnetic flux tubes each with its own magnetic and plasma characteristics. As early as 1963, Parker referred to these tubes as magnetic and plasma ``filaments,'' and the picture has undergone several refinements since then [Bartley et al. 1966, Marliani et al. 1973, Tu and Marsch 1990, Bruno et al. 2001], culminating in the recent work of Borovsky [2008] who has suggested that these are fossil structures that originate at the solar surface. We use the weakly compressible MHD turbulence model [Bhattacharjee et al., 1998], which incorporates the effect of background spatial inhomogeneities, to describe such structures. We revisit the model equations, showing their relation to recent work by Hunana and Zank [2010]. For a model of interchange-instability driven turbulence, we then use the 1998 model equations to make predictions for the beta scaling of the anisotropic magnetic fluctuation spectra (the so-called variance anisotropy) observed by ACE, and show that the predictions bracket the observations well. We also predict the scaling of the anisotropic transport coefficients for particles and thermal energy.
Anisotropic effective medium properties from interacting Ag nanoparticles in silicon dioxide.
Menegotto, Thiago; Horowitz, Flavio
2014-05-01
Films containing a layer of Ag nanoparticles embedded in silicon dioxide were produced by RF magnetron sputtering. Optical transmittance measurements at several angles of incidence (from normal to 75°) revealed two surface plasmon resonance (SPR) peaks, which depend on electric field direction: one in the ultraviolet and another red-shifted from the dilute Ag/SiO₂ system resonance at 410 nm. In order to investigate the origin of this anisotropic behavior, the structural properties were determined by transmission electron microscopy, revealing the bidimensional plane distribution of Ag nanoparticles with nearly spherical shape as well as the filling factor of metal in the composite. A simple model linked to these experimental parameters allowed description of the most relevant features of the SPR positions, which, depending on the field direction, were distinctly affected by the coupling of oscillations between close nanoparticles, as described by a modified Drude-Lorentz dielectric function introduced into the Maxwell-Garnett relation. This approach allowed prediction of the resonance for light at 75° incidence from the SPR position for light at normal incidence, in good agreement with experimental observation. PMID:24921871
Preparation and magnetic properties of anisotropic bulk MnBi/NdFeB hybrid magnets
NASA Astrophysics Data System (ADS)
Ma, Y. L.; Liu, X. B.; Nguyen, V. V.; Poudyal, N.; Yue, M.; Liu, J. P.
2016-08-01
Anisotropic hybrid bulk magnets of MnBi/NdFeB with different composition ratio have been prepared with starting MnBi and Nd2Fe14B powders as well as epoxy resin as a binder in case it is needed to form bulk samples. It has been found that the ratio between the two phases in content has a remarkable influence on the magnetic properties, the thermal stability and the density of the bulk magnets. With increasing MnBi content the binder addition can be reduced. When the MnBi content is larger than 30 wt%, no binder is needed. On the other hand, the coercivity and saturation magnetization were increased significantly with increasing NdFeB content. When the NdFeB content was increased from 0% to 50%, the maximum energy product was enhanced from 4.7 to 10.0 MGOe, respectively. The energy product then decreased gradually with the NdFeB content due to the reduced density of the hybrid magnet. The thermal stability measurements showed that the temperature coefficient of coercivity grew with the MnBi content and became positive with MnBi=80 wt%.
Influence of anisotropic elasticity on the mechanical properties of fivefold twinned nanowires
NASA Astrophysics Data System (ADS)
Niekiel, Florian; Spiecker, Erdmann; Bitzek, Erik
2015-11-01
Previous atomistic simulations and experiments have shown an increased Young's modulus and yield strength of fivefold twinned (FT) face-centered cubic metal nanowires (NWs) when compared to single crystalline (SC) NWs of the same orientation. Here we report the results of atomistic simulations of SC and FT Ag, Al, Au, Cu and Ni NWs with diameters between 2 and 50 nm under tension and compression. The simulations show that the differences in Young's modulus between SC and FT NWs are correlated with the elastic anisotropy of the metal, with Al showing a decreased Young's modulus. We develop a simple analytical model based on disclination theory and constraint anisotropic elasticity to explain the trend in the difference of Young's modulus between SC and FT NWs. Taking into account the role of surface stresses and the elastic properties of twin boundaries allows to account for the observed size effect in Young's modulus. The model furthermore explains the different relative yield strengths in tension and compression as well as the material and loading dependent failure mechanisms in FTNWs.
NASA Astrophysics Data System (ADS)
Marinescu, M.; Liu, J. F.; Bonder, M. J.; Hadjipanayis, G. C.
2008-04-01
Utilizing the chemical reduction of FeCl2 with NaBH4 in the presence of 2:17 Sm-Co powders, we synthesized composite Sm(Co0.699Fe0.213Cu0.064Zr0.024)7.4/nano-Fe anisotropic hard magnetic powders. The average particle size of the hard magnetic core powder was 21μm while the soft magnetic Fe nanoparticles deposited uniformly on the core powder had a particle size smaller than 100nm. Different reaction protocols, such as immersion of the hard magnetic core powder in each reagent, the use of microemulsion (micelle) technique, or doubling the weight ratio of FeCl2 to core powder, led to different degrees of magnetic coupling of the hard and soft magnetic components of the composite powder. A reaction time of 180s led to deposition of 3.5wt% Fe nanoparticles and improved magnetic properties of the composite powder compared to the uncoated Sm(Co0.699Fe0.213Cu0.064Zr0.024)7.4 powder. The respective magnetic hysteresis parameters were 4πM18kOe=11.3kG, 4πMr=11kG, and Hci>20kOe with a smooth demagnetization curve.
Length-dependence of flexural rigidity as a result of anisotropic elastic properties of microtubules
Li, C.; Ru, C.Q. . E-mail: c.ru@ualberta.ca; Mioduchowski, A.
2006-10-27
Unexplained length-dependence of flexural rigidity and Young's modulus of microtubules is studied using an orthotropic elastic shell model. It is showed that vibration frequencies and buckling load predicted by the accurate orthotropic shell model are much lower than that given by the approximate isotropic beam model for shorter microtubules, although the two models give almost identical results for sufficiently long microtubules. It is this inaccuracy of the isotropic beam model used by all previous researchers that leads to reported lower flexural rigidity and Young's modulus for shorter microtubules. In particular, much lower shear modulus and circumferential Young's modulus, which only weaken flexural rigidity of shorter microtubules, are responsible for the observed length-dependence of the flexural rigidity. These results confirm that longitudinal Young's modulus of microtubules is length-independent, and the observed length-dependence of the flexural rigidity and Young's modulus is a result of strongly anisotropic elastic properties of microtubules which have a length-dependent weakening effect on flexural rigidity of shorter microtubules.
Martinsson, Erik; Shahjamali, Mohammad M; Large, Nicolas; Zaraee, Negin; Zhou, Yu; Schatz, George C; Mirkin, Chad A; Aili, Daniel
2016-01-20
Shape-controlled synthesis of gold nanoparticles generally involves the use of surfactants, typically cetyltrimethylammonium (CTAX, X = Cl(-) , Br(-)), to regulate the nucleation growth process and to obtain colloidally stable nanoparticles. The surfactants adsorb on the nanoparticle surface making further functionalization difficult and therefore limit their use in many applications. Herein, the influence of CTAX on nanoparticle sensitivity to local dielectric environment changes is reported. It is shown, both experimentally and theoretically, that the CTAX bilayer significantly reduces the refractive index (RI) sensitivity of anisotropic gold nanoparticles such as nanocubes and concave nanocubes, nanorods, and nanoprisms. The RI sensitivity can be increased by up to 40% by removing the surfactant layer from nanoparticles immobilized on a solid substrate using oxygen plasma treatment. This increase compensates for the otherwise problematic decrease in RI sensitivity caused by the substrate effect. Moreover, the removal of the surfactants both facilitates nanoparticle biofunctionalization and significantly improves their catalytic properties. The strategy presented herein is a simple yet effective universal method for enhancing the RI sensitivity of CTAX-stabilized gold nanoparticles and increasing their potential as transducers in nanoplasmonic sensors, as well as in catalytic and biomedical applications. PMID:26583756
NASA Astrophysics Data System (ADS)
Wang, Lei; Wang, Xiaodong
2014-06-01
Resulting from the nature of anisotropy of coal media, it is a meaningful work to evaluate pressure transient behavior and flow characteristics within coals. In this article, a complete analytical model called the elliptical flow model is established by combining the theory of elliptical flow in anisotropic media and Fick's laws about the diffusion of coalbed methane. To investigate pressure transient behavior, analytical solutions were first obtained through introducing a series of special functions (Mathieu functions), which are extremely complex and are hard to calculate. Thus, a computer program was developed to establish type curves, on which the effects of the parameters, including anisotropy coefficient, storage coefficient, transfer coefficient and rate constant, were analyzed in detail. Calculative results show that the existence of anisotropy would cause great pressure depletion. To validate new analytical solutions, previous results were used to compare with the new results. It is found that a better agreement between the solutions obtained in this work and the literature was achieved. Finally, a case study is used to explain the effects of the parameters, including rock total compressibility coefficient, coal medium porosity and anisotropic permeability, sorption time constant, Langmuir volume and fluid viscosity, on bottom-hole pressure behavior. It is necessary to coordinate these parameters so as to reduce the pressure depletion.
Calculating Theromodynamic And Transport Properties Of Fluids
NASA Technical Reports Server (NTRS)
Proctor, Margaret P.; Klem, Mark D.
1987-01-01
Computer program incorporates van der Waals equation and correction tables. FLUID program developed to calculate thermodynamic and transport properties of pure fluids in both liquid and gas phases. Properties calculated by use of simple gas model, empirical corrections, and efficient numerical interpolation scheme. Produces results that agree very well with measured values. Much faster than older, more complex programs developed for same purpose.
Electronic, transport, and optical properties of bulk and mono-layer PdSe2
Sun, Jifeng; Shi, Hongliang; Siegrist, Theo; Singh, David J.
2015-10-13
In this study, the electronic and optical properties of bulk and monolayer PdSe2 are investigated using firstprinciples calculations. Using the modified Becke-Johnson potential, we find semiconductor behavior for both bulk and monolayer PdSe2 with indirect gap values of 0.03 eV for bulk and 1.43 eV for monolayer, respectively. Our sheet optical conductivity results support this observation and show similar anisotropic feature in the 2D plane. We further study the thermoelectric properties of the 2D PdSe2 using Blotzmann transport model and find interestingly high Seebeck coefficients (>200 μV/K) for both p- and n-type up to high doping level (–2 x 1013more » cm2) with an anisotropic character in an electrical conductivity suggesting better thermoelectric performance along y direction in the plane.V« less
Electronic, transport, and optical properties of bulk and mono-layer PdSe{sub 2}
Sun, Jifeng; Shi, Hongliang; Siegrist, Theo; Singh, David J.
2015-10-12
The electronic and optical properties of bulk and monolayer PdSe{sub 2} are investigated using first-principles calculations. Using the modified Becke-Johnson potential, we find semiconductor behavior for both bulk and monolayer PdSe{sub 2} with indirect gap values of 0.03 eV for bulk and 1.43 eV for monolayer, respectively. Our sheet optical conductivity results support this observation and show similar anisotropic feature in the 2D plane. We further study the thermoelectric properties of the 2D PdSe{sub 2} using Blotzmann transport model and find interestingly high Seebeck coefficients (>200 μV/K) for both p- and n-type up to high doping level (∼2 × 10{sup 13} cm{sup −2}) with an anisotropic character in an electrical conductivity suggesting better thermoelectric performance along y direction in the plane.
Transport Properties and Transport Phenomena in Casting Nickel Superalloys
NASA Astrophysics Data System (ADS)
Felicelli, S. D.; Sung, P. K.; Poirier, D. R.; Heinrich, J. C.
1998-11-01
Nickel superalloys that are used in the high-temperature regions of gas-turbine engines are cast by directional solidification (DS). In the DS processes, the castings are cooled from below, and three zones exist during solidification: (1) an all-solid zone at the bottom, (2) a "mushy zone" that is comprised of solid and liquid material, and (3) an overlying all-liquid zone. Computer simulations can be useful in predicting the complex transport phenomena that occur during solidification, but realistic simulations require accurate values of the transport properties. In addition to transport properties, the thermodynamic equilibria between the solid and liquid during solidification must also be known with reasonable accuracy. The importance of using reasonably accurate estimations of the transport properties is illustrated by two-dimensional simulations of the convection during solidification and the coincidental macrosegregation in the DS castings of multicomponent Ni-base alloys. In these simulations, we examine the sensitivity of the calculated results to measured partition ratios, thermal expansion coefficients, and viscosities that are estimated by regression analyses and correlations of existing property data.
NASA Astrophysics Data System (ADS)
Lee, Ji-Hwan; Park, Jong-Hun; Soon, Aloysius
2016-07-01
Current materials-related calculations employ density-functional theory (DFT), commonly using the (semi-)local-density approximations for the exchange-correlation (xc) functional. The difficulties in arriving at a reasonable description of van der Waals (vdW) interactions by DFT-based models is to date a big challenge. In this work, we use various flavors of vdW-corrected DFT xc functionals—ranging from the quasiempirical force-field add-on vdW corrections to self-consistent nonlocal correlation functionals—to study the bulk lattice and mechanical properties (including the elastic constants and anisotropic indices) of the coinage metals (copper, silver, and gold). We critically assess the reliability of the different vdW-corrected DFT methods in describing their anisotropic mechanical properties which have been less reported in the literature. In the context of this work, we regard that our results reiterate the fact that advocating a so-called perfect vdW-inclusive xc functional for describing the general physics and chemistry of these coinage metals could be a little premature. These challenges to modern-day functionals for anisotropically strained coinage metals (e.g., at the faceted surfaces of nanostructures) may well be relevant to other strained material systems.
Cho, B.
1995-11-01
The interaction of superconductivity with magnetism has been one of the most interesting and important phenomena in solid state physics since the 1950`s when small amounts of magnetic impurities were incorporated in superconductors. The discovery of the magnetic superconductors RNi{sub 2}B{sub 2}C (R = rare earth, Y) offers a new system to study this interaction. The wide ranges of superconducting transition (T{sub c}) and antiferromagnetic (AF) ordering temperatures (T{sub N}) (0 K {le} T{sub c} {le} 16 K, 0 K {le} T{sub N} {le} 20 K) give a good opportunity to observe a variety of interesting phenomena. Single crystals of high quality with appropriate size and mass are crucial in examining the anisotropic intrinsic properties. Single crystals have been grown successfully by an unusual high temperature flux method and characterized thoroughly by X-ray, electrical transport, magnetization, neutron scattering, scanning electron microscopy, and other measurements.
Sudbo, A.; Brandt, E.H. )
1991-05-01
The real-space anisotropic interaction between arbitrarily curved London vortices is calculated for a uniaxially anisotropic superconductor. From this we derive the elastic energy of a distorted flux-line lattice (FLL) in a uniaxially anisotropic superconductor for inductions {ital B}{much lt}{ital B}{sub {ital c}2} and arbitrary field direction. Avoiding the continuum description of the FLL, we obtain the exact elastic matrix, which is periodic in Fourier space and from which all elastic moduli of the FLL may be extracted. In the continuum limit, we give explicit expressions for the various nonlocal tilt and bulk moduli for the two cases {bold B}{perpendicular}{bold {cflx c}} and {bold B}-{bold {cflx c}}; here {bold {cflx c}} is the symmetry axis of the uniaxial crystal perpendicular to the basal plane. These results complement previous local theories and extend previous nonlocal treatments.
Eslami, Hossein; Mohammadzadeh, Laila; Mehdipour, Nargess
2012-03-14
While polymers are known as thermal insulators, recent studies show that stretched single chains of polymers have a very high thermal conductivity. In this work, our new simulation scheme for simulation of heat flow in nanoconfined fluids [H. Eslami, L. Mohammadzadeh, and N. Mehdipour, J. Chem. Phys. 135, 064703 (2011)] is employed to study the effect of chain ordering (stretching) on the rate of heat transfer in polyamide-6,6 nanoconfined between graphene surfaces. Our results for the heat flow in the parallel direction (the plane of surfaces) show that the coefficient of thermal conductivity depends on the intersurface distance and is much higher than that of the bulk polymer. A comparison of results in this work with our former findings on the heat flow in the perpendicular direction, with the coefficient of heat conductivity less than the bulk sample, reveal that well-organized polymer layers between the confining surfaces show an anisotropic heat conduction; the heat conduction in the direction parallel to the surfaces is much higher than that in the perpendicular direction. The origin of such anisotropy in nanometric heat flow is shown to be the dramatic anisotropy in chain conformations (chain stretching) beside the confining surfaces. The results indicate that the coefficients of heat conductivity in both directions, normal and parallel to the surfaces, depend on the degree of polymer layering between the surfaces and the pore width. PMID:22423855
NASA Astrophysics Data System (ADS)
Adler, P. M.; Thovert, J.; Mourzenko, V.
2011-12-01
The main purpose of this review paper is to summarize some recent studies of fracture networks. Progress has been made possible thanks to a very versatile numerical technique based on a three-dimensional discrete description of the fracture networks. Any network geometry, any boundary condition, and any distribution of the fractures can be addressed. The first step is to mesh the fracture network as it is by triangles of a controlled size. The second step consists in the discretization of the conservation equations by the finite volume technique. Two important properties were systematically studied, namely the percolation threshold rho_c and the macroscopic permeability K_n of the fracture network. Dimensionless quantities are denoted by a prime. The numerical results are interpreted in a systematic way with the concept of excluded volume which enables us to define a dimensionless fracture density rho' equal in the average to the average number of intersections per fracture. 1. Isotropic networks of identical fractures The dimensionless percolation threshold rho'_c of such networks was systematically studied for fractures of various shapes. rho'_c was shown to be almost independent of the shape except when one has very elongated rectangles. A formula is proposed for rho'_c. The permeability of these networks was calculated for a wide range of fracture densities and shapes. K'_n(rho') is almost independent of the fracture shape; an empirical formula is proposed for any value of rho' between rho'_c and infinity. For large rho', K_n is well approximated by the Snow formula initially derived for infinite fractures. 2. Anisotropic networks of identical fractures The fracture orientations are supposed to follow a Fisher distribution characterized by the parameter kappa; when kappa=0, the fractures are isotropic; when kappa=infinity, the fractures are perpendicular to a given direction. rho'_c does not depend significantly on kappa and the general formula proposed in 1
NASA Astrophysics Data System (ADS)
Ramirez, Sylvester
anisotropy of the thermal conductivity, K/K ⊥ ˜ 675, which is substantially larger even than in the high-quality graphite. The strongly anisotropic heat conduction properties of these films can be useful for the thermal filler applications. The results obtained for the nanostructured magnetic and hybrid materials are important for the renewable energy and electronic applications of permanent magnets.
Wang, Yong; Yue, Wenzheng; Zhang, Mo
2016-01-01
The anisotropic transport of thermal neutron in heterogeneous porous media is of great research interests in many fields. In this paper, it is the first time that a new model based on micron X-ray computed tomography (CT) has been proposed to simultaneously consider both the separation of matrix and pore and the distribution of mineral components. We apply the Monte Carlo method to simulate thermal neutrons transporting through the model along different directions, and meanwhile detect those unreacted thermal neutrons by an array detector on the other side of the model. Therefore, the anisotropy of pore structure can be imaged by the amount of received thermal neutrons, due to the difference of rock matrix and pore-filling fluids in the macroscopic reaction cross section (MRCS). The new model has been verified by the consistent between the simulated data and the pore distribution from X-ray CT. The results show that the evaluation of porosity can be affected by the anisotropy of media. Based on the research, a new formula is developed to describe the correlation between the resolution of array detectors and the quality of imaging. The formula can be further used to analyze the critical resolution and the suitable number of thermal neutrons emitted in each simulation. Unconventionally, we find that a higher resolution cannot always lead to a better image. PMID:27271330
NASA Astrophysics Data System (ADS)
Wang, Yong; Yue, Wenzheng; Zhang, Mo
2016-06-01
The anisotropic transport of thermal neutron in heterogeneous porous media is of great research interests in many fields. In this paper, it is the first time that a new model based on micron X-ray computed tomography (CT) has been proposed to simultaneously consider both the separation of matrix and pore and the distribution of mineral components. We apply the Monte Carlo method to simulate thermal neutrons transporting through the model along different directions, and meanwhile detect those unreacted thermal neutrons by an array detector on the other side of the model. Therefore, the anisotropy of pore structure can be imaged by the amount of received thermal neutrons, due to the difference of rock matrix and pore-filling fluids in the macroscopic reaction cross section (MRCS). The new model has been verified by the consistent between the simulated data and the pore distribution from X-ray CT. The results show that the evaluation of porosity can be affected by the anisotropy of media. Based on the research, a new formula is developed to describe the correlation between the resolution of array detectors and the quality of imaging. The formula can be further used to analyze the critical resolution and the suitable number of thermal neutrons emitted in each simulation. Unconventionally, we find that a higher resolution cannot always lead to a better image.
Wang, Yong; Yue, Wenzheng; Zhang, Mo
2016-01-01
The anisotropic transport of thermal neutron in heterogeneous porous media is of great research interests in many fields. In this paper, it is the first time that a new model based on micron X-ray computed tomography (CT) has been proposed to simultaneously consider both the separation of matrix and pore and the distribution of mineral components. We apply the Monte Carlo method to simulate thermal neutrons transporting through the model along different directions, and meanwhile detect those unreacted thermal neutrons by an array detector on the other side of the model. Therefore, the anisotropy of pore structure can be imaged by the amount of received thermal neutrons, due to the difference of rock matrix and pore-filling fluids in the macroscopic reaction cross section (MRCS). The new model has been verified by the consistent between the simulated data and the pore distribution from X-ray CT. The results show that the evaluation of porosity can be affected by the anisotropy of media. Based on the research, a new formula is developed to describe the correlation between the resolution of array detectors and the quality of imaging. The formula can be further used to analyze the critical resolution and the suitable number of thermal neutrons emitted in each simulation. Unconventionally, we find that a higher resolution cannot always lead to a better image. PMID:27271330
Asymptotic-preserving Lagrangian approach for modeling anisotropic transport in magnetized plasmas
NASA Astrophysics Data System (ADS)
Chacon, Luis; Del-Castillo-Negrete, Diego
2012-03-01
Modeling electron transport in magnetized plasmas is extremely challenging due to the extreme anisotropy between parallel (to the magnetic field) and perpendicular directions (the transport-coefficient ratio χ/χ˜10^10 in fusion plasmas). Recently, a novel Lagrangian Green's function method has been proposedfootnotetextD. del-Castillo-Negrete, L. Chac'on, PRL, 106, 195004 (2011); D. del-Castillo-Negrete, L. Chac'on, Phys. Plasmas, submitted (2011) to solve the local and non-local purely parallel transport equation in general 3D magnetic fields. The approach avoids numerical pollution, is inherently positivity-preserving, and is scalable algorithmically (i.e., work per degree-of-freedom is grid-independent). In this poster, we discuss the extension of the Lagrangian Green's function approach to include perpendicular transport terms and sources. We present an asymptotic-preserving numerical formulation, which ensures a consistent numerical discretization temporally and spatially for arbitrary χ/χ ratios. We will demonstrate the potential of the approach with various challenging configurations, including the case of transport across a magnetic island in cylindrical geometry.
Coupled light transport-heat diffusion model for laser dosimetry with dynamic optical properties
London, R.A.; Glinsky, M.E.; Zimmerman, G.B.; Eder, D.C.; Jacques, S.L.
1995-03-01
The effect of dynamic optical properties on the spatial distribution of light in laser therapy is studied via numerical simulations. A two-dimensional, time dependent computer program called LATIS is used. Laser light transport is simulated with a Monte Carlo technique including anisotropic scattering and absorption. Thermal heat transport is calculated with a finite difference algorithm. Material properties are specified on a 2-D mesh and can be arbitrary functions of space and time. Arrhenius rate equations are solved for tissue damage caused by elevated temperatures. Optical properties are functions of tissue damage, as determined by previous measurements. Results are presented for the time variation of the light distribution and damage within the tissue as the optical properties of the tissue are altered.
Wave-Particle Decorrelation and Transport of Anisotropic Turbulence in Collisionless Plasmas
Lin, Z.; Holod, I.; Chen, L.; Diamond, P. H.; Hahm, T. S.; Ethier, S.
2007-12-31
Comprehensive analysis of the largest first-principles simulations to date shows that stochastic wave-particle decorrelation is the dominant mechanism responsible for electron heat transport driven by electron temperature gradient turbulence with extended radial streamers. The transport is proportional to the local fluctuation intensity, and phase-space island overlap leads to a diffusive process with a time scale comparable to the wave-particle decorrelation time, determined by the fluctuation spectral width. This kinetic time scale is much shorter than the fluid time scale of eddy mixing.
NASA Astrophysics Data System (ADS)
Wei, Qin; Zhu, Jianguo; Chen, Wei
2016-02-01
The mechanical properties of plasma-sprayed thermal barrier coatings (TBC) are of great scientific and technological significance for the design and fabrication of TBC systems. The ultrasonic method combined with a sing-around method for mechanical properties measurement of TBC is deduced and the elastic modulus can be determined in the spray, or longitudinal, direction, and the transverse direction. Tested specimens of plasma-sprayed TBC are detached from the substrate and treated with thermal exposure at 1400 °C. The elastic moduli along the longitudinal and transverse directions of the TBCs are measured by different types of ultrasonic waves combined with a sing-around method, while the Poisson's ratio is also obtained simultaneously. The experimental results indicate that the magnitude of longitudinal elastic modulus is larger than that of the transverse one, and thus the plasma-sprayed TBC has an anisotropic mechanical property. Moreover, the elastic moduli along both longitudinal and transverse directions change with high-temperature exposure time, which consists of a rapid increasing stage followed by a slow decreasing stage. In addition, the magnitude of Poisson's ratio increases slightly from 0.05 to 0.2 with the high-temperature exposure time. Generally, the microstructures in the plasma-sprayed coatings and their evolution in a high-temperature environment are the main causes of the varying anisotropic mechanical properties.
Computing Thermodynamic And Transport Properties Of Air
NASA Technical Reports Server (NTRS)
Thompson, Richard A.; Gupta, Roop N.; Lee, Kam-Pui
1994-01-01
EQAIRS computer program is set of FORTRAN 77 routines for computing thermodynamic and transport properties of equilibrium air for temperatures from 100 to 30,000 K. Computes properties from 11-species, curve-fit mathematical model. Successfully implemented on DEC VAX-series computer running VMS, Sun4-series computer running SunOS, and IBM PC-compatible computer running MS-DOS.
NASA Astrophysics Data System (ADS)
Muthinti, Gangadhara R.; Medikonda, Manasa; Fronheiser, Jody; Kamineni, Vimal K.; Peterson, Brennan; Race, Joseph; Diebold, Alain C.
2013-04-01
The uses of strained channel became prevalent at the 65 nm node and have continued to be a large part of logic device performance improvements in every technology generation. These material and integration innovations will continue to be important in sub-22nm devices, and are already being applied in finFET devices where total available in-channel strains are potentially higher. The measurement of structures containing these materials is complicated by the intrinsic correlation of the measured optical thickness and variation of optical properties with strain, as well as the dramatic reduction in total volume of the device. Optical scatterometry has enabled characterization of the feature shape and dimensions of complex 3D structures, including non-planar transistors and memory structures. Ellipsometric methods have been successfully applied to the measurement of thin films of SiGe and related strained structures. A direction for research is validating that the thin film stress results can be extended into the much more physically complex 3D shape. There are clear challenges in this: the stress in a SiGe fin is constrained to match the underlying Si along one axis, but the sides and top are free, leading to very large strain gradients both along the fin width and height. Practical utilization of optical techniques as a development tool is often limited by the complexity of the scatterometry model and setup, and this added material complexity presents a new challenge. In this study, generalized spectroscopic ellipsometric measurements of strained grating was undertaken, in parallel with reference cross sectional and top down SEM data. The measurements were modeled for both anisotropy calculations, as well as full scatterometry calculations, fitting the strain and structure. The degree to which strain and CD can be quickly quantified in an optical model is discussed. Sum decomposition method has been implemented to extract the effective anisotropic coefficients and a
Transport properties of pseudospin-1 photons (Presentation Recording)
NASA Astrophysics Data System (ADS)
Chan, Che Ting; Fang, Anan; Zhang, Zhao-Qing; Louie, Steven G.
2015-09-01
Pseudospin is of central importance in governing many unusual transport properties of graphene and other artificial systems which have pseudospins of 1/2. These unconventional transport properties are manifested in phenomena such as Klein tunneling, and collimation of electron beams in one-dimensional external potentials. Here we show that in certain photonic crystals (PCs) exhibiting conical dispersions at the center of Brillouin zone, the eigenstates near the "Dirac-like point" can be described by an effective spin-orbit Hamiltonian with a pseudospin of 1. This effective Hamiltonian describes within a unified framework the wave propagations in both positive and negative refractive index media which correspond to the upper and lower conical bands respectively. Different from a Berry phase of π for the Dirac cone of pseudospin-1/2 systems, the Berry phase for the Dirac-like cone turns out to be zero from this pseudospin-1 Hamiltonian. In addition, we found that a change of length scale of the PC can shift the Dirac-like cone rigidly up or down in frequency with its group velocity unchanged, hence mimicking a gate voltage in graphene and allowing for a simple mechanism to control the flow of pseudospin-1 photons. As a photonic analogue of electron potential, the length-scale induced Dirac-like point shift is effectively a photonic potential within the effective pseudospin-1 Hamiltonian description. At the interface of two different potentials, the 3-component spinor gives rise to distinct boundary conditions which do not require each component of the wave function to be continuous, leading to new wave transport behaviors as shown in Klein tunneling and supercollimation. For examples, the Klein tunneling of pseudospin-1 photons is much less anisotropic with reference to the incident angle than that of pseudospin-1/2 electrons, and collimation can be more robust with pseudospin-1 than pseudospin-1/2. The special wave transport properties of pseudospin-1 photons
Dhar, Prodyut; Kumar, Amit; Katiyar, Vimal
2016-07-20
This paper reports a single-step co-precipitation method for the fabrication of magnetic cellulose nanocrystals (MGCNCs) with high iron oxide nanoparticle content (∼51 wt % loading) adsorbed onto cellulose nanocrystals (CNCs). X-ray diffraction (XRD), Fourier transform infrared (FTIR), and Raman spectroscopic studies confirmed that the hydroxyl groups on the surface of CNCs (derived from the bamboo pulp) acted as anchor points for the adsorption of Fe3O4 nanoparticles. The fabricated MGCNCs have a high magnetic moment, which is utilized to orient the magnetoresponsive nanofillers in parallel or perpendicular orientations inside the polylactic acid (PLA) matrix. Magnetic-field-assisted directional alignment of MGCNCs led to the incorporation of anisotropic mechanical, thermal, and electrical properties in the fabricated PLA-MGCNC nanocomposites. Thermomechanical studies showed significant improvement in the elastic modulus and glass-transition temperature for the magnetically oriented samples. Differential scanning calorimetry (DSC) and XRD studies confirmed that the alignment of MGCNCs led to the improvement in the percentage crystallinity and, with the absence of the cold-crystallization phenomenon, finds a potential application in polymer processing in the presence of magnetic field. The tensile strength and percentage elongation for the parallel-oriented samples improved by ∼70 and 240%, respectively, and for perpendicular-oriented samples, by ∼58 and 172%, respectively, in comparison to the unoriented samples. Furthermore, its anisotropically induced electrical and magnetic properties are desirable for fabricating self-biased electronics products. We also demonstrate that the fabricated anisotropic PLA-MGCNC nanocomposites could be laminated into films with the incorporation of directionally tunable mechanical properties. Therefore, the current study provides a novel noninvasive approach of orienting nontoxic bioderived CNCs in the presence of low
Thermodynamic and transport properties of fluids
NASA Technical Reports Server (NTRS)
Fessler, T. E.
1980-01-01
Computer program subroutine FLUID calculates thermodynamic and transport properties of pure fluids in liquid, gas, or two-phase (liquid/gas) conditions. Program determines thermodynamic state from assigned values for temperature and density, pressure and density, temperature and pressure, pressure and entropy, or pressure and enthalpy.
Electronic transport properties in graphene oxide frameworks
NASA Astrophysics Data System (ADS)
Zhu, P.; Cruz-Silva, E.; Meunier, V.
2014-02-01
The electronic transport properties in multiterminal graphene oxide framework (GOF) materials are investigated using a combination of theoretical and computational methods. GOFs make up four-terminal [origin=c]90H-shaped GNR-L-GNR junctions where sandwiched boronic acid molecules (L) are covalently linked to two graphene nanoribbons (GNRs) of different edge chiralities. The transport properties are governed by both tunneling and quasiresonant regimes. We determine how the presence of linker molecules affects the transport properties and establish that the through-molecule transport properties can be tuned by varying the chemical composition of the pillar molecules but are not significantly modified when changing the type of electrodes from zigzag GNRs to armchair GNRs. In addition, we find that in multilinker systems containing two parallel molecules in the device area, the coupling between the molecules can lead to both constructive and destructive quantum interferences. We also examine the inability of the classical Kirchhoff's superposition law to account for electron flow in multilinker GOF nanonetworks.
NASA Astrophysics Data System (ADS)
da Câmara Santa Clara Gomes, Tristan; De La Torre Medina, Joaquín; Velázquez-Galván, Yenni G.; Martínez-Huerta, Juan Manuel; Encinas, Armando; Piraux, Luc
2016-07-01
We have explored the interplay between the magnetic and magneto-transport properties of 3D interconnected nanowire networks made of various magnetic metals by electrodeposition into nanoporous membranes with crossed channels and controlled topology. The close relationship between their magnetic and structural properties has a direct impact on their magneto-transport behavior. In order to accurately and reliably describe the effective magnetic anisotropy and anisotropic magnetoresistance, an analytical model inherent to the topology of 3D nanowire networks is proposed and validated. The feasibility to obtain magneto-transport responses in nanowire network films based on interconnected nanowires makes them very attractive for the development of mechanically stable superstructures that are suitable for potential technological applications.
Extremely large anisotropic transport caused by electronic phase separation in Ti-doped Ca3Ru2O7
NASA Astrophysics Data System (ADS)
Peng, Jin; Liu, J. Y.; Gu, Xiaomin; Zhou, Guotai; Wang, Wei; Hu, J.; Zhang, F. M.; Wu, X. S.
2016-06-01
In this paper, we reported an extremely large out-of-plane/in-plane anisotropic transport ({ρc}/{ρab} ~ 109) in double layer ruthenates. The mechanism that may be responsible for this phenomenon is also explored here. Distinct from previously well studied layered materials which show large out-of-plane/in-plane electronic anisotropy (103–106), the Ti-doped Ca3Ru2O7 single crystals not only form quasi-2D layered structure, but also show phase separation within the layers. We found that Ti doping in Ca3Ru2O7 induced electronic phase separation between the insulating phase and weak localized phase. The ratio of these two phases is very sensitive to the Ti concentration. At typical concentration, the weak localized phase may form a channel on the background of the insulating phase within the ab plane. However, the small volume of weak localized phase makes it less likely to overlap in different layers. This results in a much larger electronic anisotropy ratio than pristine compound Ca3Ru2O7. This new mechanism provides a route for further increase electronic anisotropy, which will remarkably reduce current leak and power consumption in electronic devices.
NASA Astrophysics Data System (ADS)
Kawamura, T.; Kai, T.; Koike, F.; Nakazaki, S.; Nishimura, H.; Inubushi, Y.; Okano, Y.; Nagatomo, H.; Batani, D.; Morace, A.; Redaelli, R.; Fourment, C.; Santos, J.; Malka, G.; Boscheron, A.; Casner, A.; Koenig, M.; Fujioka, S.; Nakamura, T.; Johzaki, T.; Mima, K.
2009-09-01
In fast ignition research, the transport dynamics of fast electrons is one of the critical issues. Fast electrons generated by an intense laser pulse show a highly anisotropic velocity distribution. To gain insight into the anisotropy of the velocity distribution of fast electrons, polarized x-ray spectroscopy has been proposed. The polarization spectroscopy of Cl Heα radiation was experimentally demonstrated at 1017 W/cm2 (˜100 mJ in 130 fs), and a new time-dependent atomic population kinetics code was also developed. It predicts that the high polarization arises only in a low-density region of the target plasma. Additional x-ray polarization measurements were done at 101717-18 W/cm2 (˜10 J in ˜1 ps). Polarization was measured as a function of the overcoat thickness of a target. The polarization is negative in the shallow region near the target surface, and becomes near zero at the laser intensity of ˜1018 W/cm2. At ˜1017 W/cm2, the polarization varies from negative to positive, and finally zero along with an increase in the overcoat thickness.
Sun, Bao-Zhen; Ma, Zuju; He, Chao; Wu, Kechen
2015-11-28
Thermoelectrics interconvert heat to electricity and are of great interest in waste heat recovery, solid-state cooling and so on. Here we assessed the potential of SnS2 and SnSe2 as thermoelectric materials at the temperature gradient from 300 to 800 K. Reflecting the crystal structure, the transport coefficients are highly anisotropic between a and c directions, in particular for the electrical conductivity. The preferred direction for both materials is the a direction in TE application. Most strikingly, when 800 K is reached, SnS2 can show a peak power factor (PF) of 15.50 μW cm(-1) K(-2) along the a direction, while a relatively low value (11.72 μW cm(-1) K(-2)) is obtained in the same direction of SnSe2. These values are comparable to those observed in thermoelectrics such as SnSe and SnS. At 300 K, the minimum lattice thermal conductivity (κmin) along the a direction is estimated to be about 0.67 and 0.55 W m(-1) K(-1) for SnS2 and SnSe2, respectively, even lower than the measured lattice thermal conductivity of Bi2Te3 (1.28 W m(-1) K(-1) at 300 K). The reasonable PF and κmin suggest that both SnS2 and SnSe2 are potential thermoelectric materials. Indeed, the estimated peak ZT can approach 0.88 for SnSe2 and a higher value of 0.96 for SnS2 along the a direction at a carrier concentration of 1.94 × 10(19) (SnSe2) vs. 2.87 × 10(19) cm(-3) (SnS2). The best ZT values in SnX2 (X = S, Se) are comparable to that in Bi2Te3 (0.8), a typical thermoelectric material. We hope that this theoretical investigation will provide useful information for further experimental and theoretical studies on optimizing the thermoelectric properties of SnX2 materials. PMID:26486877
Properties of interfaces and transport across them.
Cabezas, H
2000-01-01
Much of the biological activity in cell cytoplasm occurs in compartments some of which may be formed, as suggested in this book, by phase separation, and many of the functions of such compartments depend on the transport or exchange of molecules across interfaces. Thus a fundamentally based discussion of the properties of phases, interfaces, and diffusive transport across interfaces has been given to further elucidate these phenomena. An operational criterion for the width of interfaces is given in terms of molecular and physical arguments, and the properties of molecules inside phases and interfaces are discussed in terms of molecular arguments. In general, the properties of the interface become important when the molecules diffusing across are smaller than the width of the interface. Equilibrium partitioning, Donnan phenomena, and electrochemical potentials at interfaces are also discussed in detail. The mathematical expressions for modeling transport across interfaces are discussed in detail. These describe a practical and detailed model for transport across interfaces. For molecules smaller than the width of the interface, this includes a detailed model for diffusion inside the interface. Last, the question of the time scale for phase formation and equilibration in biological systems is discussed. PMID:10610364
NASA Astrophysics Data System (ADS)
Zhang, Xudong; Jiang, Wei
2016-02-01
To better clarify the physical properties for Al3RE precipitates, first-principles calculations are performed to investigate the vibrational, anisotropic elastic and thermodynamic properties of Al3Er and Al3Yb. The calculated results agree well with available experimental and theoretical ones. The vibrational properties indicate that Al3Er and Al3Yb will keep their dynamical stabilities with L12 structure up to 100 GPa. The elastic constants are satisfied with mechanical stability criteria up to the external pressure of 100 GPa. The mechanical anisotropy is predicted by anisotropic constants AG, AU, AZ and 3D curved surface of Young's modulus. The calculated results show that both Al3Er and Al3Yb are isotropic at zero pressure and obviously anisotropic under high pressure. Further, we systematically investigate the thermodynamic properties and provide the relationships between thermal parameters and pressure. Finally, the pressure-dependent behaviours of density of states, Mulliken charge and bond length are discussed.
Transport properties in the Jovian atmosphere
NASA Technical Reports Server (NTRS)
Biolsi, L.
1978-01-01
Transport properties in a Jupiter-like atmosphere (89 mol % hydrogen and 11 mol % helium) are obtained by using the method of the kinetic theory of gases. The transport collision integrals are calculated by fitting various two-body semiempirical interaction potentials for which the collision integrals are tabulated to ab initio quantum mechanical calculations of the two-body interactions. The collision integrals are used to calculate the binary diffusion coefficients, viscosity, and 'total' thermal conductivity of the pure gases and the gas mixtures at 1-atm pressure from 1000 K to 25,000 K.
NASA Astrophysics Data System (ADS)
Zheng, J.; Zhu, J.; Wang, Z.; Fang, F.; Pain, C. C.; Xiang, J.
2015-10-01
An integrated method of advanced anisotropic hr-adaptive mesh and discretization numerical techniques has been, for first time, applied to modelling of multiscale advection-diffusion problems, which is based on a discontinuous Galerkin/control volume discretization on unstructured meshes. Over existing air quality models typically based on static-structured grids using a locally nesting technique, the advantage of the anisotropic hr-adaptive model has the ability to adapt the mesh according to the evolving pollutant distribution and flow features. That is, the mesh resolution can be adjusted dynamically to simulate the pollutant transport process accurately and effectively. To illustrate the capability of the anisotropic adaptive unstructured mesh model, three benchmark numerical experiments have been set up for two-dimensional (2-D) advection phenomena. Comparisons have been made between the results obtained using uniform resolution meshes and anisotropic adaptive resolution meshes. Performance achieved in 3-D simulation of power plant plumes indicates that this new adaptive multiscale model has the potential to provide accurate air quality modelling solutions effectively.
An analytical model of anisotropic low-field electron mobility in wurtzite indium nitride
NASA Astrophysics Data System (ADS)
Wang, Shulong; Liu, Hongxia; Song, Xin; Guo, Yulong; Yang, Zhaonian
2014-03-01
This paper presents a theoretical analysis of anisotropic transport properties and develops an anisotropic low-field electron analytical mobility model for wurtzite indium nitride (InN). For the different effective masses in the Γ-A and Γ-M directions of the lowest valley, both the transient and steady state transport behaviors of wurtzite InN show different transport characteristics in the two directions. From the relationship between velocity and electric field, the difference is more obvious when the electric field is low in the two directions. To make an accurate description of the anisotropic transport properties under low field, for the first time, we present an analytical model of anisotropic low-field electron mobility in wurtzite InN. The effects of different ionized impurity scattering models on the low-field mobility calculated by Monte Carlo method (Conwell-Weisskopf and Brooks-Herring method) are also considered.
Anisotropic colloidal transport and periodic stick-slip motion in cholesteric finger textures.
Chen, Kui; Metcalf, Linnea P; Rivas, David P; Reich, Daniel H; Leheny, Robert L
2015-06-01
We have investigated the mobility of discoidal colloidal particles sedimenting within cholesteric finger textures formed by mixtures of the nematic liquid crystal 4-cyano-4'-pentylbiphenyl (5CB) and the chiral dopant 4-(2-methylbutyl)-4'-cyanobiphenyl (CB15) with cholesteric pitch p between 24 and 114 μm. The nickel disks, with radius 17 μm and thickness 300 nm, displayed varied transport behavior that depended on the size of the pitch and the orientation of the gravitational force with respect to the cholesteric axis. In textures with small pitch (p < 40 μm), the disks moved perpendicular to the axis irrespective of the orientation of gravity as a result of an elastic retarding force that prevented motion along the axis. In textures with larger pitch, the disks similarly moved perpendicular to the axis when the angle between the force and axis was large. When the angle was small, the disks displayed stick-slip motion caused by periodic yielding of the finger texture. A model considering viscous drag on the particles and the elastic energy cost of deforming the finger texture describes the stick-slip motion accurately. The effective drag viscosities obtained from the disk motion are anomalously large compared with those of pure nematic 5CB indicating a large contribution to the dissipation from the motion of disclinations in the texture in the vicinity of the translating disks. PMID:25875803
Souza, W.R.; Voss, C.I.
1987-01-01
The groundwater system in southern Oahu, Hawaii consists of a thick, areally extensive freshwater lens overlying a zone of transition to a thick saltwater body. This system is analyzed in cross section with a variable-density groundwater flow and solute transport model on a regional scale. The simulation is difficult, because the coastal aquifer system has a saltwater transition zone that is broadly dispersed near the discharge area, but is very sharply defined inland. Steady-state simulation analysis of the transition zone in the layered basalt aquifer of southern Oahu indicates that a small transverse dispersivity is characteristic of horizontal regional flow. Further, in this system flow is generally parallel to isochlors and steady-state behavior is insensitive to the longitudinal dispersivity. Parameter analysis identifies that only six parameters control the complex hydraulics of the system: horizontal and vertical hydraulic conductivity of the basalt aquifer; hydraulic conductivity of the confining "caprock" layer; leakance below the caprock; specific yield; and aquifer matrix compressibility. The best-fitting models indicate the horizontal hydraulic conductivity is significantly greater than the vertical hydraulic conductivity. These models give values for specific yield and aquifer compressibility which imply a considerable degree of compressive storage in the water table aquifer. ?? 1987.
Crystal growth and anisotropic thermal properties of the nonlinear and polar oxide Cs2TeW3O12
NASA Astrophysics Data System (ADS)
Feng, Jiang-He; Xiang, Xu; Mao, Jiang-Gao
2015-12-01
Large crystal of the nonlinear optical and polar oxide Cs2TeW3O12 with a size of 20×15×4 mm3 has been grown by the top-seeded solution growth (TSSG) method. This crystal can be thermally stable up to 808 °C and melts incongruently. It possesses a large transparent range of 0.415-5.250 μm. Thermal properties, including thermal expansion, specific heat, thermal diffusivity and thermal conductivity were investigated. The average linear thermal expansion coefficients were calculated based on the measurement in the temperature range of 30-390 °C. It exhibits strong anisotropic thermal expansion which was discussed according to the relationships between the structure and thermal properties. Furthermore, laser-induced damage threshold has been estimated to be 591.28 MW/cm2 with a laser wavelength of 1064 nm and pulse duration of 8 ns.
Anisotropic charge transport in large single crystals of π-conjugated organic molecules.
Hourani, Wael; Rahimi, Khosrow; Botiz, Ioan; Koch, Felix Peter Vinzenz; Reiter, Günter; Lienerth, Peter; Heiser, Thomas; Bubendorff, Jean-Luc; Simon, Laurent
2014-05-01
The electronic properties of organic semiconductors depend strongly on the nature of the molecules, their conjugation and conformation, their mutual distance and the orientation between adjacent molecules. Variations of intramolecular distances and conformation disturb the conjugation and perturb the delocalization of charges. As a result, the mobility considerably decreases compared to that of a covalently well-organized crystal. Here, we present electrical characterization of large single crystals made of the regioregular octamer of 3-hexyl-thiophene (3HT)8 using a conductive-atomic force microscope (C-AFM) in air. We find a large anisotropy in the conduction with charge mobility values depending on the crystallographic orientation of the single crystal. The smaller conduction is in the direction of π-π stacking (along the long axis of the single crystal) with a mobility value in the order of 10(-3) cm(2) V(-1) s(-1), and the larger one is along the molecular axis (in the direction normal to the single crystal surface) with a mobility value in the order of 0.5 cm(2) V(-1) s(-1). The measured current-voltage (I-V) curves showed that along the molecular axis, the current followed an exponential dependence corresponding to an injection mode. In the π-π stacking direction, the current exhibits a space charge limited current (SCLC) behavior, which allows us to estimate the charge carrier mobility. PMID:24658783
Tian, Xiaojuan; Itkis, Mikhail E.; Bekyarova, Elena B.; Haddon, Robert C.
2013-01-01
Thermal interface materials (TIMs) are crucial components of high density electronics and the high thermal conductivity of graphite makes this material an attractive candidate for such applications. We report an investigation of the in-plane and through-plane electrical and thermal conductivities of thin thermal interface layers of graphite nanoplatelet (GNP) based composites. The in-plane electrical conductivity exceeds its through-plane counterpart by three orders of magnitude, whereas the ratio of the thermal conductivities is about 5. Scanning electron microscopy reveals that the anisotropy in the transport properties is due to the in-plane alignment of the GNPs which occurs during the formation of the thermal interface layer. Because the alignment in the thermal interface layer suppresses the through-plane component of the thermal conductivity, the anisotropy strongly degrades the performance of GNP-based composites in the geometry required for typical thermal management applications and must be taken into account in the development of GNP-based TIMs.
Charge Transport Properties in Polymer Brushes
NASA Astrophysics Data System (ADS)
Moog, Mark; Tsui, Frank; Vonwald, Ian; You, Wei
Electrical transport properties in poly(3-methyl)thiophene (P3MT) brushes have been studied. The P3MT brushes correspond to a new type of surface-tethered, vertically oriented conjugated molecular wires, sandwiched between two metallic electrodes to form the electrode-molecule-electrode (EME) devices. P3MT is a highly conjugated polymer, a ''workhorse'' material for organic electronics and photonics. The P3MT brushes were grown on ITO surfaces with controlled length (between 2 and 100 nm). The top electrodes were transfer-printed Au films with lateral dimensions between 200 nm and 50 μm. I-V and differential conductance measurements were performed using conductive AFM and 4-terminal techniques. Tunneling and field-emission measurements in EME devices with molecular lengths < 5 nm show HOMO mediated direct hole tunneling with energy barriers of 0.3 and 0.5 eV at the respective interfaces with ITO and Au. The transport properties in longer brushes are indicative of the two quasi-Ohmic interfaces with a characteristic offset in the conductance minimum of 0.12 V biased toward the ITO. Temperature dependent parameters have been examined at various molecular lengths. The drift mobility and the interplay between intra- and intermolecular transport have been investigated.
Thermodynamic and transport properties of gaseous tetrafluoromethane in chemical equilibrium
NASA Technical Reports Server (NTRS)
Hunt, J. L.; Boney, L. R.
1973-01-01
Equations and in computer code are presented for the thermodynamic and transport properties of gaseous, undissociated tetrafluoromethane (CF4) in chemical equilibrium. The computer code calculates the thermodynamic and transport properties of CF4 when given any two of five thermodynamic variables (entropy, temperature, volume, pressure, and enthalpy). Equilibrium thermodynamic and transport property data are tabulated and pressure-enthalpy diagrams are presented.
Ortiz, Aurélie U; Boutin, Anne; Fuchs, Alain H; Coudert, François-Xavier
2012-11-01
We performed ab initio calculations of the elastic constants of five flexible metal-organic frameworks (MOFs): MIL-53(Al), MIL-53(Ga), MIL-47, and the square and lozenge structures of DMOF-1. Tensorial analysis of the elastic constants reveals a highly anisotropic elastic behavior, some deformation directions exhibiting very low Young's modulus and shear modulus. This anisotropy can reach a 400:1 ratio between the most rigid and weakest directions, in stark contrast to the case of nonflexible MOFs such as MOF-5 and ZIF-8. In addition, we show that flexible MOFs can display extremely large negative linear compressibility. These results uncover the microscopic roots of stimuli-induced structural transitions in flexible MOFs, by linking the local elastic behavior of the material and its multistability. PMID:23215398
Anisotropic optical properties of semipolar AlGaN layers grown on m-plane sapphire
NASA Astrophysics Data System (ADS)
Feneberg, Martin; Winkler, Michael; Klamser, Juliane; Stellmach, Joachim; Frentrup, Martin; Ploch, Simon; Mehnke, Frank; Wernicke, Tim; Kneissl, Michael; Goldhahn, Rüdiger
2015-05-01
The valence band order of AlxGa 1 -x N is investigated experimentally by analyzing the anisotropic dielectric functions of semipolar (11 2 ¯ 2 ) AlGaN thin films grown on m-plane Al2O3. Point-by-point fitted dielectric functions are obtained by spectroscopic ellipsometry and corresponding inter-band transition energies are extracted. The known strain situation of the sample layers is used to correct for the small strain-induced energy shifts within k . p perturbation theory. It also is used to identify transitions related to the three valence bands. Transitions with E ⊥ c from the Γ9 valence band verify an inter-band bowing parameter of b =0.9 eV . The transitions with E || c allow determining the crystal field splitting energy which can be described by a linear interpolation between the values for GaN and AlN satisfactorily.
Gorelikov, G. A.; Fridman, Yu. A.
2013-07-15
The spectra of coupled magnetoelastic waves in a semi-infinite strongly anisotropic easy-plane ferromagnet with a rigidly fixed face are analyzed for two variants of fixation (in the basal plane and perpendicularly to it). The phase states of the system are determined. Differences in the phase diagrams and elementary excitation spectra depending on the choice of the sample fixation plane are considered. When rotational invariance is taken into account, the nonreciprocity effect for the velocities of sound in a crystal appears. It is shown that the velocity of sound in the sample considerably depends on the symmetry of the imposed mechanical boundary conditions. The phase diagrams of the system under investigation are presented.
Anisotropic Hydraulic Permeability Under Finite Deformation
Ateshian, Gerard A.; Weiss, Jeffrey A.
2011-01-01
The structural organization of biological tissues and cells often produces anisotropic transport properties. These tissues may also undergo large deformations under normal function, potentially inducing further anisotropy. A general framework for formulating constitutive relations for anisotropic transport properties under finite deformation is lacking in the literature. This study presents an approach based on representation theorems for symmetric tensor-valued functions and provides conditions to enforce positive semi-definiteness of the permeability or diffusivity tensor. Formulations are presented which describe materials that are orthotropic, transversely isotropic, or isotropic in the reference state, and where large strains induce greater anisotropy. Strain-induced anisotropy of the permeability of a solid-fluid mixture is illustrated for finite torsion of a cylinder subjected to axial permeation. It is shown that, in general, torsion can produce a helical flow pattern, rather than the rectilinear pattern observed when adopting a more specialized, unconditionally isotropic spatial permeability tensor commonly used in biomechanics. The general formulation presented in this study can produce both affine and non-affine reorientation of the preferred directions of material symmetry with strain, depending on the choice of material functions. This study addresses a need in the biomechanics literature by providing guidelines and formulations for anisotropic strain-dependent transport properties in porous-deformable media undergoing large deformations. PMID:21034145
Banai, R. E.; Brownson, J. R. S.; Burton, L. A.; Walsh, A.; Choi, S. G. To, B.; Hofherr, F.; Sorgenfrei, T.; Cröll, A.
2014-07-07
We report on the anisotropic optical properties of single-crystal tin monosulfide (SnS). The components ε{sub a}, ε{sub b}, and ε{sub c} of the pseudodielectric-function tensor (ε)=(ε₁)+i(ε₂) spectra are taken from 0.73 to 6.45 eV by spectroscopic ellipsometry. The measured (ε) spectra are in a good agreement with the results of the calculated dielectric response from hybrid density functional theory. The (ε) spectra show the direct band-gap onset and a total of eight above-band-gap optical structures that are associated with the interband-transition critical points (CPs). We obtain accurate CP energies by fitting analytic CP expressions to second-energy-derivatives of the (ε) data. Their probable electronic origins and implications for photovoltaic applications are discussed.
NASA Astrophysics Data System (ADS)
Ozyar, U. F.; Deligoz, E.; Colakoglu, K.
2015-02-01
The anisotropic elastic properties of XYSb (X = Ti, Zr, Hf; Y = Si, Ge) compounds have been investigated by using first-principles calculations based on density functional theory. The calculated lattice parameters are in excellent agreement with the available experimental data. The computed elastic constants indicate that all compounds are mechanically stable according to the elastic stability criteria under pressure. We have calculated the bulk modulus, shear modulus, Young's modulus, Poisson's ratio, Debye temperature, and anisotropy value from the obtained elastic constants according to the Voigt-Reuss-Hill approximation. Additionally, the ductility and brittleness are characterized with the estimation from Pugh's rule (B/G) and Poisson's ratio. Furthermore, the elastic anisotropy have been visualized in detail by plotting the directional dependence of compressibility, Young's and shear moduli.
Electronic transport properties of silicon clusters
NASA Astrophysics Data System (ADS)
Matsuura, Yukihito
2016-02-01
The electronic transport properties of silicon clusters were examined via theoretical calculations using the first-principles method. Additionally, p-type doping and n-type doping were analyzed by calculating conductance and current of boron- and phosphorus-doped silicon clusters. The p-type doping and n-type doping provided a new transmission peak at an energy level around the Fermi level to increase conductance. Furthermore, simultaneous boron and phosphorus doping resulted in noticeable rectifying characteristics, with the current drive in forward bias being three times higher than that in the reverse bias. A p-n junction was achieved even on a molecular scale.
Effect of Transmural Transport Properties on Atheroma Plaque Formation and Development.
Cilla, M; Martínez, M A; Peña, E
2015-07-01
We propose a mathematical model of atheroma plaque initiation and early development in coronary arteries using anisotropic transmural diffusion properties. Our current approach is on the process on plaque initiation and intimal thickening rather than in severe plaque progression and rupture phenomena. The effect of transport properties, in particular the anisotropy of diffusion properties of the artery, on plaque formation and development is investigated using the proposed mathematical model. There is not a strong influence of the anisotropic transmural properties on LDL, SMCs and collagen distribution and concentrations along the artery. On the contrary, foam cells distribution strongly depends on the value of the radial diffusion coefficient of the substances [Formula: see text] and the ratio [Formula: see text]. Decreasing [Formula: see text] or diffusion coefficients ratio means a higher concentration of the foam cells close to the intima. Due to the fact that foam cells concentration is associated to the necrotic core formation, the final distribution of foam cells is critical to evolve into a vulnerable or fibrotic plaque. PMID:25814436
NASA Astrophysics Data System (ADS)
Bobashev, S. V.; Popov, P. A.; Reznikov, B. I.; Sakharov, V. A.
2016-05-01
Thermal and thermoelectric processes in anisotropic heat elements located on substrates made of different materials have been numerically simulated. It is shown that, when an invariable heat flux passes through a heat element, the thermophysical properties of the substrate and heat transfer coefficient at its rear surface affect significantly the temperature distribution and the value of generated thermal emf.
Electronic, transport, and optical properties of bulk and mono-layer PdSe_{2}
Sun, Jifeng; Shi, Hongliang; Siegrist, Theo; Singh, David J.
2015-10-13
In this study, the electronic and optical properties of bulk and monolayer PdSe_{2} are investigated using firstprinciples calculations. Using the modified Becke-Johnson potential, we find semiconductor behavior for both bulk and monolayer PdSe_{2} with indirect gap values of 0.03 eV for bulk and 1.43 eV for monolayer, respectively. Our sheet optical conductivity results support this observation and show similar anisotropic feature in the 2D plane. We further study the thermoelectric properties of the 2D PdSe_{2} using Blotzmann transport model and find interestingly high Seebeck coefficients (>200 μV/K) for both p- and n-type up to high doping level (–2 x 10^{13} cm^{2}) with an anisotropic character in an electrical conductivity suggesting better thermoelectric performance along y direction in the plane.V
NMR Properties of the Polar Phase of Superfluid ^3He in Anisotropic Aerogel Under Rotation
NASA Astrophysics Data System (ADS)
Mineev, V. P.
2016-09-01
The polar phase of superfluid ^3He is stable in "nematically ordered" densed aerogel. A rotating vessel with the polar superfluid can be filled either by an array of the single quantum vortices or by an array of the half-quantum vortices. It is shown that the inhomogeneous distribution of the spin part of the order parameter arising in an array of half-quantum vortices in strong enough magnetic field tilted to the average direction of aerogel strands leads to the appearance of a satellite in the NMR signal shifted in the negative direction with respect to the Larmor frequency. The satellite is absent in the case of an array of single quantum vortices which allows to distinguish these two configurations. The polar state in the anisotropic aerogel with lower density transforms at lower temperatures to the axipolar state. The array of half-quantum vortices created in the polar phase keeps its structure under transition to the axipolar state. The temperature dependence of the vortex-satellite NMR frequency is found to be slower below the transition temperature to the axipolar state.
NMR Properties of the Polar Phase of Superfluid ^3 He in Anisotropic Aerogel Under Rotation
NASA Astrophysics Data System (ADS)
Mineev, V. P.
2016-04-01
The polar phase of superfluid ^3 He is stable in "nematically ordered" densed aerogel. A rotating vessel with the polar superfluid can be filled either by an array of the single quantum vortices or by an array of the half-quantum vortices. It is shown that the inhomogeneous distribution of the spin part of the order parameter arising in an array of half-quantum vortices in strong enough magnetic field tilted to the average direction of aerogel strands leads to the appearance of a satellite in the NMR signal shifted in the negative direction with respect to the Larmor frequency. The satellite is absent in the case of an array of single quantum vortices which allows to distinguish these two configurations. The polar state in the anisotropic aerogel with lower density transforms at lower temperatures to the axipolar state. The array of half-quantum vortices created in the polar phase keeps its structure under transition to the axipolar state. The temperature dependence of the vortex-satellite NMR frequency is found to be slower below the transition temperature to the axipolar state.
Transport properties of epitaxial lift off films
NASA Technical Reports Server (NTRS)
Mena, R. A.; Schacham, S. E.; Young, P. G.; Haugland, E. J.; Alterovitz, S. A.
1993-01-01
Transport properties of epitaxially lifted-off (ELO) films were characterized using conductivity, Hall, and Shubnikov-de Haas measurements. A 10-15 percent increase in the 2D electron gas concentration was observed in these films as compared with adjacent conventional samples. We believe this result to be caused by a backgating effect produced by a charge build up at the interface of the ELO film and the quartz substrate. This increase results in a substantial decrease in the quantum lifetime in the ELO samples, by 17-30 percent, but without a degradation in carrier mobility. Under persistent photoconductivity, only one subband was populated in the conventional structure, while in the ELO films the population of the second subband was clearly visible. However, the increase of the second subband concentration with increasing excitation is substantially smaller than anticipated due to screening of the backgating effect.
Electronic transport properties of (fluorinated) metal phthalocyanine
NASA Astrophysics Data System (ADS)
Fadlallah, M. M.; Eckern, U.; Romero, A. H.; Schwingenschlögl, U.
2016-01-01
The magnetic and transport properties of the metal phthalocyanine (MPc) and F16MPc (M = Sc, Ti, V, Cr, Mn, Fe, Co, Ni, Cu, Zn and Ag) families of molecules in contact with S-Au wires are investigated by density functional theory within the local density approximation, including local electronic correlations on the central metal atom. The magnetic moments are found to be considerably modified under fluorination. In addition, they do not depend exclusively on the configuration of the outer electronic shell of the central metal atom (as in isolated MPc and F16MPc) but also on the interaction with the leads. Good agreement between the calculated conductance and experimental results is obtained. For M = Ag, a high spin filter efficiency and conductance is observed, giving rise to a potentially high sensitivity for chemical sensor applications.
Transport properties of quark and gluon plasmas
Heiselberg, H.
1993-12-01
The kinetic properties of relativistic quark-gluon and electron-photon plasmas are described in the weak coupling limit. The troublesome Rutherford divergence at small scattering angles is screened by Debye screening for the longitudinal or electric part of the interactions. The transverse or magnetic part of the interactions is effectively screened by Landau damping of the virtual photons and gluons transferred in the QED and QCD interactions respectively. Including screening a number of transport coefficients for QCD and QED plasmas can be calculated to leading order in the interaction strength, including rates of momentum and thermal relaxation, electrical conductivity, viscosities, flavor and spin diffusion of both high temperature and degenerate plasmas. Damping of quarks and gluons as well as color diffusion in quark-gluon plasmas is, however, shown not to be sufficiently screened and the rates depends on an infrared cut-off of order the ``magnetic mass,`` m{sub mag} {approximately} g{sup 2}T.
Transport properties of strontium titanate niobates
Podkorytov, A.L.; Pantyukhina, M.I.; Zhukovskii, V.M.
1995-08-01
In this work the authors studied transport properties of Sr{sub 3}NiNb{sub 2}O{sub 10} and Sr{sub 6-x}Ti{sub x}Nb{sub 2}O{sub 11+x} in order to develop views concerning their high-temperature behavior and mechanisms of disordering in their structures. The authors measured the electrical conductivity (f+1 kHz, RLC meter, 500-1300{degrees}C) and the effective self-diffusion coefficients of radionuclides {sup 90}Sr, {sup 44}Ti, and {sup 95}Nb using radiometric depth profiling (RKB-4IeM {beta}-radiometer) of ceramic samples (porosity no greater than 10%), as described. The samples with radionuclides applied to their faces were annealed in the range 1270-1470 K for 24-100 h. The error in the diffusion coefficients thus measured did not exceed 20%.
NASA Astrophysics Data System (ADS)
Min, Byunghoon; An, Chan-Yong; Kim, Chang-Bae; Lee, Gun Bok
2015-04-01
Fluxes of both the vorticity and the plasma density due to the nonlinear E × B convective derivatives are divided into two parts. One part, which is almost isotropic, is well known to engage in the transfer of energies from the energy-producing scale where the phase mismatch between the density and the electric potential is large. The other part, in the Fourier space , is found to be highly anisotropic. If it is summed over k y , the result is nearly random around zero in k x while the sum over k x is approximately proportional to k y . In Fourier space, such anisotropic fluxes are found to be closely related to the gradients of the squares of the vorticity and the electric potential, respectively. We argue that the advecting velocities in Fourier space may be predicted on dimensional grounds.
Theoretical study on transport properties of topological states of matter
NASA Astrophysics Data System (ADS)
Hsu, Hsiu-Chuan
In condensed matter physics, states of matter are usually classified by symmetry. Topological states of matter describe new quantum states of matter that cannot adiabatically connect to conventional states of matter even though they share the same symmetry. Thus, the discovery of topological states of matter has opened a new research era and attracted intensive research interests in recent years. This dissertation is devoted to the theoretical and numerical study of transport properties of topological states of matter, mainly focusing on two topological systems, time reversal invariant topological insulator nano-structures and the quantum anomalous Hall insulators. The first system studied in this dissertation is time reversal invariant topological insulator, which is an insulating material behaving as an insulator in its interior but with conducting channels on its surface. The conducting surface states of a topological insulator are known as "helical states" due to the spin texture in the momentum space and protected by time reversal symmetry. Helical surface states have been observed in surface sensitive experiments, such as angular-resolved photon emission spectroscopy and scanning tunneling microscopy. However, signatures of topological surface states in transport measurements are complicated by the dominating conduction from bulk channels and strong disorder effect. Therefore, in this dissertation, we numerically study transport in disordered topological insulator nano-structures, e.g. nanowires and nanotubes, which possess a larger surfaceto-volume ratio compared to bulk systems. For a topological insulator nanowire, it is found that a gapless mode with linear dispersion, which is refered to as a topological state in the main text, arises when a half-integer magnetic flux quantum is inserted along the nanowire. We find that topological states possess a longer localization length than other non-topological states. Thus, for a long nanowire or nanotube, a
Anisotropic elastic properties of MB (M = Cr, Mo, W) monoborides: a first-principles investigation
NASA Astrophysics Data System (ADS)
Li, Run-Yue; Duan, Yong-Hua
2016-04-01
First principles calculations were performed to systematically investigate structure properties, phase stability and mechanical properties of MB (M = Cr, Mo, W) monoborides in orthorhombic and tetragonal structures. The results of equilibrium structures are in good agreement with other available theoretical and experimental data. The elastic properties, including bulk modulus B, shear modulus G, Young's modulus E and Poisson's ratio ν were calculated by the Voigt-Reuss-Hill approximation. All considered monoborides are mechanically stable. The results of elastic anisotropies show that elastic anisotropy of orthorhombic structure is larger than that of tetragonal structure. Moreover, the minimum thermal conductivities were also estimated using the Cahill's model, and the results indicate that the minimum thermal conductivities show a dependence on directions.
Structural and magnetic properties of an anisotropic M-type LaCo-substituted strontium hexaferrite
NASA Astrophysics Data System (ADS)
Tyrman, Muriel; Pasko, Alexandre; De La Barrière, Olivier; Mazaleyrat, Frédéric
2015-11-01
Rare-earth-free permanent magnets returned to the forefront of scientific and technological concerns about the environmental and economical issues. The emergence of new markets, control of costs and availability of raw materials encourage to look for alternative materials containing much less, or no, rare earth elements selected from the most common and most available. The hexaferrite doped with lanthanum and cobalt present interesting properties to succeed the rare-earth magnets. The structural and magnetic properties of a strontium hexaferrite are presented in this paper, and two models are developed in order to correlate structural and magnetic properties. Contribution to the topical issue "Electrical Engineering Symposium (SGE 2014)", edited by Adel Razek
Transport properties of supercooled confined water
NASA Astrophysics Data System (ADS)
Mallamace, F.; Branca, C.; Broccio, M.; Corsaro, C.; Gonzalez-Segredo, N.; Spooren, J.; Stanley, H. E.; Chen, S.-H.
2008-07-01
This article presents an overview of recent experiments performed on transport properties of water in the deeply supercooled region, a temperature region of fundamental importance in the science of water. We report data of nuclear magnetic resonance, quasi-elastic neutron scattering, Fourier-transform infrared spectroscopy, and Raman spectroscopy, studying water confined in nanometer-scale environments. When contained within small pores, water does not crystallise, and can be supercooled well below its homogeneous nucleation temperature Th. On this basis it is possible to carry out a careful analysis of the well known thermodynamical anomalies of water. Studying the temperature and pressure dependencies of water dynamics, we show that the liquid-liquid phase transition (LLPT) hypothesis represents a reliable model for describing liquid water. In this model, water in the liquid state is a mixture of two different local structures, characterised by different densities, namely the low density liquid (LDL) and the high-density liquid (HDL). The LLPT line should terminate at a special transition point: a low-T liquid-liquid critical point. We discuss the following experimental findings on liquid water: (i) a crossover from non-Arrhenius behaviour at high T to Arrhenius behaviour at low T in transport parameters; (ii) a breakdown of the Stokes-Einstein relation; (iii) the existence of a Widom line, which is the locus of points corresponding to maximum correlation length in the p-T phase diagram and which ends in the liquid-liquid critical point; (iv) the direct observation of the LDL phase; (v) a minimum in the density at approximately 70 K below the temperature of the density maximum. In our opinion these results represent the experimental proofs of the validity of the LLPT hypothesis.
Friedel, Michael J.
2001-01-01
This report describes a model for simulating transient, Variably Saturated, coupled water-heatsolute Transport in heterogeneous, anisotropic, 2-Dimensional, ground-water systems with variable fluid density (VST2D). VST2D was developed to help understand the effects of natural and anthropogenic factors on quantity and quality of variably saturated ground-water systems. The model solves simultaneously for one or more dependent variables (pressure, temperature, and concentration) at nodes in a horizontal or vertical mesh using a quasi-linearized general minimum residual method. This approach enhances computational speed beyond the speed of a sequential approach. Heterogeneous and anisotropic conditions are implemented locally using individual element property descriptions. This implementation allows local principal directions to differ among elements and from the global solution domain coordinates. Boundary conditions can include time-varying pressure head (or moisture content), heat, and/or concentration; fluxes distributed along domain boundaries and/or at internal node points; and/or convective moisture, heat, and solute fluxes along the domain boundaries; and/or unit hydraulic gradient along domain boundaries. Other model features include temperature and concentration dependent density (liquid and vapor) and viscosity, sorption and/or decay of a solute, and capability to determine moisture content beyond residual to zero. These features are described in the documentation together with development of the governing equations, application of the finite-element formulation (using the Galerkin approach), solution procedure, mass and energy balance considerations, input requirements, and output options. The VST2D model was verified, and results included solutions for problems of water transport under isohaline and isothermal conditions, heat transport under isobaric and isohaline conditions, solute transport under isobaric and isothermal conditions, and coupled water
Dynamics of Anisotropic Universes
NASA Astrophysics Data System (ADS)
Perez, Jérôme
2006-11-01
We present a general study of the dynamical properties of Anisotropic Bianchi Universes in the context of Einstein General Relativity. Integrability results using Kovalevskaya exponents are reported and connected to general knowledge about Bianchi dynamics. Finally, dynamics toward singularity in Bianchi type VIII and IX universes are showed to be equivalent in some precise sence.
Hydrostatic pressure effect on charge transport properties of phenacene organic semiconductors.
Nguyen, Thao P; Shim, Ji Hoon
2016-05-18
We investigate the charge transport properties of phenacene organic semiconductors including phenanthrene, chrysene and picene using density functional theory (DFT) calculations under hydrostatic pressure. Under compression, the crystal structures of the three materials are altered and thus, a decrease in the intermolecular distances gives changes in charge transport properties while the molecular structures remain stable. As a result of the applied pressure, the mobilities of these materials increase dramatically. Chrysene shows a transition from a p-type semiconductor to an ambipolar semiconductor at around 2.0 GPa. Interestingly, chrysene favors electron transport at above 3.0 GPa. On the other hand, both phenanthrene and picene exhibit hole transport characteristics under high pressure. Between 3.1 and 4.3 GPa, the picene crystal is found to transform from an anisotropic mobility to an isotropic mobility in the ab plane. We also found that, the bulk modulus representing the resistance of the material under pressure compression follows a linear relationship with molecular length. PMID:27146786
NASA Astrophysics Data System (ADS)
Kulyk, M. M.; Kalita, V. M.; Lozenko, A. F.; Ryabchenko, S. M.; Stognei, O. V.; Sitnikov, A. V.; Korenivski, V.
2014-08-01
Magnetic properties of nanogranular ferromagnetic Co/Al2O3 films with 74.5 at% Co, which is above the percolation limit, are investigated. It is established that the films have perpendicular magnetic anisotropy and a weaker in-plane anisotropy. The magnetization curves show that the film consists of two magnetic components: a dominating contribution from magneto-anisotropic isolated grains with the anisotropy axis perpendicular to the film plane and a weaker contribution from the percolated part of the film. This two-component magnetic composition of the films, with the dominating contribution from the nanograins, is confirmed by transmission electron microscopy as well as by ferromagnetic resonance spectroscopy. It is further established that the coercive field of the film is almost entirely determined by the percolated part of the film. In this, the angular dependence of the coercive force, Hc (θH), is essentially proportional to sin-1θH, where θH is the angle between the applied field and the film's normal. However, for θH → 0, Hc (θH) there is a narrow minimum with Hc approaching zero. Such non-linear dependence agrees well with our modelling results for a two-component magnetic system of the film, where the non-percolated nanograins have a distinct perpendicular anisotropy. The reported results should be important for in-depth characterization and understanding the magnetism and anisotropy in inhomogeneous systems as well as for applications, specifically in perpendicular magnetic recording.
NASA Astrophysics Data System (ADS)
Lam, Wai Sze Tiffany
Optical components made of anisotropic materials, such as crystal polarizers and crystal waveplates, are widely used in many complex optical system, such as display systems, microlithography, biomedical imaging and many other optical systems, and induce more complex aberrations than optical components made of isotropic materials. The goal of this dissertation is to accurately simulate the performance of optical systems with anisotropic materials using polarization ray trace. This work extends the polarization ray tracing calculus to incorporate ray tracing through anisotropic materials, including uniaxial, biaxial and optically active materials. The 3D polarization ray tracing calculus is an invaluable tool for analyzing polarization properties of an optical system. The 3x3 polarization ray tracing P matrix developed for anisotropic ray trace assists tracking the 3D polarization transformations along a ray path with series of surfaces in an optical system. To better represent the anisotropic light-matter interactions, the definition of the P matrix is generalized to incorporate not only the polarization change at a refraction/reflection interface, but also the induced optical phase accumulation as light propagates through the anisotropic medium. This enables realistic modeling of crystalline polarization elements, such as crystal waveplates and crystal polarizers. The wavefront and polarization aberrations of these anisotropic components are more complex than those of isotropic optical components and can be evaluated from the resultant P matrix for each eigen-wavefront as well as for the overall image. One incident ray refracting or reflecting into an anisotropic medium produces two eigenpolarizations or eigenmodes propagating in different directions. The associated ray parameters of these modes necessary for the anisotropic ray trace are described in Chapter 2. The algorithms to calculate the P matrix from these ray parameters are described in Chapter 3 for
Magnetic properties of cubic FeCo nanoparticles with anisotropic long chain structure
NASA Astrophysics Data System (ADS)
Liu, Jinming; Wu, Kai; Wang, Jian-Ping
2016-05-01
Cubic FeCo alloy nanoparticles (NPs) with body-centered cubic (bcc) phase were prepared using sputter based gas-condensation method. When the NPs formed long chain assemblies, the magnetic properties were quite different from that of well-dispersed NPs. Most of the well-dispersed NPs were superparamagnetic at room temperature while the long chain NP assemblies were ferromagnetic with coercivities around 765 Oe, which displayed quite different magnetic properties. The ferromagnetism of long chain NPs was from the exchange coupling between NPs, which eventually led to the transition from superparamagnetism (SPM) to superferromagetism (SFM). Zero-field-cooled (ZFC) and field-cooled (FC) curves were obtained and long chain NP assemblies displayed ferromagnetism at the temperature ranging from 10 K to 400 K. Time-dependent remanent magnetic moment curves also indicated that the long chain structure had better thermal stability due to the strong exchange coupling.
Transport properties of alkali metal doped fullerides
Yadav, Daluram Yadav, Nishchhal
2015-07-31
We have studied the intercage interactions between the adjacent C{sub 60} cages and expansion of lattice due to the intercalation of alkali atoms based on the spring model to estimate phonon frequencies from the dynamical matrix for the intermolecular alkali-C{sub 60} phonons. We considered a two-peak model for the phonon density of states to investigate the nature of electron pairing mechanism for superconducting state in fullerides. Coulomb repulsive parameter and the electron phonon coupling strength are obtained within the random phase approximation. Transition temperature, T{sub c}, is obtained in a situation when the free electrons in lowest molecular orbital are coupled with alkali-C{sub 60} phonons as 5 K, which is much lower as compared to reported T{sub c} (20 K). The superconducting pairing is mainly driven by the high frequency intramolecular phonons and their effects enhance it to 22 K. The importance of the present study, the pressure effect and normal state transport properties are calculated within the same model leading superconductivity.
Transport properties of alkali metal doped fullerides
NASA Astrophysics Data System (ADS)
Yadav, Daluram; Yadav, Nishchhal
2015-07-01
We have studied the intercage interactions between the adjacent C60 cages and expansion of lattice due to the intercalation of alkali atoms based on the spring model to estimate phonon frequencies from the dynamical matrix for the intermolecular alkali-C60 phonons. We considered a two-peak model for the phonon density of states to investigate the nature of electron pairing mechanism for superconducting state in fullerides. Coulomb repulsive parameter and the electron phonon coupling strength are obtained within the random phase approximation. Transition temperature, Tc, is obtained in a situation when the free electrons in lowest molecular orbital are coupled with alkali-C60 phonons as 5 K, which is much lower as compared to reported Tc (20 K). The superconducting pairing is mainly driven by the high frequency intramolecular phonons and their effects enhance it to 22 K. The importance of the present study, the pressure effect and normal state transport properties are calculated within the same model leading superconductivity.
Field-dependent anisotropic microrheological and microstructural properties of dilute ferrofluids.
Yendeti, Balaji; Thirupathi, G; Vudaygiri, Ashok; Singh, R
2014-08-01
We have measured microrheological and microstructural properties of a superparamagnetic ferrofluid made of Mn0.75Zn0.25Fe2O4 (MZF) nanoparticles, using passive microrheology in a home-built inverted microscope. Thermal motion of a probe microsphere was measured for different values of an applied external magnetic field and analysed. The analysis shows anisotropy in magneto-viscous effect. Additional microrheological properties, such as storage modulus and loss modulus and their transition are also seen. We have also obtained microstructural properties such as elongational flow coefficient [Formula: see text] , relaxation time constant [Formula: see text] , coefficient of dissipative magnetization [Formula: see text] , etc., using the analysis given in Oliver Muller et al., J. Phys.: Condens. Matter 18, S2623, (2006) and Stefan Mahle et al., Phys. Rev. E 77, 016305 (2008) over our measured viscosity data. Our values for the above parameters are in agreement with earlier theoretical calculations and macro-rheological experimental measurements. These theoretical calculations consider an ideal situation of zero-shear limit, which is best approximated only in the passive microrheology technique described here and a first time measurement of all these parameters with passive microrheology. PMID:25117500
Anisotropic metamaterial optical fibers.
Pratap, Dheeraj; Anantha Ramakrishna, S; Pollock, Justin G; Iyer, Ashwin K
2015-04-01
Internal physical structure can drastically modify the properties of waveguides: photonic crystal fibers are able to confine light inside a hollow air core by Bragg scattering from a periodic array of holes, while metamaterial loaded waveguides for microwaves can support propagation at frequencies well below cutoff. Anisotropic metamaterials assembled into cylindrically symmetric geometries constitute light-guiding structures that support new kinds of exotic modes. A microtube of anodized nanoporous alumina, with nanopores radially emanating from the inner wall to the outer surface, is a manifestation of such an anisotropic metamaterial optical fiber. The nanopores, when filled with a plasmonic metal such as silver or gold, greatly increase the electromagnetic anisotropy. The modal solutions in such anisotropic circular waveguides can be uncommon Bessel functions with imaginary orders. PMID:25968741
NASA Astrophysics Data System (ADS)
Hallberg, Håkan
2014-12-01
The present study elaborates on a 2D level set model of polycrystal microstructures that was recently established by adding the influence of anisotropic grain boundary energy and mobility on microstructure evolution. The new model is used to trace the evolution of grain boundary character distribution during grain growth. The employed level set formulation conveniently allows the grain boundary characteristics to be quantified in terms of coincidence site lattice (CSL) type per unit of grain boundary length, providing a measure of the distribution of such boundaries. In the model, both the mobility and energy of the grain boundaries are allowed to vary with misorientation. In addition, the influence of initial polycrystal texture is studied by comparing results obtained from a polycrystal with random initial texture against results from a polycrystal that initially has a cube texture. It is shown that the proposed level set formulation can readily incorporate anisotropic grain boundary properties and the simulation results further show that anisotropic grain boundary properties only have a minor influence on the evolution of CSL boundary distribution during grain growth. As anisotropic boundary properties are considered, the most prominent changes in the CSL distributions are an increase of general low-angle Σ1 boundaries as well as a more stable presence of Σ3 boundaries. The observations also hold for the case of an initially cube-textured polycrystal. The presence of this kind of texture has little influence over the evolution of the CSL distribution. Taking into consideration the anisotropy of grain boundary properties, grain growth alone does not seem to be sufficient to promote any significantly increased overall presence of CSL boundaries.
Boire, Adeline; Menut, Paul; Morel, Marie-Hélène; Sanchez, Christian
2015-04-30
In this Article, we investigated the interaction properties of wheat gliadins, properties that are at the basis of their functionality in wheat grain and in food matrixes. We established the equation of state of our isolate by osmotic compression and characterized the concentration-induced structural transitions, from the secondary structure of proteins to the rheological properties. We evidenced three thermodynamical regimes corresponding to several structuring regimes. First, for Φ < 0.03, gliadins behave as repulsive colloids, with a positive second virial coefficient, arising presumably from their surface charge density and/or their steric repulsion. No intermolecular interaction was detected by FT-IR, suggesting that proteins form a stable dispersion. In the second regime, the system becomes more easily compressible, i.e., less repulsive and/or more attractive. It is associated with the disappearance of β-sheet intramolecular structures of the proteins in favor of random coils/α-helix and intermolecular β-sheet interactions. This coincides with the appearance of elasticity and the increase of the apparent viscosity. Finally, in the last regime, for Φ > 0.16, FT-IR spectra show that proteins are strongly interacting via intermolecular interactions. A correlation peak develops in SAXS, revealing a global order in the dispersion. Interestingly, the osmotic pressure applied to extract the solvent is higher than expected from a hard-sphere-like protein and we highlighted a liquid-like state at very high concentration (>450 g L(-1)) which is in contrast with most proteins that form gel or glass at such concentration. In the discussion, we questioned the existence of supramolecular assemblies and the role of the solvation that would lead to this specific behavior. PMID:25839358
Isenberg, Brett C; Backman, Daniel E; Kinahan, Michelle E; Jesudason, Rajiv; Suki, Bela; Stone, Phillip J; Davis, Elaine C; Wong, Joyce Y
2012-03-15
For an arterial replacement graft to be effective, it must possess the appropriate strength in order to withstand long-term hemodynamic stress without failure, yet be compliant enough that the mismatch between the stiffness of the graft and the native vessel wall is minimized. The native vessel wall is a structurally complex tissue characterized by circumferentially oriented collagen fibers/cells and lamellar elastin. Besides the biochemical composition, the functional properties of the wall, including stiffness, depend critically on the structural organization. Therefore, it will be crucial to develop methods of producing tissues with defined structures in order to more closely mimic the properties of a native vessel. To this end, we sought to generate cell sheets that have specific ECM/cell organization using micropatterned polydimethylsiloxane (PDMS) substrates to guide cell organization and tissue growth. The patterns consisted of large arrays of alternating grooves and ridges. Adult bovine aortic smooth muscle cells cultured on these substrates in the presence of ascorbic acid produced ECM-rich sheets several cell layers thick in which both the cells and ECM exhibited strong alignment in the direction of the micropattern. Moreover, mechanical testing revealed that the sheets exhibited mechanical anisotropy similar to that of native vessels with both the stiffness and strength being significantly larger in the direction of alignment, demonstrating that the microscale control of ECM organization results in functional changes in macroscale material behavior. PMID:22177672
Akseli, I; Hancock, B C; Cetinkaya, C
2009-07-30
The mechanical property anisotropy of compacts made from four commercially available pharmaceutical excipient powders (microcrystalline cellulose, lactose monohydrate, ascorbic acid, and aspartame) was evaluated. The speed of pressure (longitudinal) waves in the uni-axially compressed cubic compacts of each excipient in the three principle directions was determined using a contact ultrasonic method. Average Young's moduli of each compact in the axial (x) and radial (y and z) directions were characterized. The contact ultrasonic measurements revealed that average Young's modulus values vary with different testing orientations which indicate Young's modulus anisotropy in the compacts. The extent of Young's modulus anisotropy was quantified by using a dimensionless ratio and was found to be significantly different for each material (microcrystalline cellulose>lactose>aspartame>ascorbic acid). It is also observed that using the presented contact method, compacts at high solid fraction (0.857-0.859) could be differentiated than those at the solid fraction of 0.85 in their groups. The presented contact ultrasonic method is an attractive tool since it has the advantages of being sensitive to solid fraction ratio, non-destructive, requiring small amount of material and rapid. It is noteworthy that, since the approach provides insight into the performance of common pharmaceutical materials and fosters increased process knowledge, it can be applied to broaden the understanding of the effect of the mechanical properties on the performance (e.g., disintegration profiles) of solid oral dosage forms. PMID:19426791
NASA Astrophysics Data System (ADS)
Ojeda, Oscar; Cagin, Tahir
2011-03-01
Localization of strain and changes under extreme conditions in energetic materials (EM) can cause runaway reactions and unexpected initiation. A clear understanding of the mechanical properties is a perquisite in understanding the interplay between mechanical, chemical and thermodynamic properties that relate sensitivity and EM's before they undergo initiation. We have conducted first principles ground state studies, complemented by atomistic calculations at elevated temperatures and pressures, for energetic commonly used secondary EM's with varying sensitivities. Chemical information found from ab intio methods, and from compression at elevated temperatures show that external conditions relevant to impact and shock behavior can have different effects on the studied systems. These range from changes in local conformation, changes in the hydrogen-bonding network, and more drastically to a full crystallographic transition in which the symmetry of the system undergoes a transformation. Due to the chemical, mechanical and thermodynamic level information that provides, multiscale modeling methods, can then be applied to the understanding of other type of systems and give a clearer understanding of the molecular processes that undergo energetic materials, prior to initiation. Laboratory of Computational Engineering of Nanomaterials.
Anisotropic magneto-optical properties of vanadium in Bi4Ge3O12
NASA Astrophysics Data System (ADS)
Petkova, P.
2016-07-01
The paper deals with the investigation of the magneto-optical effect and photochromism in vanadium doped Bi4Ge3O12 (BGO) single crystals in a wide spectral range. It has been found out that the photosensitivity of doped crystals is significantly shifted to the visible wavelengths. This investigation reports the experimental results of Faraday rotation in the case of vanadium doped Bi4Ge3O12. The rotation angle of the polarization plane of the crystal plate has been investigated in the magnetic field in an illuminated state, obtained by exposure with ultraviolet (UV) light and an annealed state developed after annealing at 400 °C. We have observed the strong appearance of vanadium impurity in the spectral range 380-700 nm. The experimental determination of magneto-optical properties of V4+ ions gives us an opportunity for calculation of the refractive index n of the doped BGO.
Thermodynamic properties of anisotropic spin ladder in a longitudinal magnetic field
NASA Astrophysics Data System (ADS)
Rezania, H.
2015-08-01
We address thermodynamic properties of quasi-one dimensional two leg antiferromagnetic ladder in the presence of magnetic field. A generalized bond operator formalism is used to transform the spin model to a hard core bosonic gas. We have implemented Green's function approach to obtain the temperature dependence of spin excitation spectrum in field induced spin polarized phase. The results show energy gap that vanishes at critical magnetic field for fixed values of temperatures. We have also found the temperature dependence of the specific heat and magnetization component in the magnetic field direction for various magnetic field strengths and anisotropies in the Heisenberg interactions on both leg and rung couplings. At low temperatures, the specific heat is found to be monotonically increasing with temperature for magnetic fields in the spin polarized phase region. Furthermore we studied the temperature dependence of the longitudinal magnetization for different magnetic field and anisotropy parameters.
Transport properties of graphene and its application
NASA Astrophysics Data System (ADS)
Lu, Jianming
This thesis focuses on the transport properties of graphene, a new emerging atomically thin, two-dimensional material, with and without the application of a magnetic field. Because of its high mobility, graphene is a promising candidate for Extraordinary Magnetoresistance (EMR) devices. The magnetoresistance of an EMR device arises mainly from its geometry rather than the intrinsic response of the material itself to an applied magnetic field. As a result, the geometric parameters play an important role in its performance. Experiments employing various combinations of geometric parameters and graphene of different quality levels were conducted to determine the optimal results. We found that the optimized parameters vary for different applied magnetic fields. In a magnetic field of 9 Tesla, magnetoresistance up to 55,000% was observed. In addition, Finite Element Analysis (FEA) simulations are used to complement the experiments and explain the measured magnetoresistance. The excellent agreement between the simulations and experimental results indicates that theoretical simulation can be used as a convenient method to explore EMR devices with alternative geometries or materials. The anomalous quantum Hall effect is one of the most exciting properties of graphene. The observation of the v=0 state above a critical magnetic field is closely related to the quality of the graphene, where a higher quality reduces the critical field needed. With our high quality graphene sample, the critical field is reduced to 6.75 Tesla. Moreover, from 6.75 T to 9T, the resistance at the cross point of the metal-insulator transition (MIT) is very close to h/2e2, which resembles the case of a disordered two-dimensional electron gas (2DEG) and may indicate a similar physical mechanism. In addition to the magnetotransport measurements, the current saturation of graphene in a high electric field is studied both theoretically and experimentally. This thesis focuses primarily on bilayer graphene
Neoclassical Transport Properties of Tokamak Plasmas
Weyssow, B.
2004-03-15
The classical transport theory is strictly valid for a plasma in a homogeneous and stationary magnetic field. In the '60, experiments have shown that this theory does not apply as a local theory of transport in Tokamaks. It was shown that global geometric characteristics of the confining elements have a strong influence on the transport. Three regimes of collisionality are characteristic of the neoclassical transport theory: the banana regime (the electronic diffusion coefficient increases starting from zero), the plateau regime (the diffusion coefficient is almost independent of the collisionality) and the Pfirsch-Schlueter regime (the electronic diffusion coefficient again increases with the collisionality)
Wang, Christopher C-B.; Chahine, Nadeen O.; Hung, Clark T.; Ateshian, Gerard A.
2010-01-01
The precise nature of the material symmetry of articular cartilage in compression remains to be elucidated. The primary objective of this study was to determine the equilibrium compressive Young’s moduli and Poisson’s ratios of bovine cartilage along multiple directions (parallel and perpendicular to the split line direction, and normal to the articular surface) by loading small cubic specimens (0.9×0.9×0.8 mm, n=15) in unconfined compression, with the expectation that the material symmetry of cartilage could be determined more accurately with the help of a more complete set of material properties. The second objective was to investigate how the tension-compression nonlinearity of cartilage might alter the interpretation of material symmetry. Optimized digital image correlation was used to accurately determine the resultant strain fields within the specimens under loading. Experimental results demonstrated that neither the Young’s moduli nor the Poisson’s ratios exhibit the same values when measured along the three loading directions. The main findings of this study are that the framework of linear orthotropic elasticity (as well as higher symmetries of linear elasticity) is not suitable to describe the equilibrium response of articular cartilage nor characterize its material symmetry; a framework which accounts for the distinctly different responses of cartilage in tension and compression is more suitable for describing the equilibrium response of cartilage; within this framework, cartilage exhibits no lower than orthotropic symmetry. PMID:12594982
Unusual transport and highly anisotropic thermopower in PtCoO2 and PdCoO2
Ong, Khuong P; Singh, David J; Wu, Ping
2010-01-01
We show, using Boltzmann transport calculations and analysis of experimental data, that hexagonal PdCoO2 and PtCoO2 have a highly unusual metallic transport. The in-plane transport is typical of a very good metal, with high conductivity and low positive thermopower. The c-axis transport is completely different, with 2 orders of magnitude lower, but still coherent, conductivity and remarkably a very large negative thermopower. This large anisotropy of the thermopower provides an opportunity for investigating transport in a highly unusual regime using bulk materials.
Applications of asymmetric nanotextured parylene surface using its wetting and transport properties
NASA Astrophysics Data System (ADS)
Sekeroglu, Koray
In this thesis, basic digital fluidics devices were introduced using polymeric nanorods (nano-PPX) inspired from nature. Natural inspiration ignited this research by observing butterfly wings, water strider legs, rye grass leaves, and their asymmetric functions. Nano-PPX rods, manufactured by an oblique angle polymerization (OAP) method, are asymmetrically aligned structures that have unidirectional wetting properties. Nano-PPX demonstrates similar functions to the directional textured surfaces of animals and plants in terms of wetting, adhesion, and transport. The water pin-release mechanism on the asymmetric nano-PPX surface with adhesion function provides a great transport property. How the asymmetry causes transport is discussed in terms of hysteresis and interface contact of water droplets. In this study, the transport property of nano-PPX rods is used to guide droplets as well as transporting cargo such as microgels. With the addition of tracks on the nano-PPX rods, the surfaces were transformed into basic digital fluidics devices. The track-assisted nano-PPX has been employed to applications (i.e. sorting, mixing, and carrying cargo particles). Thus, digital fluidics devices fabricated on nano-PPX surface is a promising pathway to assemble microgels in the field of bioengineering. The characterization of the nano textured surface was completed using methods such as Scanning Electron Microscopy, Atomic Force Microscopy, Contact Angle Goniometry, and Fourier Transform Infra-Red Spectroscopy. These methods helped to understand the physical and chemical properties of nano-PPX. Parameters such as advancing and receding contact angles, nanorod tilt angle, and critical drop volumes were utilized to investigate the anisotropic wetting properties of nano-PPX surface. This investigation explained the directional wetting behavior of the surface as well as approaching new design parameters for adjusting surface properties. The nanorod tilt angle was a key parameter
Anisotropic transport properties of PrBa 2Cu 3O 7
NASA Astrophysics Data System (ADS)
Goto, M.; Takenaka, K.; Eisaki, H.; Uchida, S.
1997-08-01
The in-plane resitivity is measured on the twin-free PrBa 2Cu 3O 7 crystals. The observal anisotropy indicates that dominant carrier conduction takes place in the CuO one-dimensional chain. By applying the pressure, ϱa, containing CuO 2 plane contribution increases more rapidly than ϱa, containing both and plane contributions. This is considered to be due to the increased the hybridization between Pr4f and O2p orbital at the plane site, consistent with the scenario proposed by Fehrenbacher and Rice.
Transport properties of Dirac semimetal Cd3As2
NASA Astrophysics Data System (ADS)
Liang, Tian; Gibson, Quinn; Xiong, Jun; Liu, Minhao; Hirschberger, Maximilian; Cava, Robert; Ong, Nai Phuan
2014-03-01
The semimetal Cd3As2 has emerged as an attractive candidate for a Dirac semimetal. A recent LDA calculation reveals that, at the Fermi energy, it has two bulk Dirac nodes which straddle the Γ point along the kz axis. The Dirac nodes were recently observed by ARPES. We have made extensive transport measurements of Cd3As2. Because of possible Cd vacancy disorder in the very large unit cell (160 atoms), the SdH oscillations reveal a quantum lifetime that is moderately damped. Despite the disorder, the observed resistivity ρ in some crystals displays a RRR of 1000. At 4 K, the residual resistivity is anomalously low (30 n Ω cm). We estimate that the mobility exceeds 106 cm2V-1s-1. A magnetic field H strongly increases ρ by factors of 100 to 1000 at 10 Tesla. This giant magnetoresistance (MR) is highly anisotropic. The MR is largest when H is perpendicular to the axis (110) and minimal when H is ∥(110). We will discuss possible origins of this unusual anisotropic giant MR. We also discuss the possibility of detecting an enhanced longitudinal MR associated with charge pumping between Weyl nodes (the chiral anomaly). Supported by Army Research Office (ARO W911NF-11-1-0379) and NSF-MRSEC Grant DMR 0819860.
NASA Astrophysics Data System (ADS)
Zhao, Ying-Ying; Wang, Jing; Kuang, Hao; Hu, Feng-Xia; Zhang, Hong-Rui; Liu, Yao; Zhang, Ying; Wang, Shuan-Hu; Wu, Rong-Rong; Zhang, Ming; Bao, Li-Fu; Sun, Ji-Rong; Shen, Bao-Gen
2014-11-01
Abnormal percolative transport in inhomogeneous systems has drawn increasing interests due to its deviation from the conventional percolation picture. However, its nature is still ambiguous partly due to the difficulty in obtaining controllable abnormal percolative transport behaviors. Here, we report the first observation of electric-field-controlled abnormal percolative transport in (011)-Pr0.7(Ca0.6Sr0.4)0.3MnO3/0.7Pb(Mg1/3Nb2/3)O3-0.3PbTiO3 heterostructure. By introducing an electric-field-induced in-plane anisotropic strain-field in a phase separated PCSMO film, we stimulate a significant inverse thermal hysteresis (~ -17.5 K) and positive colossal electroresistance (~11460%), which is found to be crucially orientation-dependent and completely inconsistent with the well accepted conventional percolation picture. Further investigations reveal that such abnormal inverse hysteresis is strongly related to the preferential formation of ferromagnetic metallic domains caused by in-plane anisotropic strain-field. Meanwhile, it is found that the positive colossal electroresistance should be ascribed to the coactions between the anisotropic strain and the polarization effect from the poling of the substrate which leads to orientation and bias-polarity dependencies for the colossal electroresistance. This work unambiguously evidences the indispensable role of the anisotropic strain-field in driving the abnormal percolative transport and provides a new perspective for well understanding the percolation mechanism in inhomogeneous systems.
NASA Astrophysics Data System (ADS)
Xu, Wenxiang; Wang, Han; Niu, Yanze; Bai, Jingtao
2016-01-01
With advances in interfacial properties characterization technologies, the interfacial volume fraction is a feasible parameter for evaluating effective physical properties of materials. However, there is a need to determine the interfacial volume fraction around anisotropic fibers and a need to assess the influence of such the interfacial property on effective properties of fibrous materials. Either ways, the accurate prediction of interfacial volume fraction is required. Towards this end, we put forward both theoretical and numerical schemes to determine the interfacial volume fraction in fibrous materials, which are considered as a three-phase composite structure consisting of matrix, anisotropic hard spherocylinder fibers, and soft interfacial layers with a constant dimension coated on the surface of each fiber. The interfacial volume fraction actually represents the fraction of space not occupied by all hard fibers and matrix. The theoretical scheme that adopts statistical geometry and stereological theories is essentially an analytic continuation from spherical inclusions. By simulating such three-phase chopped fibrous materials, we numerically derive the interfacial volume fraction. The theoretical and numerical schemes provide a quantitative insight that the interfacial volume fraction depends strongly on the fiber geometries like fiber shape, geometric size factor, and fiber size distribution. As a critical interfacial property, the present contribution can be further drawn into assessing effective physical properties of fibrous materials, which will be demonstrated in another paper (Part II) of this series.
NASA Astrophysics Data System (ADS)
Pedretti, D.; Fernandez-Garcia, D.; Bolster, D.; Sanchez-Vila, X.; Benson, D.
2012-04-01
For risk assessment and adequate decision making regarding remediation strategies in contaminated aquifers, solute fate in the subsurface must be modeled correctly. In practical situations, hydrodynamic transport parameters are obtained by fitting procedures, that aim to mathematically reproduce solute breakthrough (BTC) observed in the field during tracer tests. In recent years, several methods have been proposed (curve-types, moments, nonlocal formulations) but none of them combine the two main characteristic effects of convergent flow tracer tests (which are the most used tests in the practice): the intrinsic non-stationarity of the convergent flow to a well and the ubiquitous multiscale hydraulic heterogeneity of geological formations. These two effects separately have been accounted for by a lot of methods that appear to work well. Here, we investigate both effects at the same time via numerical analysis. We focus on the influence that measurable statistical properties of the aquifers (such as the variance and the statistical geometry of correlation scales) have on the shape of BTCs measured at the pumping well during convergent flow tracer tests. We built synthetic multigaussian 3D fields of heterogeneous hydraulic conductivity fields with variable statistics. A well is located in the center of the domain to reproduce a forced gradient towards it. Constant-head values are imposed on the boundaries of the domains, which have 251x251x100 cells. Injections of solutes take place by releasing particles at different distances from the well and using a random walk particle tracking scheme with constant local coefficient of dispersivity. The results show that BTCs partially display the typical anomalous behavior that has been commonly referred to as the effect of heterogeneity and connectivity (early and late arrival times of solute differ from the one predicted by local formulations). Among the most salient features, the behaviors of BTCs after the peak (the slope
Highly anisotropic thermal conductivity of arsenene: An ab initio study
NASA Astrophysics Data System (ADS)
Zeraati, Majid; Vaez Allaei, S. Mehdi; Abdolhosseini Sarsari, I.; Pourfath, Mahdi; Donadio, Davide
2016-02-01
Elemental two-dimensional (2D) materials exhibit intriguing heat transport and phononic properties. Here we have investigated the lattice thermal conductivity of newly proposed arsenene, the 2D honeycomb structure of arsenic, using ab initio calculations. Solving the Boltzmann transport equation for phonons, we predict a highly anisotropic thermal conductivity of 30.4 and 7.8 W/mK along the zigzag and armchair directions, respectively, at room temperature. Our calculations reveal that phonons with mean free paths between 20 nm and 1 μ m provide the main contribution to the large thermal conductivity in the zigzag direction; mean free paths of phonons contributing to heat transport in the armchair directions range between 20 and 100 nm. The obtained anisotropic thermal conductivity and feasibility of synthesis, in addition to high electron mobility reported elsewhere, make arsenene a promising material for nanoelectronic applications and thermal management.
Transport properties of finite-beta microturbulence
Pueschel, M. J.; Jenko, F.
2010-06-15
Via nonlinear gyrokinetic simulations, microturbulent transport is investigated for electromagnetic trapped electron mode (TEM) and ion temperature gradient (ITG) tokamak core turbulence with beta up to and beyond the kinetic ballooning mode threshold. Deviations from linear expectations are explained by zonal flow activity in the TEM case. For the ITG scenario, beta-induced changes are observed in the nonlinear critical gradient upshift--from a certain beta, a strong increase is observed in the Dimits shift. Additionally, a Rechester-Rosenbluth-type model for magnetic transport is applied, and the amplitudes of magnetic field fluctuations are quantified for different types of turbulence.
NASA Astrophysics Data System (ADS)
Diez, A.; Eisen, O.
2014-08-01
A preferred orientation of the anisotropic ice crystals influences the viscosity of the ice bulk and the dynamic behaviour of glaciers and ice sheets. Knowledge about the distribution of crystal anisotropy, to understand its contribution to ice dynamics, is mainly provided by crystal orientation fabric (COF) data from ice cores. However, the developed anisotropic fabric does not only influence the flow behaviour of ice, but also the propagation of seismic waves. Two effects are important: (i) sudden changes in COF lead to englacial reflections and (ii) the anisotropic fabric induces an angle dependency on the seismic velocities and, thus, also recorded traveltimes. A framework is presented here to connect COF data with the elasticity tensor to determine seismic velocities and reflection coefficients for cone and girdle fabrics from ice-core data. We connect the microscopic anisotropy of the crystals with the macroscopic anisotropy of the ice mass, observable with seismic methods. Elasticity tensors for different fabrics are calculated and used to investigate the influence of the anisotropic ice fabric on seismic velocities and reflection coefficients, englacially as well as for the ice-bed contact. Our work, therefore, provides a contribution to remotely determine the state of bulk ice anisotropy.
NASA Astrophysics Data System (ADS)
Diez, A.; Eisen, O.
2015-02-01
A preferred orientation of the anisotropic ice crystals influences the viscosity of the ice bulk and the dynamic behaviour of glaciers and ice sheets. Knowledge about the distribution of crystal anisotropy is mainly provided by crystal orientation fabric (COF) data from ice cores. However, the developed anisotropic fabric influences not only the flow behaviour of ice but also the propagation of seismic waves. Two effects are important: (i) sudden changes in COF lead to englacial reflections, and (ii) the anisotropic fabric induces an angle dependency on the seismic velocities and, thus, recorded travel times. A framework is presented here to connect COF data from ice cores with the elasticity tensor to determine seismic velocities and reflection coefficients for cone and girdle fabrics. We connect the microscopic anisotropy of the crystals with the macroscopic anisotropy of the ice mass, observable with seismic methods. Elasticity tensors for different fabrics are calculated and used to investigate the influence of the anisotropic ice fabric on seismic velocities and reflection coefficients, englacially as well as for the ice-bed contact. Hence, it is possible to remotely determine the bulk ice anisotropy.
Anisotropic universe with anisotropic sources
Aluri, Pavan K.; Panda, Sukanta; Sharma, Manabendra; Thakur, Snigdha E-mail: sukanta@iiserb.ac.in E-mail: snigdha@iiserb.ac.in
2013-12-01
We analyze the state space of a Bianchi-I universe with anisotropic sources. Here we consider an extended state space which includes null geodesics in this background. The evolution equations for all the state observables are derived. Dynamical systems approach is used to study the evolution of these equations. The asymptotic stable fixed points for all the evolution equations are found. We also check our analytic results with numerical analysis of these dynamical equations. The evolution of the state observables are studied both in cosmic time and using a dimensionless time variable. Then we repeat the same analysis with a more realistic scenario, adding the isotropic (dust like dark) matter and a cosmological constant (dark energy) to our anisotropic sources, to study their co-evolution. The universe now approaches a de Sitter space asymptotically dominated by the cosmological constant. The cosmic microwave background anisotropy maps due to shear are also generated in this scenario, assuming that the universe contains anisotropic matter along with the usual (dark) matter and vacuum (dark) energy since decoupling. We find that they contribute dominantly to the CMB quadrupole. We also constrain the current level of anisotropy and also search for any cosmic preferred axis present in the data. We use the Union 2 Supernovae data to this extent. An anisotropy axis close to the mirror symmetry axis seen in the cosmic microwave background data from Planck probe is found.
Computer program for calculating thermodynamic and transport properties of fluids
NASA Technical Reports Server (NTRS)
Hendricks, R. C.; Braon, A. K.; Peller, I. C.
1975-01-01
Computer code has been developed to provide thermodynamic and transport properties of liquid argon, carbon dioxide, carbon monoxide, fluorine, helium, methane, neon, nitrogen, oxygen, and parahydrogen. Equation of state and transport coefficients are updated and other fluids added as new material becomes available.
Lee, Barry
2010-05-01
This paper presents a new multigrid method applied to the most common Sn discretizations (Petrov-Galerkin, diamond-differenced, corner-balanced, and discontinuous Galerkin) of the mono-energetic Boltzmann transport equation in the optically thick and thin regimes, and with strong anisotropic scattering. Unlike methods that use scalar DSA diffusion preconditioners for the source iteration, this multigrid method is applied directly to an integral equation for the scalar flux. Thus, unlike the former methods that apply a multigrid strategy to the scalar DSA diffusion operator, this method applies a multigrid strategy to the integral source iteration operator, which is an operator for 5 independent variables in spatial 3-d (3 in space and 2 in angle) and 4 independent variables in spatial 2-d (2 in space and 2 in angle). The core smoother of this multigrid method involves applications of the integral operator. Since the kernel of this integral operator involves the transport sweeps, applying this integral operator requires a transport sweep (an inversion of an upper triagular matrix) for each of the angles used. As the equation is in 5-space or 4-space, the multigrid approach in this paper coarsens in both angle and space, effecting efficient applications of the coarse integral operators. Although each V-cycle of this method is more expensive than a V-cycle for the DSA preconditioner, since the DSA equation does not have angular dependence, the overall computational efficiency is about the same for problems where DSA preconditioning {\\it is} effective. This new method also appears to be more robust over all parameter regimes than DSA approaches. Moreover, this new method is applicable to a variety of Sn spatial discretizations, to problems involving a combination of optically thick and thin regimes, and more importantly, to problems with anisotropic scattering cross-sections, all of which DSA approaches perform poorly or not applicable at all. This multigrid approach
PROPERTIES OF INTERFACES AND TRANSPORT ACROSS THEM
Much of the biological activity in cell cytoplasm occurs in compartments which are thought to form by phase separation, and many of the functions of these compartments occur by the transport or exchange of molecules across interfaces. Thus, a fundamentally based discussion of th...
Transport properties of pancreatic cancer describe gemcitabine delivery and response
Koay, Eugene J.; Truty, Mark J.; Cristini, Vittorio; Thomas, Ryan M.; Chen, Rong; Chatterjee, Deyali; Kang, Ya’an; Bhosale, Priya R.; Tamm, Eric P.; Crane, Christopher H.; Javle, Milind; Katz, Matthew H.; Gottumukkala, Vijaya N.; Rozner, Marc A.; Shen, Haifa; Lee, Jeffery E.; Wang, Huamin; Chen, Yuling; Plunkett, William; Abbruzzese, James L.; Wolff, Robert A.; Varadhachary, Gauri R.; Ferrari, Mauro; Fleming, Jason B.
2014-01-01
Background. The therapeutic resistance of pancreatic ductal adenocarcinoma (PDAC) is partly ascribed to ineffective delivery of chemotherapy to cancer cells. We hypothesized that physical properties at vascular, extracellular, and cellular scales influence delivery of and response to gemcitabine-based therapy. Methods. We developed a method to measure mass transport properties during routine contrast-enhanced CT scans of individual human PDAC tumors. Additionally, we evaluated gemcitabine infusion during PDAC resection in 12 patients, measuring gemcitabine incorporation into tumor DNA and correlating its uptake with human equilibrative nucleoside transporter (hENT1) levels, stromal reaction, and CT-derived mass transport properties. We also studied associations between CT-derived transport properties and clinical outcomes in patients who received preoperative gemcitabine-based chemoradiotherapy for resectable PDAC. Results. Transport modeling of 176 CT scans illustrated striking differences in transport properties between normal pancreas and tumor, with a wide array of enhancement profiles. Reflecting the interpatient differences in contrast enhancement, resected tumors exhibited dramatic differences in gemcitabine DNA incorporation, despite similar intravascular pharmacokinetics. Gemcitabine incorporation into tumor DNA was inversely related to CT-derived transport parameters and PDAC stromal score, after accounting for hENT1 levels. Moreover, stromal score directly correlated with CT-derived parameters. Among 110 patients who received preoperative gemcitabine-based chemoradiotherapy, CT-derived parameters correlated with pathological response and survival. Conclusion. Gemcitabine incorporation into tumor DNA is highly variable and correlates with multiscale transport properties that can be derived from routine CT scans. Furthermore, pretherapy CT-derived properties correlate with clinically relevant endpoints. Trial registration. Clinicaltrials.gov NCT01276613
Lagrangian transport properties of pulmonary interfacial flows
Smith, Bradford J.; Lukens, Sarah; Yamaguchi, Eiichiro; Gaver, Donald P.
2012-01-01
Disease states characterized by airway fluid occlusion and pulmonary surfactant insufficiency, such as respiratory distress syndrome, have a high mortality rate. Understanding the mechanics of airway reopening, particularly involving surfactant transport, may provide an avenue to increase patient survival via optimized mechanical ventilation waveforms. We model the occluded airway as a liquid-filled rigid tube with the fluid phase displaced by a finger of air that propagates with both mean and sinusoidal velocity components. Finite-time Lyapunov exponent (FTLE) fields are employed to analyse the convective transport characteristics, taking note of Lagrangian coherent structures (LCSs) and their effects on transport. The Lagrangian perspective of these techniques reveals flow characteristics that are not readily apparent by observing Eulerian measures. These analysis techniques are applied to surfactant-free velocity fields determined computationally, with the boundary element method, and measured experimentally with micro particle image velocimetry (μ-PIV). We find that the LCS divides the fluid into two regimes, one advected upstream (into the thin residual film) and the other downstream ahead of the advancing bubble. At higher oscillatory frequencies particles originating immediately inside the LCS experience long residence times at the air–liquid interface, which may be conducive to surfactant transport. At high frequencies a well-mixed attractor region is identified; this volume of fluid cyclically travels along the interface and into the bulk fluid. The Lagrangian analysis is applied to velocity data measured with 0.01 mg ml−1 of the clinical pulmonary surfactant Infasurf in the bulk fluid, demonstrating flow field modifications with respect to the surfactant-free system that were not visible in the Eulerian frame. PMID:23049141
Braithwaite, D.; Bourgault, D.; Sulpice, A.; Barbut, J.M.; Tournier, R. l'Universite Joseph Fourier, Grenoble ); Monot, I.; Lepropre, M.; Provost, J.; Desgardin, G. )
1993-04-01
The dc transport critical current densities of melt texture grown and magnetically melt textured bulk YBaCuO have been measured at 77 K and in magnetic fields. A maximum value of over 31,000 A/cm[sup 2] is obtained with a field of 7 teslas applied parallel to the (a,b) planes. Over the rest of the angular range the critical current is shown to be determined mainly by the c-axis component of the applied field. Although this dependency is expected in the presence of two-dimensional vortices, in fact the data are shown to correspond better to the behavior expected of an anisotropic three-dimensional superconductor. These results are compared to magnetization measurements on the same samples. Results show that when the field is directed close to the c-axis, superconducting transport currents flow at fields well above the field at which the irreversible magnetization disappears.
Superlens from complementary anisotropic metamaterials
NASA Astrophysics Data System (ADS)
Li, G. X.; Tam, H. L.; Wang, F. Y.; Cheah, K. W.
2007-12-01
Metamaterials with isotropic property have been shown to possess novel optical properties such as a negative refractive index that can be used to design a superlens. Recently, it was shown that metamaterials with anisotropic property can translate the high-frequency wave vector k values from evanescence to propagating. However, electromagnetic waves traveling in single-layer anisotropic metamaterial produce diverging waves of different spatial frequency. In this work, it is shown that, using bilayer metamaterials that have complementary anisotropic property, the diverging waves are recombined to produce a subwavelength image, i.e., a superlens device can be designed. The simulation further shows that the design can be achieved using a metal/oxide multilayer, and a resolution of 30 nm can be easily obtained in the optical frequency range.
Physical transport properties of marine microplastic pollution
NASA Astrophysics Data System (ADS)
Ballent, A.; Purser, A.; Mendes, P. de Jesus; Pando, S.; Thomsen, L.
2012-12-01
Given the complexity of quantitative collection, knowledge of the distribution of microplastic pollution in many regions of the world ocean is patchy, both spatially and temporally, especially for the subsurface environment. However, with knowledge of typical hydrodynamic behavior of waste plastic material, models predicting the dispersal of pelagic and benthic plastics from land sources into the ocean are possible. Here we investigate three aspects of plastic distribution and transport in European waters. Firstly, we assess patterns in the distribution of plastics found in fluvial strandlines of the North Sea and how distribution may be related to flow velocities and distance from source. Second, we model transport of non-buoyant preproduction pellets in the Nazaré Canyon of Portugal using the MOHID system after assessing the density, settling velocity, critical and depositional shear stress characteristics of such waste plastics. Thirdly, we investigate the effect of surface turbulences and high pressures on a range of marine plastic debris categories (various densities, degradation states and shapes tested) in an experimental water column simulator tank and pressure laboratory. Plastics deposited on North Sea strandlines varied greatly spatially, as a function of material composition and distance from source. Model outputs indicated that such dense production pellets are likely transported up and down canyon as a function of tidal forces, with only very minor net down canyon movement. Behaviour of plastic fragments under turbulence varied greatly, with the dimensions of the material, as well as density, playing major determining roles. Pressure was shown to affect hydrodynamic behaviours of only low density foam plastics at pressures ≥ 60 bar.
Enhancement of wall jet transport properties
Claunch, Scott D.; Farrington, Robert B.
1997-01-01
By enhancing the natural instabilities in the boundary layer and in the free shear layer of a wall jet, the boundary is minimized thereby increasing the transport of heat and mass. Enhancing the natural instabilities is accomplished by pulsing the flow of air that creates the wall jet. Such pulsing of the flow of air can be accomplished by sequentially occluding and opening a duct that confines and directs the flow of air, such as by rotating a disk on an axis transverse to the flow of air in the duct.
Enhancement of wall jet transport properties
Claunch, S.D.; Farrington, R.B.
1997-02-04
By enhancing the natural instabilities in the boundary layer and in the free shear layer of a wall jet, the boundary is minimized thereby increasing the transport of heat and mass. Enhancing the natural instabilities is accomplished by pulsing the flow of air that creates the wall jet. Such pulsing of the flow of air can be accomplished by sequentially occluding and opening a duct that confines and directs the flow of air, such as by rotating a disk on an axis transverse to the flow of air in the duct. 17 figs.
Middle Atmosphere Transport Properties of Assimilated Datasets
NASA Technical Reports Server (NTRS)
Pawson, Steven; Rood, Richard
1999-01-01
One of the most compelling reasons for performing data assimilation in the middle atmosphere is to obtain global, balanced datasets for studies of trace gas transport and chemistry. This is a major motivation behind the Goddard Earth observation System-Data Assimilation System (GEOS-DAS). Previous studies have shown that while this and other data assimilation systems can generally obtain good estimates of the extratropical rotational velocity field, the divergent part of the dynamical field is deficient; this impacts the "residual circulation" and leads to spurious trace gas transport on seasonal and interannual timescales. These problems are impacted by the quality and the method of use of the observational data and by deficiencies in the atmospheric general circulation model. Whichever the cause at any place and time, the "solution" is to introduce non-physical forcing terms into the system (the so-called incremental analysis updates); these can directly (thermal) or indirectly (mechanical) affect the residual circulation. This paper will illustrate how the divergent circulation is affected by deficiencies in both observations and models. Theoretical considerations will be illustrated with examples from the GEOS-DAS and from simplified numerical experiments. These are designed to isolate known problems, such as the inability of models to sustain a quasi-biennial oscillation and sparse observational constraints on tropical dynamics, or radiative inconsistencies in the presence of volcanic aerosols.
Middle Atmospheric Transport Properties of Assimilated Datasets
NASA Technical Reports Server (NTRS)
Pawson, Steven; Rood, Richard
1999-01-01
One of the most compelling reasons for performing data assimilation in the middle atmosphere is to obtain global, balanced datasets for studies of trace gas transport and chemistry. This is a major motivation behind the Goddard Earth observation System-Data Assimilation System (GEOS-DAS). Previous studies have shown that while this and other data assimilation systems can generally obtain good estimates of the extratropical rotational velocity field, the divergent part of the dynamical field is deficient; this impacts the "residual circulation" and leads to spurious trace gas transport on seasonal and interannual timescales. These problems are impacted by the quality and the method of use of the observational data and by deficiencies in the atmospheric general circulation model. Whichever the cause at any place and time, the "solution" is to introduce non-physical forcing terms into the system (the so-called incremental analysis updates); these can directly (thermal) or indirectly (mechanical) affect the residual circulation. This paper will illustrate how the divergent circulation is affected by deficiencies in both observations and models. Theoretical considerations will be illustrated with examples from the GEOS-DAS and from simplified numerical experiments. These are designed to isolate known problems, such as the inability of models to sustain a quasi-biennial oscillation and sparse observational constraints on tropical dynamics, or radiative inconsistencies in the presence of volcanic aerosols.
Fractures in anisotropic media
NASA Astrophysics Data System (ADS)
Shao, Siyi
Rocks may be composed of layers and contain fracture sets that cause the hydraulic, mechanical and seismic properties of a rock to be anisotropic. Coexisting fractures and layers in rock give rise to competing mechanisms of anisotropy. For example: (1) at low fracture stiffness, apparent shear-wave anisotropy induced by matrix layering can be masked or enhanced by the presence of a fracture, depending on the fracture orientation with respect to layering, and (2) compressional-wave guided modes generated by parallel fractures can also mask the presence of matrix layerings for particular fracture orientations and fracture specific stiffness. This report focuses on two anisotropic sources that are widely encountered in rock engineering: fractures (mechanical discontinuity) and matrix layering (impedance discontinuity), by investigating: (1) matrix property characterization, i.e., to determine elastic constants in anisotropic solids, (2) interface wave behavior in single-fractured anisotropic media, (3) compressional wave guided modes in parallel-fractured anisotropic media (single fracture orientation) and (4) the elastic response of orthogonal fracture networks. Elastic constants of a medium are required to understand and quantify wave propagation in anisotropic media but are affected by fractures and matrix properties. Experimental observations and analytical analysis demonstrate that behaviors of both fracture interface waves and compressional-wave guided modes for fractures in anisotropic media, are affected by fracture specific stiffness (controlled by external stresses), signal frequency and relative orientation between layerings in the matrix and fractures. A fractured layered medium exhibits: (1) fracture-dominated anisotropy when the fractures are weakly coupled; (2) isotropic behavior when fractures delay waves that are usually fast in a layered medium; and (3) matrix-dominated anisotropy when the fractures are closed and no longer delay the signal. The
Transport properties of porous media from the microstructure
Torquato, S.
1995-12-31
The determination of the effective transport properties of a random porous medium remains a challenging area of research because the properties depend on the microstructure in a highly complex fashion. This paper reviews recent theoretical and experimental progress that we have made on various aspects of this problem. A unified approach is taken to characterize the microstructure and the seemingly disparate properties of the medium.
NASA Astrophysics Data System (ADS)
Kovalevskiy, Mikhail
2013-04-01
The KTB German Superdeep Well (Germany, Windischeschenbach) has limiting depth of 9101 m. It is one of the world deepest well among the continental boreholes. A study of physical parameters including elastic ones of the massif intersected by the well allowed to represent a real pattern of changing properties and the state of crystalline rocks in upper and middle part of the Earth crust. Such a deep section enables performing analyses of large spectrum of geological and geophysical objects, such as minerals, crystalline rocks, geological strata, formation complexes et al. Recently obtained results permit to get a general idea of elastic-anisotropic properties of crystalline rocks extracted from great depths. A study of properties and state of rocks along the KTB section will make it possible to most precisely determine regular changes of the Earth's rock properties within a large range of depths. Below are the results of investigation of elastic-anisotropic properties for 13 core samples of the KTB rocks in the range of 4.1 to 7.1 km. In this interval the well has penetrated metamorphosed rocks [1]. The measurements have been done by an acoustopolarization method with recent improvements and with devices for determination of sample elastic properties [2 3]. The data obtained are the result of extended study into the KTB rock samples by the method [4]. Study of rock samples from the KTB Superdeep Well in the 4100-7100 m depth range showed that they all are elastic anisotropic and pertain to a orthorhombic symmetry type. Virtually the degree of linear acoustic anisotropic absorption (LAAA) effect has been detected in all samples. Its appearance is likely related to directional orientation of mineral grains as well as to the generation of microcracks during drilling and lithostatic stress release. The several samples showed an angular unconformity between the LAAA orientation and elastic symmetry elements. The shear waves depolarization (DSW) effect was detected in
CET89 - CHEMICAL EQUILIBRIUM WITH TRANSPORT PROPERTIES, 1989
NASA Technical Reports Server (NTRS)
Mcbride, B.
1994-01-01
Scientists and engineers need chemical equilibrium composition data to calculate the theoretical thermodynamic properties of a chemical system. This information is essential in the design and analysis of equipment such as compressors, turbines, nozzles, engines, shock tubes, heat exchangers, and chemical processing equipment. The substantial amount of numerical computation required to obtain equilibrium compositions and transport properties for complex chemical systems led scientists at NASA's Lewis Research Center to develop CET89, a program designed to calculate the thermodynamic and transport properties of these systems. CET89 is a general program which will calculate chemical equilibrium compositions and mixture properties for any chemical system with available thermodynamic data. Generally, mixtures may include condensed and gaseous products. CET89 performs the following operations: it 1) obtains chemical equilibrium compositions for assigned thermodynamic states, 2) calculates dilute-gas transport properties of complex chemical mixtures, 3) obtains Chapman-Jouguet detonation properties for gaseous species, 4) calculates incident and reflected shock properties in terms of assigned velocities, and 5) calculates theoretical rocket performance for both equilibrium and frozen compositions during expansion. The rocket performance function allows the option of assuming either a finite area or an infinite area combustor. CET89 accommodates problems involving up to 24 reactants, 20 elements, and 600 products (400 of which may be condensed). The program includes a library of thermodynamic and transport properties in the form of least squares coefficients for possible reaction products. It includes thermodynamic data for over 1300 gaseous and condensed species and transport data for 151 gases. The subroutines UTHERM and UTRAN convert thermodynamic and transport data to unformatted form for faster processing. The program conforms to the FORTRAN 77 standard, except for
Unsaturated Zone and Saturated Zone Transport Properties (U0100)
J. Conca
2000-12-20
This Analysis/Model Report (AMR) summarizes transport properties for the lower unsaturated zone hydrogeologic units and the saturated zone at Yucca Mountain and provides a summary of data from the Busted Butte Unsaturated Zone Transport Test (UZTT). The purpose of this report is to summarize the sorption and transport knowledge relevant to flow and transport in the units below Yucca Mountain and to provide backup documentation for the sorption parameters decided upon for each rock type. Because of the complexity of processes such as sorption, and because of the lack of direct data for many conditions that may be relevant for Yucca Mountain, data from systems outside of Yucca Mountain are also included. The data reported in this AMR will be used in Total System Performance Assessment (TSPA) calculations and as general scientific support for various Process Model Reports (PMRs) requiring knowledge of the transport properties of different materials. This report provides, but is not limited to, sorption coefficients and other relevant thermodynamic and transport properties for the radioisotopes of concern, especially neptunium (Np), plutonium (Pu), Uranium (U), technetium (Tc), iodine (I), and selenium (Se). The unsaturated-zone (UZ) transport properties in the vitric Calico Hills (CHv) are discussed, as are colloidal transport data based on the Busted Butte UZTT, the saturated tuff, and alluvium. These values were determined through expert elicitation, direct measurements, and data analysis. The transport parameters include information on interactions of the fractures and matrix. In addition, core matrix permeability data from the Busted Butte UZTT are summarized by both percent alteration and dispersion.
Magnetothermoelectric transport properties of multiterminal graphene nanoribbons
NASA Astrophysics Data System (ADS)
Wei, Miao-Miao; Zhang, Ying-Tao; Guo, Ai-Min; Liu, Jian-Jun; Xing, Yanxia; Sun, Qing-Feng
2016-06-01
The Peltier effect and the Ettingshausen effect are investigated in graphene nanoribbons, where charge current produces heat current along the longitudinal direction in the former case, and longitudinal charge current generates transverse heat current in the latter case. With the aid of the nonequilibrium Green's function and the Landauer-Büttiker formalism, the Peltier coefficient Πc and the Ettingshausen coefficient Ec are obtained. We found that the Kelvin relation is always valid for the longitudinal thermoelectric transport, i.e., Πc=T Sc , with T the temperature and Sc the Seebeck coefficient. In contrast, for transverse magnetothermoelectric transport, the Kelvin relation breaks down and Ec≠T Nc usually, with Nc the Nernst coefficient. In the region of weak magnetic field, the Ettingshausen effect depends strongly on device parameters. When the Fermi energy EF is close to the Dirac point, the Ettingshausen effect of the semiconducting armchair graphene nanoribbon is much stronger than that of the metallic one. When EF is far away from the Dirac point, the Ettingshausen coefficient Ec oscillates around zero. When under a strong magnetic field, Ec is independent of the device parameters and swells only near the Dirac point. Further, the dependence of Ec on EF can be scaled by EF/kBT , with a peak value of (2 ln2 ) kBT /e for the three-terminal system and (4/3 ln2 ) kBT /e for the four-terminal system. We also study the impact of disorder on the Ettingshausen effect. Regardless of the magnetic field strength, Ec is robust against moderate disorder scattering. In addition, in the strong magnetic field, Ec with additional regular oscillating structure can be caused by disorder.
Ueki, T.; Larsen, E.W.
1998-09-01
The authors show that Monte Carlo simulations of neutral particle transport in planargeometry anisotropically scattering media, using the exponential transform with angular biasing as a variance reduction device, are governed by a new Boltzman Monte Carlo (BMC) equation, which includes particle weight as an extra independent variable. The weight moments of the solution of the BMC equation determine the moments of the score and the mean number of collisions per history in the nonanalog Monte Carlo simulations. Therefore, the solution of the BMC equation predicts the variance of the score and the figure of merit in the simulation. Also, by (1) using an angular biasing function that is closely related to the ``asymptotic`` solution of the linear Boltzman equation and (2) requiring isotropic weight changes as collisions, they derive a new angular biasing scheme. Using the BMC equation, they propose a universal ``safe`` upper limit of the transform parameter, valid for any type of exponential transform. In numerical calculations, they demonstrate that the behavior of the Monte Carlo simulations and the performance predicted by deterministically solving the BMC equation agree well, and that the new angular biasing scheme is always advantageous.
NASA Astrophysics Data System (ADS)
Kuramochi, H.; Odaka, S.; Morita, K.; Tanaka, S.; Miyazaki, H.; Lee, M. V.; Li, S.-L.; Hiura, H.; Tsukagoshi, K.
2012-03-01
Thermal decomposition of vicinal SiC substrates with self-organized periodic nanofacets is a promising method to produce large graphene sheets toward the commercial exploitation of graphene's superior electronic properties. The epitaxial graphene films grown on vicinal SiC comprise two distinct regions of terrace and step; and typically exhibit anisotropic electron transport behavior, although limited areas in the graphene film showed ballistic transport. To evaluate the role of terraces and steps in electron transport properties, we compared graphene samples with terrace and step regions grown on 4H-SiC(0001). Arrays of field effect transistors were fabricated on comparable graphene samples with their channels parallel or perpendicular to the nanofacets to identify the source of measured reduced mobility. Minimum conductivity and electron mobility increased with the larger proportional terrace region area; therefore, the terrace region has superior transport properties to step regions. The measured electron mobility in the terrace region, ˜1000 cm2/Vs, is 10 times larger than that in the step region, ˜100 cm2/Vs. We conclusively determine that parasitic effects originate in regions of graphene that grow over step edges in 4H-SiC(0001).
Thermodynamic and transport properties of sodium liquid and vapor
Fink, J.K.; Leibowitz, L.
1995-01-01
Data have been reviewed to obtain thermodynamically consistent equations for thermodynamic and transport properties of saturated sodium liquid and vapor. Recently published Russian recommendations and results of equation of state calculations on thermophysical properties of sodium have been included in this critical assessment. Thermodynamic properties of sodium liquid and vapor that have been assessed include: enthalpy, heat capacity at constant pressure, heat capacity at constant volume, vapor pressure, boiling point, enthalpy of vaporization, density, thermal expansion, adiabatic and isothermal compressibility, speed of sound, critical parameters, and surface tension. Transport properties of liquid sodium that have been assessed include: viscosity and thermal conductivity. For each property, recommended values and their uncertainties are graphed and tabulated as functions of temperature. Detailed discussions of the analyses and determinations of the recommended equations include comparisons with recommendations given in other assessments and explanations of consistency requirements. The rationale and methods used in determining the uncertainties in the recommended values are also discussed.
Electron-Transport Properties of Few-Layer Black Phosphorus.
Xu, Yuehua; Dai, Jun; Zeng, Xiao Cheng
2015-06-01
We perform the first-principles computational study of the effect of number of stacking layers and stacking style of the few-layer black phosphorus (BPs) on the electronic properties, including transport gap, current-voltage (i-v) relation, and differential conductance. Our computation is based on the nonequilibrium Green's function approach combined with density functional theory calculations. Specifically, we compute electron-transport properties of monolayer BP, bilayer BP, and trilayer BP as well as bilayer BPs with AB-, AA-, or AC-stacking. We find that the stacking number has greater influence on the transport gap than the stacking type. Conversely, the stacking type has greater influence on i-v curve and differential conductance than on the transport gap. This study offers useful guidance for determining the number of stacking layers and the stacking style of few-layer BP sheets in future experimental measurements and for potential applications in nanoelectronic devices. PMID:26266491
Transport properties of high-temperature Jupiter atmosphere components
Bruno, D.; Colonna, G.; De Pascale, O.; Laricchiuta, A.; Catalfamo, C.; Diomede, P.; Capitelli, M.; Gorse, C.; Longo, S.; Giordano, D.; Pirani, F.
2010-11-15
Transport properties of high-temperature helium and hydrogen plasmas as well as Jupiter atmosphere have been calculated for equilibrium and nonequilibrium conditions using higher approximations of the Chapman-Enskog method. A complete database of transport cross sections for relevant interactions has been derived, including minority species, by using both ab initio and phenomenological potentials. Inelastic collision integrals terms, due to resonant charge-exchange channels, have been also considered.
Allen G Hunt
2008-06-09
43Tc99 is spreading mostly laterally through the U.S. Department of Energy Hanford site sediments. At higher tensions in the unsaturated zone, the hydraulic conductivity may be strongly anisotropic as a consequence of finer soils to retain more water than coarser ones, and for these soils to have been deposited primarily in horizontal structures. We have tried to develop a consistent modeling procedure that could predict the behavior of Tc plumes. Our procedure consists of: (1) Adapting existing numerical recipes based on critical path analysis to calculate the hydraulic conductivity, K, as a function of tension, h, (2) Statistically correlating the predicted K at various values of the tension with fine content, (3) Seeking a tension value, for which the anisotropy and the horizontal K values are both sufficiently large to accommodate multi-kilometer spreading, (4) Predicting the distribution of K values for vertical flow as a function of system support volume, (5) Comparing the largest likely K value in the vertical direction with the expected K in the horizontal direction, (6) Finding the length scale at which the two K values are roughly equal, (7) Comparing that length scale with the horizontal spreading of the plume. We find that our predictions of the value of the tension at which the principle spreading is likely occurring compares very well with experiment. However, we seem to underestimate the physical length scale at which the predominantly horizontal spreading begins to take on significant vertical characteristics. Our data and predictions would seem to indicate that this should happen after horizontal transport of somewhat over a km, but the chiefly horizontal transport appears to continue out to scales of 10km or so.
Zhao, Ying-Ying; Wang, Jing; Kuang, Hao; Hu, Feng-Xia; Zhang, Hong-Rui; Liu, Yao; Zhang, Ying; Wang, Shuan-Hu; Wu, Rong-Rong; Zhang, Ming; Bao, Li-Fu; Sun, Ji-Rong; Shen, Bao-Gen
2014-01-01
Abnormal percolative transport in inhomogeneous systems has drawn increasing interests due to its deviation from the conventional percolation picture. However, its nature is still ambiguous partly due to the difficulty in obtaining controllable abnormal percolative transport behaviors. Here, we report the first observation of electric-field-controlled abnormal percolative transport in (011)-Pr(0.7)(Ca(0.6)Sr(0.4))(0.3)MnO3/0.7Pb(Mg(1/3)Nb(2/3))O3-0.3PbTiO3 heterostructure. By introducing an electric-field-induced in-plane anisotropic strain-field in a phase separated PCSMO film, we stimulate a significant inverse thermal hysteresis (~ -17.5 K) and positive colossal electroresistance (~11460%), which is found to be crucially orientation-dependent and completely inconsistent with the well accepted conventional percolation picture. Further investigations reveal that such abnormal inverse hysteresis is strongly related to the preferential formation of ferromagnetic metallic domains caused by in-plane anisotropic strain-field. Meanwhile, it is found that the positive colossal electroresistance should be ascribed to the coactions between the anisotropic strain and the polarization effect from the poling of the substrate which leads to orientation and bias-polarity dependencies for the colossal electroresistance. This work unambiguously evidences the indispensable role of the anisotropic strain-field in driving the abnormal percolative transport and provides a new perspective for well understanding the percolation mechanism in inhomogeneous systems. PMID:25399635
Zhao, Ying-Ying; Wang, Jing; Kuang, Hao; Hu, Feng-Xia; Zhang, Hong-Rui; Liu, Yao; Zhang, Ying; Wang, Shuan-Hu; Wu, Rong-Rong; Zhang, Ming; Bao, Li-Fu; Sun, Ji-Rong; Shen, Bao-Gen
2014-01-01
Abnormal percolative transport in inhomogeneous systems has drawn increasing interests due to its deviation from the conventional percolation picture. However, its nature is still ambiguous partly due to the difficulty in obtaining controllable abnormal percolative transport behaviors. Here, we report the first observation of electric-field-controlled abnormal percolative transport in (011)-Pr0.7(Ca0.6Sr0.4)0.3MnO3/0.7Pb(Mg1/3Nb2/3)O3-0.3PbTiO3 heterostructure. By introducing an electric-field-induced in-plane anisotropic strain-field in a phase separated PCSMO film, we stimulate a significant inverse thermal hysteresis (~ -17.5 K) and positive colossal electroresistance (~11460%), which is found to be crucially orientation-dependent and completely inconsistent with the well accepted conventional percolation picture. Further investigations reveal that such abnormal inverse hysteresis is strongly related to the preferential formation of ferromagnetic metallic domains caused by in-plane anisotropic strain-field. Meanwhile, it is found that the positive colossal electroresistance should be ascribed to the coactions between the anisotropic strain and the polarization effect from the poling of the substrate which leads to orientation and bias-polarity dependencies for the colossal electroresistance. This work unambiguously evidences the indispensable role of the anisotropic strain-field in driving the abnormal percolative transport and provides a new perspective for well understanding the percolation mechanism in inhomogeneous systems. PMID:25399635
Transport properties of interacting magnetic islands in tokamak plasmas
Gianakon, T.A.; Callen, J.D.; Hegna, C.C.
1993-10-01
This paper explores the equilibrium and transient transport properties of a mixed magnetic topology model for tokamak equilibria. The magnetic topology is composed of a discrete set of mostly non-overlapping magnetic islands centered on the low-order rational surfaces. Transport across the island regions is fast due to parallel transport along the stochastic magnetic field lines about the separatrix of each island. Transport between island regions is assumed to be slow due to a low residual cross-field transport. In equilibrium, such a model leads to: a nonlinear dependence of the heat flux on the pressure gradient; a power balance diffusion coefficient which increases from core to edge; and profile resiliency. Transiently, such a model also exhibits a heat pulse diffusion coefficient larger than the power balance diffusion coefficient.
Transport properties of a discrete helical electrostatic quadrupole
Meitzler, C.R.; Antes, K.; Datte, P.; Huson, F.R. ); Xiu, L. . Inst. for Beam Particle Dynamics)
1991-01-01
The helical electrostatic quadrupole (HESQ) lens has been proposed as a low energy beam transport system which permits intense H{sup {minus}} beams to be focused into an RFQ without seriously increasing the beam's emittance. A stepwise continuous HESQ lens has been constructed, and preliminary tests have shown that the structure does provide focusing. In order to understand the transport properties of this device, further detailed studies have been performed. Emittances were measured 3.5 cm from the end of the HESQ at two different voltages on the HESQ electrodes. A comparison of these experimental results with a linear model of the HESQ beam transport is made. 4 refs., 5 figs.
Transport properties in nontwist area-preserving maps
Szezech Jr., J. D.; Caldas, I. L.; Lopes, S. R.; Viana, R. L.; Morrison, P. J.
2009-10-23
Nontwist systems, common in the dynamical descriptions of fluids and plasmas, possess a shearless curve with a concomitant transport barrier that eliminates or reduces chaotic transport, even after its breakdown. In order to investigate the transport properties of nontwist systems, we analyze the barrier escape time and barrier transmissivity for the standard nontwist map, a paradigm of such systems. We interpret the sensitive dependence of these quantities upon map parameters by investigating chaotic orbit stickiness and the associated role played by the dominant crossing of stable and unstable manifolds.
Anisotropic magnetic properties of Dy{sub 6}Cr{sub 4}Al{sub 43} single crystal
Maurya, Arvind Thamizhavel, A. Dhar, S. K.
2014-04-24
We have studied the anisotropic magnetic behavior of the rare earth intermetallic compound Dy{sub 6}Cr{sub 4}Al{sub 43}. This compound crystallizes in the hexagonal symmetry and orders ferromagnetically at 8.3 K as confirmed by the magnetic susceptibility and heat capacity measurements. A significant anisotropy in the magnetization is observed between the c axis and the ab-plane. The easy axis liesin theab-plane at low temperatures; however it orients itselfalong the c-axis above 170 K as inferred from the susceptibility data.
Transport properties of water at functionalized molecular interfaces
Feng, Jun; Wong, Ka-Yiu; Dyer, Kippi; Pettitt, B. Montgomery
2009-01-01
Understanding transport properties of solvent such as diffusion and viscosity at interfaces with biomacromolecules and hard materials is of fundamental importance to both biology and biotechnology. Our study utilizes equilibrium molecular dynamics simulations to calculate solvent transport properties at a model peptide and microarray surface. Both diffusion and selected components of viscosity are considered. Solvent diffusion is found to be affected near the peptide and surface. The stress-stress correlation function of solvent near the hard surface exhibits long time memory. Both diffusion and viscosity are shown to be closely correlated with the density distribution function of water along the microarray surface. PMID:19791920
Transport properties of water at functionalized molecular interfaces
NASA Astrophysics Data System (ADS)
Feng, Jun; Wong, Ka-Yiu; Dyer, Kippi; Pettitt, B. Montgomery
2009-09-01
Understanding transport properties of solvent such as diffusion and viscosity at interfaces with biomacromolecules and hard materials is of fundamental importance to both biology and biotechnology. Our study utilizes equilibrium molecular dynamics simulations to calculate solvent transport properties at a model peptide and microarray surface. Both diffusion and selected components of viscosity are considered. Solvent diffusion is found to be affected near the peptide and surface. The stress-stress correlation function of solvent near the hard surface exhibits long time memory. Both diffusion and viscosity are shown to be closely correlated with the density distribution function of water along the microarray surface.
Transport properties associated with carbon-phenolic ablators
NASA Technical Reports Server (NTRS)
Biolsi, L.
1982-01-01
Entry vehicle heat shields designed for entry into the atmosphere of the outer planets are usually made of carbonaceous material such as carbon-phenolic ablator. Ablative injection of this material is an important mechanism for reducing the heat at the surface of the entry vehicle. Conductive transport properties in the shock layer are important for some entry conditions. The kinetic theory of gases has been used to calculate the transport properties for 17 gaseous species obtained from the ablation of carbon-phenolic heat shields. Results are presented for the pure species and for the gas mixture.
Single tube electric transport properties of synthesized Titania nanotubes
NASA Astrophysics Data System (ADS)
Abdelmoula, Mohamed; Menon, Latika
2011-03-01
Titania nanotube arrays fabricated by means of electrochemical anodization is currently the main interest of several research groups due to its promising applications. The high aspect ratio, durability, cheap and scalable fabrication technique make it highly attractive material for efficient solar cell. In this regard extensive research work is being carried out to investigate its properties. In our previous work we were able to find a mechanism for separating a single titania nanotube from the titania nanotube arrays and to measure its electric transport properties using e-beam lithography technique, In this work we investigated the effect of thermal annealing on the transport properties, we studied the effect of different annealing temperatures, heating and cooling rates, and in different gases. As a result, we were able to find the optimal annealing conditions to enhance the transport properties in blank titania nanotube. Under these optimal conditions, we were able to study the effect of coating TNTs with N719 dye and gold nanoparticles on the transport properties. As a result of our work we were able to optimize the treatments for more efficient solar cell fabrication.
Modelling Coulomb Collisions in Anisotropic Plasmas
NASA Astrophysics Data System (ADS)
Hellinger, P.; Travnicek, P. M.
2009-12-01
Collisional transport in anisotropic plasmas is investigated comparing the theoretical transport coefficients (Hellinger and Travnicek, 2009) for anisotropic particles with the results of the corresponding Langevin equation, obtained as a generalization of Manheimer et al. (1997). References: Hellinger, P., and P. M. Travnicek (2009), On Coulomb collisions in bi-Maxwellian plasmas, Phys. Plasmas, 16, 054501. Manheimer, W. M., M. Lampe and G. Joyce (1997), Langevin representation of Coulomb collisions in PIC simulations, J. Comput. Phys., 138, 563-584.
Tadiello, L; D'Arienzo, M; Di Credico, B; Hanel, T; Matejka, L; Mauri, M; Morazzoni, F; Simonutti, R; Spirkova, M; Scotti, R
2015-05-28
Silica-styrene butadiene rubber (SBR) nanocomposites were prepared by using shape-controlled spherical and rod-like silica nanoparticles (NPs) with different aspect ratios (AR = 1-5), obtained by a sol-gel route assisted by a structure directing agent. The nanocomposites were used as models to study the influence of the particle shape on the formation of nanoscale immobilized rubber at the silica-rubber interface and its effect on the dynamic-mechanical behavior. TEM and AFM tapping mode analyses of nanocomposites demonstrated that the silica particles are surrounded by a rubber layer immobilized at the particle surface. The spherical filler showed small contact zones between neighboring particles in contact with thin rubber layers, while anisotropic particles (AR > 2) formed domains of rods preferentially aligned along the main axis. A detailed analysis of the polymer chain mobility by different time domain nuclear magnetic resonance (TD-NMR) techniques evidenced a population of rigid rubber chains surrounding particles, whose amount increases with the particle anisotropy, even in the absence of significant differences in terms of chemical crosslinking. Dynamic measurements demonstrate that rod-like particles induce stronger reinforcement of rubber, increasing with the AR. This was related to the self-alignment of the anisotropic silica particles in domains able to immobilize rubber. PMID:25899456
NASA Astrophysics Data System (ADS)
Głaz, Waldemar; Bancewicz, Tadeusz; Godet, Jean-Luc; Gustafsson, Magnus; Haskopoulos, Anastasios; Maroulis, George
2016-07-01
A comprehensive study is presented of many aspects of the depolarized anisotropic collision induced (CI) component of light scattered by weakly bound compounds composed of a dihydrogen molecule and a rare gas (Rg) atom, H2-Rg. The work continues a series of earlier projects marking the revival of interest in linear light scattering following the development of new highly advanced tools of quantum chemistry and other theoretical, computational, and experimental means of spectral analyses. Sophisticated ab initio computing procedures are applied in order to obtain the anisotropic polarizability component's dependence on the H2-Rg geometry. These data are then used to evaluate the CI spectral lines for all types of Rg atoms ranging from He to Xe (Rn excluded). Evolution of the properties of CI spectra with growing polarizability/masses of the complexes studied is observed. Special attention is given to the heaviest, Kr and Xe based, scatterers. The influence of specific factors shaping the spectral lines (e.g., bound and metastable contribution, potential anisotropy) is discussed. Also the share of pressure broadened allowed rotational transitions in the overall spectral profile is taken into account and the extent to which it is separable from the pure CI contribution is discussed. We finish with a brief comparison between the obtained results and available experimental data.
Zhao, Guijuan; Wang, Lianshan; Yang, Shaoyan; Li, Huijie; Wei, Hongyuan; Han, Dongyue; Wang, Zhanguo
2016-01-01
We report the anisotropic structural and optical properties of semi-polar (11–22) GaN grown on m-plane sapphire using a three-step growth method which consisted of a low temperature AlN buffer layer, followed by a high temperature AlN buffer layer and GaN growth. By introducing double AlN buffer layers, we substantially improve the crystal and optical qualities of semi-polar (11–22) GaN, and significantly reduce the density of stacking faults and dislocations. The high resolution x-ray diffraction measurement revealed that the in-plane anisotropic structural characteristics of GaN layer are azimuthal dependent. Transmission electron microscopy analysis showed that the majority of dislocations in the GaN epitaxial layer grown on m-sapphire are the mixed-type and the orientation of GaN layer was rotated 58.4° against the substrate. The room temperature photoluminescence (PL) spectra showed the PL intensity and wavelength have polarization dependence along parallel and perpendicular to the [1–100] axis (polarization degrees ~ 0.63). The realization of a high polarization semi-polar GaN would be useful to achieve III-nitride based lighting emission device for displays and backlighting. PMID:26861595
Cuenca, Jacques Van der Kelen, Christophe; Göransson, Peter
2014-02-28
This paper proposes an inverse estimation method for the characterisation of the elastic and anelastic properties of the frame of anisotropic open-cell foams used for sound absorption. A model of viscoelasticity based on a fractional differential constitutive equation is used, leading to an augmented Hooke's law in the frequency domain, where the elastic and anelastic phenomena appear as distinctive terms in the stiffness matrix. The parameters of the model are nine orthotropic elastic moduli, three angles of orientation of the material principal directions and three parameters governing the anelastic frequency dependence. The inverse estimation consists in numerically fitting the model on a set of transfer functions extracted from a sample of material. The setup uses a seismic-mass measurement repeated in the three directions of space and is placed in a vacuum chamber in order to remove the air from the pores of the sample. The method allows to reconstruct the full frequency-dependent complex stiffness matrix of the frame of an anisotropic open-cell foam and in particular it provides the frequency of maximum energy dissipation by viscoelastic effects. The characterisation of a melamine foam sample is performed and the relation between the fractional-derivative model and other types of parameterisations of the augmented Hooke's law is discussed.
NASA Astrophysics Data System (ADS)
Zhao, Guijuan; Wang, Lianshan; Yang, Shaoyan; Li, Huijie; Wei, Hongyuan; Han, Dongyue; Wang, Zhanguo
2016-02-01
We report the anisotropic structural and optical properties of semi-polar (11-22) GaN grown on m-plane sapphire using a three-step growth method which consisted of a low temperature AlN buffer layer, followed by a high temperature AlN buffer layer and GaN growth. By introducing double AlN buffer layers, we substantially improve the crystal and optical qualities of semi-polar (11-22) GaN, and significantly reduce the density of stacking faults and dislocations. The high resolution x-ray diffraction measurement revealed that the in-plane anisotropic structural characteristics of GaN layer are azimuthal dependent. Transmission electron microscopy analysis showed that the majority of dislocations in the GaN epitaxial layer grown on m-sapphire are the mixed-type and the orientation of GaN layer was rotated 58.4° against the substrate. The room temperature photoluminescence (PL) spectra showed the PL intensity and wavelength have polarization dependence along parallel and perpendicular to the [1-100] axis (polarization degrees ~ 0.63). The realization of a high polarization semi-polar GaN would be useful to achieve III-nitride based lighting emission device for displays and backlighting.
Zhao, Guijuan; Wang, Lianshan; Yang, Shaoyan; Li, Huijie; Wei, Hongyuan; Han, Dongyue; Wang, Zhanguo
2016-01-01
We report the anisotropic structural and optical properties of semi-polar (11-22) GaN grown on m-plane sapphire using a three-step growth method which consisted of a low temperature AlN buffer layer, followed by a high temperature AlN buffer layer and GaN growth. By introducing double AlN buffer layers, we substantially improve the crystal and optical qualities of semi-polar (11-22) GaN, and significantly reduce the density of stacking faults and dislocations. The high resolution x-ray diffraction measurement revealed that the in-plane anisotropic structural characteristics of GaN layer are azimuthal dependent. Transmission electron microscopy analysis showed that the majority of dislocations in the GaN epitaxial layer grown on m-sapphire are the mixed-type and the orientation of GaN layer was rotated 58.4° against the substrate. The room temperature photoluminescence (PL) spectra showed the PL intensity and wavelength have polarization dependence along parallel and perpendicular to the [1-100] axis (polarization degrees ~ 0.63). The realization of a high polarization semi-polar GaN would be useful to achieve III-nitride based lighting emission device for displays and backlighting. PMID:26861595
Głaz, Waldemar; Bancewicz, Tadeusz; Godet, Jean-Luc; Gustafsson, Magnus; Haskopoulos, Anastasios; Maroulis, George
2016-07-21
A comprehensive study is presented of many aspects of the depolarized anisotropic collision induced (CI) component of light scattered by weakly bound compounds composed of a dihydrogen molecule and a rare gas (Rg) atom, H2-Rg. The work continues a series of earlier projects marking the revival of interest in linear light scattering following the development of new highly advanced tools of quantum chemistry and other theoretical, computational, and experimental means of spectral analyses. Sophisticated ab initio computing procedures are applied in order to obtain the anisotropic polarizability component's dependence on the H2-Rg geometry. These data are then used to evaluate the CI spectral lines for all types of Rg atoms ranging from He to Xe (Rn excluded). Evolution of the properties of CI spectra with growing polarizability/masses of the complexes studied is observed. Special attention is given to the heaviest, Kr and Xe based, scatterers. The influence of specific factors shaping the spectral lines (e.g., bound and metastable contribution, potential anisotropy) is discussed. Also the share of pressure broadened allowed rotational transitions in the overall spectral profile is taken into account and the extent to which it is separable from the pure CI contribution is discussed. We finish with a brief comparison between the obtained results and available experimental data. PMID:27448883
Reference Fluid Thermodynamic and Transport Properties Database (REFPROP)
National Institute of Standards and Technology Data Gateway
SRD 23 NIST Reference Fluid Thermodynamic and Transport Properties Database (REFPROP) (PC database for purchase) NIST 23 contains revised data in a Windows version of the database, including 105 pure fluids and allowing mixtures of up to 20 components. The fluids include the environmentally acceptable HFCs, traditional HFCs and CFCs and 'natural' refrigerants like ammonia
Properties and Transport Behavior among 12 Different Environmental Escherichia coli
Technology Transfer Automated Retrieval System (TEKTRAN)
Escherichia coli is a commonly used indicator organism for detecting the presence of fecal-borne pathogenic microorganisms in water supplies. The importance of E. coli as an indicator organism has led to numerous studies looking at cell properties and transport behavior of this microorganism. In man...
Oxygen transport properties estimation by DSMC-CT simulations
Bruno, Domenico; Frezzotti, Aldo; Ghiroldi, Gian Pietro
2014-12-09
Coupling DSMC simulations with classical trajectories calculations is emerging as a powerful tool to improve predictive capabilities of computational rarefied gas dynamics. The considerable increase of computational effort outlined in the early application of the method (Koura,1997) can be compensated by running simulations on massively parallel computers. In particular, GPU acceleration has been found quite effective in reducing computing time (Ferrigni,2012; Norman et al.,2013) of DSMC-CT simulations. The aim of the present work is to study rarefied Oxygen flows by modeling binary collisions through an accurate potential energy surface, obtained by molecular beams scattering (Aquilanti, et al.,1999). The accuracy of the method is assessed by calculating molecular Oxygen shear viscosity and heat conductivity following three different DSMC-CT simulation methods. In the first one, transport properties are obtained from DSMC-CT simulations of spontaneous fluctuation of an equilibrium state (Bruno et al, Phys. Fluids, 23, 093104, 2011). In the second method, the collision trajectory calculation is incorporated in a Monte Carlo integration procedure to evaluate the Taxman’s expressions for the transport properties of polyatomic gases (Taxman,1959). In the third, non-equilibrium zero and one-dimensional rarefied gas dynamic simulations are adopted and the transport properties are computed from the non-equilibrium fluxes of momentum and energy. The three methods provide close values of the transport properties, their estimated statistical error not exceeding 3%. The experimental values are slightly underestimated, the percentage deviation being, again, few percent.
Computer programs for thermodynamic and transport properties of hydrogen
NASA Technical Reports Server (NTRS)
Hall, W. J.; Mc Carty, R. D.; Roder, H. M.
1968-01-01
Computer program subroutines provide the thermodynamic and transport properties of hydrogen in tabular form. The programs provide 18 combinations of input and output variables. This program is written in FORTRAN 4 for use on the IBM 7044 or CDC 3600 computers.
Transport Properties of Metallic Ruthenates: A DFT +DMFT Investigation
NASA Astrophysics Data System (ADS)
Deng, Xiaoyu; Haule, Kristjan; Kotliar, Gabriel
2016-06-01
We present a systematical theoretical study on the transport properties of an archetypal family of Hund's metals, Sr2RuO4 , Sr3 Ru2 O7 , SrRuO3 , and CaRuO3 , within the combination of first principles density functional theory and dynamical mean field theory. The agreement between theory and experiments for optical conductivity and resistivity is good, which indicates that electron-electron scattering dominates the transport of ruthenates. We demonstrate that in the single-site dynamical mean field approach the transport properties of Hund's metals fall into the scenario of "resilient quasiparticles." We explain why the single layered compound Sr2 RuO4 has a relative weak correlation with respect to its siblings, which corroborates its good metallicity.
Effects of nanosized constriction on thermal transport properties of graphene
2014-01-01
Thermal transport properties of graphene with nanosized constrictions are investigated using nonequilibrium molecular dynamics simulations. The results show that the nanosized constrictions have a significant influence on the thermal transport properties of graphene. The thermal resistance of the nanosized constrictions is on the order of 107 to 109 K/W at 150 K, which reduces the thermal conductivity by 7.7% to 90.4%. It is also found that the constriction resistance is inversely proportional to the width of the constriction and independent of the heat current. Moreover, we developed an analytical model for the ballistic thermal resistance of the nanosized constrictions in two-dimensional nanosystems. The theoretical prediction agrees well with the simulation results in this paper, which suggests that the thermal transport across the nanosized constrictions in two-dimensional nanosystems is ballistic in nature. PACS 65.80.CK; 61.48.Gh; 63.20.kp; 31.15.xv PMID:25232292
Transport Properties of Metallic Ruthenates: A DFT+DMFT Investigation.
Deng, Xiaoyu; Haule, Kristjan; Kotliar, Gabriel
2016-06-24
We present a systematical theoretical study on the transport properties of an archetypal family of Hund's metals, Sr_{2}RuO_{4}, Sr_{3}Ru_{2}O_{7}, SrRuO_{3}, and CaRuO_{3}, within the combination of first principles density functional theory and dynamical mean field theory. The agreement between theory and experiments for optical conductivity and resistivity is good, which indicates that electron-electron scattering dominates the transport of ruthenates. We demonstrate that in the single-site dynamical mean field approach the transport properties of Hund's metals fall into the scenario of "resilient quasiparticles." We explain why the single layered compound Sr_{2}RuO_{4} has a relative weak correlation with respect to its siblings, which corroborates its good metallicity. PMID:27391734
Mass-Transport Properties In Growth Of Crystals From Vapors
NASA Technical Reports Server (NTRS)
Wiedemeier, H.
1992-01-01
Brief report summarizes results of experimental and theoretical studies of mass-transport properties of GeSe/Gel4 and Hg0.8Cd0.2Te systems in connection with growth of crystals in closed ampoules. Primary emphasis in studies was on thermochemical analyses, on development of mathematical models to predict diffusion-limited mass transport, and on comparison of theoretically predicted with experimental fluxes. Results applied to design, preparation, performance, and analysis of crystal-growth experiments of semiconducting materials on Earth and in outer space. Model extended to predict mass flux and overall composition of transport products of Hg0.8Cd0.2Te transport system.
Transport properties in semiconducting NbS{sub 2} nanoflakes
Huang, Y. H.; Chen, R. S. Ho, C. H.; Peng, C. C.; Huang, Y. S.
2014-09-01
The electronic transport properties in individual niobium disulphide (NbS{sub 2}) nanoflakes mechanically exfoliated from the bulk crystal with three rhombohedral (3R) structure grown by chemical vapor transport were investigated. It is found that the conductivity values of the single-crystalline nanoflakes are approximately two orders of magnitude lower than that of their bulk counterparts. Temperature-dependent conductivity measurements show that the 3R-NbS{sub 2} nanoflakes exhibit semiconducting transport behavior, which is also different from the metallic character in the bulk crystals. In addition, the noncontinuous conductivity variations were observed at the temperature below 180 K for both the nanoflakes and the bulks, which is attributed to the probable charge density wave transition. The photoconductivities in the semiconducting nanoflakes were also observed under the excitation at 532 nm wavelength. The probable mechanisms resulting in the different transport behaviors between the NbS{sub 2} nanostructure and bulk were discussed.
Review on measurement techniques of transport properties of nanowires.
Rojo, Miguel Muñoz; Calero, Olga Caballero; Lopeandia, A F; Rodriguez-Viejo, J; Martín-Gonzalez, Marisol
2013-12-01
Physical properties at the nanoscale are novel and different from those in bulk materials. Over the last few decades, there has been an ever growing interest in the fabrication of nanowire structures for a wide variety of applications including energy generation purposes. Nevertheless, the study of their transport properties, such as thermal conductivity, electrical conductivity or Seebeck coefficient, remains an experimental challenge. For instance, in the particular case of nanostructured thermoelectrics, theoretical calculations have shown that nanowires offer a promising way of enhancing the hitherto low efficiency of these materials in the conversion of temperature differences into electricity. Therefore, within the thermoelectrical community there has been a great experimental effort in the measurement of these quantities in actual nanowires. The measurements of these properties at the nanoscale are also of interest in fields other than energy, such as electrical components for microchips, field effect transistors, sensors, and other low scale devices. For all these applications, knowing the transport properties is mandatory. This review deals with the latest techniques developed to perform the measurement of these transport properties in nanowires. A thorough overview of the most important and modern techniques used for the characterization of different kinds of nanowires will be shown. PMID:24113712
Wentzel-Bardeen singularity in coupled Luttinger liquids: Transport properties
Martin, T.
1994-08-26
The recent progress on 1 D interacting electrons systems and their applications to study the transport properties of quasi one dimensional wires is reviewed. We focus on strongly correlated elections coupled to low energy acoustic phonons in one dimension. The exponents of various response functions are calculated, and their striking sensitivity to the Wentzel-Bardeen singularity is discussed. For the Hubbard model coupled to phonons the equivalent of a phase diagram is established. By increasing the filling factor towards half filling the WB singularity is approached. This in turn suppresses antiferromagnetic fluctuations and drives the system towards the superconducting regime, via a new intermediate (metallic) phase. The implications of this phenomenon on the transport properties of an ideal wire as well as the properties of a wire with weak or strong scattering are analyzed in a perturbative renormalization group calculation. This allows to recover the three regimes predicted from the divergence criteria of the response functions.
Transport processes in partially saturate concrete: Testing and liquid properties
NASA Astrophysics Data System (ADS)
Villani, Chiara
The measurement of transport properties of concrete is considered by many to have the potential to serve as a performance criterion that can be related to concrete durability. However, the sensitivity of transport tests to several parameters combined with the low permeability of concrete complicates the testing. Gas permeability and diffusivity test methods are attractive due to the ease of testing, their non-destructive nature and their potential to correlate to in-field carbonation of reinforced concrete structures. This work was aimed at investigating the potential of existing gas transport tests as a way to reliably quantify transport properties in concrete. In this study gas permeability and diffusivity test methods were analyzed comparing their performance in terms of repeatability and variability. The influence of several parameters was investigated such as moisture content, mixture proportions and gas flow. A closer look to the influence of pressure revealed an anomalous trend of permeability with respect to pressure. An alternative calculation is proposed in an effort to move towards the determination of intrinsic material properties that can serve as an input for service life prediction models. The impact of deicing salts exposure was also analyzed with respect to their alteration of the degree of saturation as this may affect gas transport in cementitious materials. Limited information were previously available on liquid properties over a wide range of concentrations. To overcome this limitation, this study quantified surface tension, viscosity in presence of deicing salts in a broad concentration range and at different temperatures. Existing models were applied to predict the change of fluid properties during drying. Vapor desorption isotherms were obtained to investigate the influence of deicing salts presence on the non-linear moisture diffusion coefficient. Semi-empirical models were used to quantify the initiation and the rate of drying using liquid
Vetrov, S Ya; Timofeev, I V; Pankin, P S
2014-09-30
We have studied the spectral properties of a one-dimensional photonic crystal with a structure defect that represents an anisotropic nanocomposite layer sandwiched between two multilayer dielectric mirrors. The nanocomposite consists of metallic nanoscale inclusions of orientationally ordered spheroidal shape, dispersed in a transparent matrix, and is characterised by an effective resonant permittivity. Each of the two orthogonal polarisations of probe radiation corresponds to a particular plasmon resonant frequency of the nanocomposite. The problem of calculating the transmittance spectrum of the waves with s- and p-polarisations for such structures is solved. Spectral manifestation of splitting of the defect mode depending on the structure parameters and volumetric fraction of the nanospheroids is studied. The essential dependence of the position of maxima of the defect modes in the bandgap of the photonic crystal and their splitting on the incidence angle, polarisation, and the ratio of lengths of the polar and equatorial semi-axes of the spheroidal nanoparticles is shown. (photonic crystals)
NASA Astrophysics Data System (ADS)
Ghoufi, Aziz; Morineau, Denis; Lefort, Ronan; Malfreyt, Patrice
2011-01-01
Molecular simulations in the isothermal statistical ensembles require that the macroscopic thermal and mechanical equilibriums are respected and that the local values of these properties are constant at every point in the system. The thermal equilibrium in Monte Carlo simulations can be checked through the calculation of the configurational temperature, {k_BT_{conf}={< |nabla _r U({r}^N)|2>}/{< nabla _r{^2} U({r}^N) >}}, where nabla _r is the nabla operator of position vector r. As far as we know, T_{conf} was never calculated with the anisotropic Gay-Berne potential, whereas the calculation of T_{conf} is much more widespread with more common potentials (Lennard Jones, electrostatic, …). We establish here an operational expression of the macroscopic and local configurational temperatures, and we investigate locally the isotropic liquid phase, the liquid / vapor interface, and the isotropic-nematic transition by Monte Carlo simulations.
Ghoufi, Aziz; Morineau, Denis; Lefort, Ronan; Malfreyt, Patrice
2011-01-21
Molecular simulations in the isothermal statistical ensembles require that the macroscopic thermal and mechanical equilibriums are respected and that the local values of these properties are constant at every point in the system. The thermal equilibrium in Monte Carlo simulations can be checked through the calculation of the configurational temperature, k(B)T(conf)=<|∇(r)U(r(N))|(2)>/<∇(r) (2)U(r(N))>, where ∇(r) is the nabla operator of position vector r. As far as we know, T(conf) was never calculated with the anisotropic Gay-Berne potential, whereas the calculation of T(conf) is much more widespread with more common potentials (Lennard Jones, electrostatic, ...). We establish here an operational expression of the macroscopic and local configurational temperatures, and we investigate locally the isotropic liquid phase, the liquid / vapor interface, and the isotropic-nematic transition by Monte Carlo simulations. PMID:21261339
Sakakibara, H. Ando, H.; Kuroki, Y.; Kawai, S.; Ueda, K.; Asano, H.
2015-05-07
Epitaxial bilayers of antiferromagnetic Mn{sub 3}GaN/ferromagnetic Co{sub 3}FeN with an antiperovskite structure were grown by reactive magnetron sputtering, and their structural, magnetic, and electrical properties were investigated. Exchange coupling with an exchange field H{sub ex} of 0.4 kOe at 4 K was observed for Mn{sub 3}GaN (20 nm)/Co{sub 3}FeN (5 nm) bilayers. Negative anisotropic magnetoresistance (AMR) effect in Co{sub 3}FeN was observed and utilized to detect magnetization reversal in exchange-coupled Mn{sub 3}GaN/Co{sub 3}FeN bilayers. The AMR results showed evidence for current-induced spin transfer torque in antiferromagnetic Mn{sub 3}GaN.
Magneto-optical transport properties of monolayer WSe2
NASA Astrophysics Data System (ADS)
Tahir, M.; Vasilopoulos, P.
2016-07-01
The recent experimental realization of a high quality WSe2 leads to the possibility of magneto-optical measurements and the manipulation of the spin and valley degrees of freedom. We study the influence of the very strong spin-orbit coupling and of the anisotropic lifting of the valley pseudospin degeneracy on its magnetotransport properties. The energy spectrum of WSe2 is derived and discussed in the presence of a perpendicular magnetic field B . Correspondingly we evaluate the magneto-optical Hall conductivity and the optical longitudinal conductivity as functions of the frequency, magnetic field, and Fermi energy. They are strongly influenced by the field B and the strong spin splitting. The former exhibits valley polarization and the latter beatings of oscillations. The magneto-optical responses can be tuned in two different regimes: the microwave-to-terahertz regime and the visible-frequency one. The absorption peaks involving the n =0 LL appear in between these two regimes and show a magnetic control of the spin and valley splittings. We also evaluate the power absorption spectrum.
Charge carrier transport properties in layer structured hexagonal boron nitride
NASA Astrophysics Data System (ADS)
Doan, T. C.; Li, J.; Lin, J. Y.; Jiang, H. X.
2014-10-01
Due to its large in-plane thermal conductivity, high temperature and chemical stability, large energy band gap (˜ 6.4 eV), hexagonal boron nitride (hBN) has emerged as an important material for applications in deep ultraviolet photonic devices. Among the members of the III-nitride material system, hBN is the least studied and understood. The study of the electrical transport properties of hBN is of utmost importance with a view to realizing practical device applications. Wafer-scale hBN epilayers have been successfully synthesized by metal organic chemical deposition and their electrical transport properties have been probed by variable temperature Hall effect measurements. The results demonstrate that undoped hBN is a semiconductor exhibiting weak p-type at high temperatures (> 700 °K). The measured acceptor energy level is about 0.68 eV above the valence band. In contrast to the electrical transport properties of traditional III-nitride wide bandgap semiconductors, the temperature dependence of the hole mobility in hBN can be described by the form of μ ∝ (T/T0)-α with α = 3.02, satisfying the two-dimensional (2D) carrier transport limit dominated by the polar optical phonon scattering. This behavior is a direct consequence of the fact that hBN is a layer structured material. The optical phonon energy deduced from the temperature dependence of the hole mobility is ħω = 192 meV (or 1546 cm-1), which is consistent with values previously obtained using other techniques. The present results extend our understanding of the charge carrier transport properties beyond the traditional III-nitride semiconductors.
Intrinsic electronic and transport properties of graphyne sheets and nanoribbons.
Wu, Wenzhi; Guo, Wanlin; Zeng, Xiao Cheng
2013-10-01
Graphyne, a two-dimensional carbon allotrope like graphene but containing doubly and triply bonded carbon atoms, has been proven to possess amazing electronic properties as graphene. Although the electronic, optical, and mechanical properties of graphyne and graphyne nanoribbons (NRs) have been previously studied, their electron transport behaviors have not been understood. Here we report a comprehensive study of the intrinsic electronic and transport properties of four distinct polymorphs of graphyne (α, β, γ, and 6,6,12-graphynes) and their nanoribbons (GyNRs) using density functional theory coupled with the non-equilibrium Green's function (NEGF) method. Among the four graphyne sheets, 6,6,12-graphyne displays notable directional anisotropy in the transport properties. Among the GyNRs, those with armchair edges are nonmagnetic semiconductors whereas those with zigzag edges can be either antiferromagnetic or nonmagnetic semiconductors. Among the armchair GyNRs, the α-GyNRs and 6,6,12-GyNRs exhibit distinctive negative differential resistance (NDR) behavior. On the other hand, the zigzag α-GyNRs and zigzag 6,6,12-GyNRs exhibit symmetry-dependent transport properties, that is, asymmetric zigzag GyNRs behave as conductors with nearly linear current-voltage dependence, whereas symmetric GyNRs produce very weak currents due to the presence of a conductance gap around the Fermi level under finite bias voltages. Such symmetry-dependent behavior stems from different coupling between π* and π subbands. Unlike α- and 6,6,12-GyNRs, both zigzag β-GyNRs and zigzag γ-GyNRs exhibit NDR behavior regardless of the symmetry. PMID:23949158
Transport properties of the calcium ionophore ETH-129.
Wang, E; Erdahl, W L; Hamidinia, S A; Chapman, C J; Taylor, R W; Pfeiffer, D R
2001-12-01
The transport mechanism and specificities of ionophore ETH-29 have been investigated in a highly defined phospholipid vesicle system, with the goal of facilitating the application of this compound to biological problems. ETH-129 transports Ca(2+) via an electrogenic mechanism, in contrast to A23187 and ionomycin, which function in a charge neutral manner. The rate of transport is a function of membrane potential, increasing by 3.9-fold per 59 mV over a broad range of that parameter. Rate is independent of the transmembrane pH gradient and strongly stimulated by the uncoupler carbonyl cyanide m-chlorophenylhydrazone when no external potential has been applied. The effect of uncoupler reflects the collapse of an opposing potential arising during Ca(2+) transport, but also reflects the formation of a mixed complex between the uncoupler, ETH-129, and Ca(2+) that readily permeates the vesicle membrane. Oleate does not substitute for the uncoupler in either regard. ETH-129 transports polyvalent cations according to the selectivity sequence La(3+) > Ca(2+) > Zn(2+) approximately equal to Sr(2+) > Co(2+) approximately equal to Ni(2+) approximately equal to Mn(2+), with the magnitude of the selectivity coefficients reflecting the cation concentration range considered. There is little or no activity for the transport of Na(+), K(+), and Mg(2+). These properties suggest that ETH-129 will be useful for investigating the consequences of a mitochondrial Ca(2+) overload in mammalian cells, which is difficult to pursue through the application of electroneutral ionophores. PMID:11720991
Zhao, Ying-Ying; Wang, Jing; Kuang, Hao; Hu, Feng-Xia; Liu, Yao; Wu, Rong-Rong; Zhang, Xi-Xiang; Sun, Ji-Rong; Shen, Bao-Gen
2015-01-01
Memory effect of electric-field control on magnetic behavior in magnetoelectric composite heterostructures has been a topic of interest for a long time. Although the piezostrain and its transfer across the interface of ferroelectric/ferromagnetic films are known to be important in realizing magnetoelectric coupling, the underlying mechanism for nonvolatile modulation of magnetic behaviors remains a challenge. Here, we report on the electric-field control of magnetic properties in wide-band (011)-Pr0.7Sr0.3MnO3/0.7Pb(Mg1/3Nb2/3)O3-0.3PbTiO3 heterostructures. By introducing an electric-field-induced in-plane anisotropic strain field during the cooling process from room temperature, we observe an in-plane anisotropic, nonvolatile modulation of magnetic properties in a wide-band Pr0.7Sr0.3MnO3 film at low temperatures. We attribute this anisotropic memory effect to the preferential seeding and growth of ferromagnetic (FM) domains under the anisotropic strain field. In addition, we find that the anisotropic, nonvolatile modulation of magnetic properties gradually diminishes as the temperature approaches FM transition, indicating that the nonvolatile memory effect is temperature dependent. By taking into account the competition between thermal energy and the potential barrier of the metastable magnetic state induced by the anisotropic strain field, this distinct memory effect is well explained, which provides a promising approach for designing novel electric-writing magnetic memories. PMID:25909177
NASA Astrophysics Data System (ADS)
Zhao, Ying-Ying; Wang, Jing; Kuang, Hao; Hu, Feng-Xia; Liu, Yao; Wu, Rong-Rong; Zhang, Xi-Xiang; Sun, Ji-Rong; Shen, Bao-Gen
2015-04-01
Memory effect of electric-field control on magnetic behavior in magnetoelectric composite heterostructures has been a topic of interest for a long time. Although the piezostrain and its transfer across the interface of ferroelectric/ferromagnetic films are known to be important in realizing magnetoelectric coupling, the underlying mechanism for nonvolatile modulation of magnetic behaviors remains a challenge. Here, we report on the electric-field control of magnetic properties in wide-band (011)-Pr0.7Sr0.3MnO3/0.7Pb(Mg1/3Nb2/3)O3-0.3PbTiO3 heterostructures. By introducing an electric-field-induced in-plane anisotropic strain field during the cooling process from room temperature, we observe an in-plane anisotropic, nonvolatile modulation of magnetic properties in a wide-band Pr0.7Sr0.3MnO3 film at low temperatures. We attribute this anisotropic memory effect to the preferential seeding and growth of ferromagnetic (FM) domains under the anisotropic strain field. In addition, we find that the anisotropic, nonvolatile modulation of magnetic properties gradually diminishes as the temperature approaches FM transition, indicating that the nonvolatile memory effect is temperature dependent. By taking into account the competition between thermal energy and the potential barrier of the metastable magnetic state induced by the anisotropic strain field, this distinct memory effect is well explained, which provides a promising approach for designing novel electric-writing magnetic memories.
Electrical Transport Properties of Liquid Al-Cu Alloys
NASA Astrophysics Data System (ADS)
Thakore, B. Y.; Khambholja, S. G.; Suthar, P. H.; Jani, A. R.
2010-06-01
Electrical transport properties viz. electrical resistivity, thermoelectric power and thermal conductivity of liquid Al-Cu alloys as a function of Cu concentration have been studied in the present paper. Ashcroft empty core model potential has been used to incorporate the ion-electron interaction. To incorporate the exchange and correlation effects, five different forms of local field correction functions viz. Hartree, Taylor, Ichimaru et al., Farid et al. and Sarkar et al. have been used. The transport properties of binary system have been studied using Faber-Ziman formulation combined with Ashcroft-Langreth (AL) partial structure factor. The computed values of electrical resistivity are compared with experimental data and for low Cu concentration, good agreement has been observed. Further, thermoelectric power and thermal conductivity have also been predicted.
Electrical transport properties of manganite powders under pressure
NASA Astrophysics Data System (ADS)
Rodríguez, M. G.; Leyva, A. G.; Acha, C.
2012-08-01
We have measured the electrical resistance of micrometric to nanometric powders of the LaPryCaMnO3 (LPCMO with y=0.3) manganite for hydrostatic pressures up to 4 kbar. By applying different final thermal treatments to samples synthesized by a microwave assisted denitration process, we obtained two particular grain characteristic dimensions (40 nm and 1000 nm) which allowed us to analyze the grain size sensitivity of the electrical conduction properties of both the metal electrode interface with manganite (Pt/LPCMO) and the intrinsic intergranular interfaces formed by the LPCMO powder, conglomerate under the only effect of external pressure. We also analyzed the effects of pressure on the phase diagram of these powders. Our results indicate that different magnetic phases coexist at low temperatures and that the electrical transport properties are related to the intrinsic interfaces, as we observe evidences of a granular behavior and an electronic transport dominated by the Space Charge limited Current mechanism.
Transport properties of two finite armchair graphene nanoribbons.
Rosales, Luis; González, Jhon W
2013-01-01
: In this work, we present a theoretical study of the transport properties of two finite and parallel armchair graphene nanoribbons connected to two semi-infinite leads of the same material. Using a single Π-band tight binding Hamiltonian and based on Green's function formalisms within a real space renormalization techniques, we have calculated the density of states and the conductance of these systems considering the effects of the geometric confinement and the presence of a uniform magnetic field applied perpendicularly to the heterostructure. Our results exhibit a resonant tunneling behaviour and periodic modulations of the transport properties as a function of the geometry of the considered conductors and as a function of the magnetic flux that crosses the heterostructure. We have observed Aharonov-Bohm type of interference representing by periodic metal-semiconductor transitions in the DOS and conductance curves of the nanostructures. PMID:23279756
Transport properties of two finite armchair graphene nanoribbons
2013-01-01
In this work, we present a theoretical study of the transport properties of two finite and parallel armchair graphene nanoribbons connected to two semi-infinite leads of the same material. Using a single Π-band tight binding Hamiltonian and based on Green’s function formalisms within a real space renormalization techniques, we have calculated the density of states and the conductance of these systems considering the effects of the geometric confinement and the presence of a uniform magnetic field applied perpendicularly to the heterostructure. Our results exhibit a resonant tunneling behaviour and periodic modulations of the transport properties as a function of the geometry of the considered conductors and as a function of the magnetic flux that crosses the heterostructure. We have observed Aharonov-Bohm type of interference representing by periodic metal-semiconductor transitions in the DOS and conductance curves of the nanostructures. PMID:23279756
Modeling transport properties of inhomogeneous superconductor-metal composites
Borroto, A.; Altshuler, E.; Del Río, L.; Arronte, M.; Johansen, T. H.
2014-11-17
We propose a model for a superconductor-metal composite that allows to derive intrinsic transport properties of the superconducting phase based on 2D images of its cross section, and a minimal set of parameters. The method is tested experimentally by using, as model composite, a “transversal bridge” made on a Bi{sub 2}Sr{sub 2}Ca{sub 2}Cu{sub 3}O{sub 10+x} (BSCCO)-Ag multi-filamentary tape. It is shown that the approach allows to predict the measured I−〈E〉 curves of the filaments. In addition, one can determine the critical current anisotropy between the longitudinal and transverse directions of the Ag-BSCCO tape, and also of its superconducting filaments separately, which emphasizes the role of the morphology of the composite in the transport properties.
Transport properties and microstructural characteristics of a thermally cracked mylonite
NASA Astrophysics Data System (ADS)
Le Ravalec, M.; Darot, M.; Reuschlé, T.; Guéguen, Y.
1996-03-01
An experimental study was carried out on a granitic mylonite (La Bresse, France) to analyze the influence of pore microstructure on transport properties. Different crack networks were obtained by a controlled thermal treatment. Microstructures were analyzed by means of gas adsorption and mercury porosimetry. Transport properties have been investigated by measuring gas permeability and electrical conductivity. The dependence of permeability on confining pressure shows an exponential decrease, characteristic of a porosity made of cracks. Correlations between measured parameters have been analyzed by comparing them with relations deduced from theoretical models. Linking the formation factor to the porosity leads to a rather low tortuosity value (about 2.4), characterizing a medium with a well connected porosity. Correlation between permeability k and formation factor F leads to a power-law relation k ∝ F -n where n≈2.9, which is consistent with a crack model describing the behavior of the thermally treated rock.
Low temperature transport properties of Ce-Al metallic glasses
Zeng, Q. S.; Rotundu, C. R.; Mao, W. L.; Dai, J. H.; Xiao, Y. M.; Chow, P.; Chen, X. J.; Qin, C. L.; Mao, H.-k.; Jiang, J. Z.
2011-01-01
The low temperature transport properties of Ce_{75- x} Al_{25+ x} (x = 0, 10, and 15 at. %) metallic glasses were investigated. Magnetic field and composition tuned magnetoresistances changing from negative to positive values were observed at low temperature. It was suggested that these peculiar phenomena were caused by the tunable competition between the Kondo effect and the Ruderman-Kittel-Kasuya-Yoshida interaction in Ce-Al metallic glass with the variation in Ce content and magnetic field. Further magnetization and Ce-2p3d resonant inelastic x-ray scattering spectroscopy measurements supported this scenario. These Ce-Al metallic glasses could provide an interesting model system for the investigation of 4f electron behaviors in complex condensed matter with tunable transport properties.
Synthesis and anisotropic properties of single crystalline Ln2Ru3Al15+x (Ln=Gd, Tb)
NASA Astrophysics Data System (ADS)
Morrison, Gregory; Prestigiacomo, Joseph; Haldolaarachchige, Neel; Rai, Binod K.; Young, David P.; Stadler, Shane; Morosan, Emilia; Chan, Julia Y.
2016-04-01
Single crystals of Ln2Ru3Al15+x (Ln=Gd, Tb) have been grown using the self-flux method under Ru-poor conditions. The structure of the Gd analog is found to be highly dependent on the synthesis method. Gd2Ru3Al15.08 orders antiferromagnetically at 17.5 K. Tb2Ru3Al15.05 enters an antiferromagnetic state at 16.6 K followed by a likely incommensurate-to-commensurate transition at 14.9 K for crystals oriented with H//ab. For crystals oriented with H//c, a broad maximum is observed in the temperature dependent M/H, indicative of a highly anisotropic magnetic system with the hard axis in the c-direction. The magnetization as a function of field and magnetoresistance along the ab-direction of Tb2Ru3Al15.05 display a stepwise behavior and indicate strong crystalline electric field effects.
NASA Astrophysics Data System (ADS)
Wall, B.; Katter, M.; Rodewald, W.; Velicescu, M.
In cast Sm2Fe17 ingots minor fractions of SmFe2 and SmFe3 may occur. Nitrogenation of such alloy-powders inidicates that only Sm2Fe17 forms an interstitial solid solution whereas SmFe2 and SmFe3 decompose directly into SmN and α-Fe. From Sm2Fe17Nx alloy powders with an average particle size of about 3 μm anisotropic magnets were prepared by adding 15 wt% Zn-powder. Annealing at 390 ºC results in intrinsic coercivities > 15 kOe promoted by the formation of an unknown binary Fe8Zn92-compound. Whereas annealing at temperatures > 420 ºC leads to the formation of binary Fe3Zn7 and ternary Sm2FeZn2. By the formation of Sm2FeZn2 from Sm2Fe17Nx+Zn some α-Fe occurs inducing a step in the demagnetization curve J(H).
Volume transport and property distributions of the Mozambique Channel
NASA Astrophysics Data System (ADS)
DiMarco, Steven F.; Chapman, Piers; Nowlin, Worth D.; Hacker, Peter; Donohue, Kathleen; Luther, Mark; Johnson, Gregory C.; Toole, John
We summarize previous estimates of volume transport and property distributions through the Mozambique Channel and offer additional estimates and measurements based on recently acquired hydrographic and float data. Previously published property distributions are consistent with southward spreading through the Channel. Waters of the Mozambique Channel are characterized by shallow and intermediate oxygen minima separated by a relative maximum. Based on hydrographic sections, the intermediate maximum in dissolved oxygen is seen to decrease in value as it spreads southward. The highest values are found in the westward flow of the South Equatorial Current just north of Madagascar and within the western 200 km of the Channel. Similarly, oxygen concentrations at the intermediate oxygen minimum, which derives from the Arabian Sea, increase southwards, while its depth increases from 900 to 1100 m, supporting previous studies and indicating southward spreading and mixing along the Mozambique Channel. Historical transports based on hydrographic data in the Channel vary from 5 Sv northward to 26 Sv southward depending on reference level and time of the year. Balancing transport below 2500 m (the sill depth in the Channel), we estimate the net southward transports above this depth to be 29.1 and 5.9 Sv for the northern and southern sections, respectively—the difference is presumably related to seasonality and eddy variability superimposed on the mean flow. Individual deep float trajectories show the presence of many eddies, but the overall flow in the channel is southward, and broadly consistent with hydrography. Model outputs also show mean southward transport with considerable seasonal variability. Satellite data show high variability in sea surface height anomalies and high eddy kinetic energy associated with eddy activity. Although the geostrophic transport values are consistent with the historical limits, the lowered ADCP measurements suggest a substantial barotropic
CALIPSO observations of changes in dust properties during transatlantic transport
NASA Astrophysics Data System (ADS)
Marshak, A.; Yang, W.; Varnai, T.; Kostinski, A. B.
2015-12-01
The vertical distribution of dust shape and size is highly important for understanding and estimating dust radiative forcing. We used CALIPSO nighttime datasets to examine the vertical structure and evolution of Saharan dust during transatlantic transport. The results show that most Saharan dust is lifted to high altitude and descends after traveling thousands of km-s. Initially, the depolarization ratio and color ratio of Saharan dust are uniformly distributed along altitude, suggesting vertically constant particle size and shape distributions. During transport, the depolarization ratio of Saharan dust drops at lower altitudes, suggesting that particle shapes become less irregular; while at relatively high altitudes, the depolarization ratio of dust increases during transport. The changes observed during transport likely come from the effects of gravitational sorting caused by variations in particle shape and size. A simple model with only two shapes qualitatively captures these features and confirms that shape-induced differential settling contribute significantly to the observed vertical stratification of dust properties. In addition, the effect of clouds on dust properties will be also discussed.
TOPICAL REVIEW: Nanoscale transport properties at silicon carbide interfaces
NASA Astrophysics Data System (ADS)
Roccaforte, F.; Giannazzo, F.; Raineri, V.
2010-06-01
Wide bandgap semiconductors promise devices with performances not achievable using silicon technology. Among them, silicon carbide (SiC) is considered the top-notch material for a new generation of power electronic devices, ensuring the improved energy efficiency required in modern society. In spite of the significant progress achieved in the last decade in the material quality, there are still several scientific open issues related to the basic transport properties at SiC interfaces and ion-doped regions that can affect the devices' performances, keeping them still far from their theoretical limits. Hence, significant efforts in fundamental research at the nanoscale have become mandatory to better understand the carrier transport phenomena, both at surfaces and interfaces. In this paper, the most recent experiences on nanoscale transport properties will be addressed, reviewing the relevant key points for the basic devices' building blocks. The selected topics include the major concerns related to the electronic transport at metal/SiC interfaces, to the carrier concentration and mobility in ion-doped regions and to channel mobility in metal/oxide/SiC systems. Some aspects related to interfaces between different SiC polytypes are also presented. All these issues will be discussed considering the current status and the drawbacks of SiC devices.
NASA Astrophysics Data System (ADS)
Kataoka, Keisuke; Yasumoto, Tetsuaki; Manabe, Yousuke; Sato, Hiroyasu; Yamano, Akihito; Katagiri, Toshimasa
2013-01-01
An anisotropic tunnel microporous crystal was prepared. Active transportation of anthracene as a guest molecule in the anisotropic tunnels was observed. The direction of anthracene movement implies that the anisotropic tunnel did not work as a flap-check valve. The direction of the movement was consistent with that caused by a Brownian ratchet.An anisotropic tunnel microporous crystal was prepared. Active transportation of anthracene as a guest molecule in the anisotropic tunnels was observed. The direction of anthracene movement implies that the anisotropic tunnel did not work as a flap-check valve. The direction of the movement was consistent with that caused by a Brownian ratchet. Electronic supplementary information (ESI) available. CCDC reference numbers 837539 and 837540. For ESI and crystallographic data in CIF or other electronic format see DOI: 10.1039/c2nr30880k
NASA Astrophysics Data System (ADS)
Zhang, Fan; Fang, Yue-Wen; Chan, Ngai Yui; Lo, Wing Chong; Li, Dan Feng; Duan, Chun-Gang; Ding, Feng; Dai, Ji Yan
2016-06-01
Among the interfacial transport modulations to the LaAl O3/SrTi O3 (LAO/STO) heterostructure, mechanical strain has been proven to be an effective approach by growing the LAO/STO films on different substrates with varying lattice mismatches to STO. However, this lattice-mismatch-induced strain effect is static and biaxial, hindering the study of the strain effect in a dynamic way. In this work we realize dynamic and uniaxial strain to the LAO/STO oxide heterostructure at low temperature, through mechanical coupling from a magnetostrictive template. This anisotropic strain results in symmetry breaking at the interface and induces further splitting of the electronic band structure and therefore produces different conductivities along the x and y in-plane directions. In particular, we observe that along the strained direction the interface conductivity decreases by up to 70 % under a tensile strain, while it increases by 6.8 % under a compressive strain at 2 K. Also, it is revealed that the modulation on the interfacial transport property can be anisotropic, i.e., the resistance changes differently when an excitation current is parallel or perpendicular to the strain direction. This approach of strain engineering provides another degree of freedom for control of transport properties of oxide heterostructures and opens an additional way to investigate strain effects in materials science.
Thermoelectric transport properties of In2Se3 single crystal
NASA Astrophysics Data System (ADS)
Nguyen, Thi Huong; Duong, Van Thiet; Nguyen, Van Quang; Duong, Anh Tuan; Cho, Sunglae; Song, Jae Yong; Park, Hyun-Min
In recent years the discovery and development of green energy source are one of the top concerns in science. The enormous efforts have been devoted to search for thermoelectric materials. Enhancement of thermoelectric figure of merit (ZT = (S2 σ / κ) T) is currently research goal of scientists. In2Se3 is one of semiconductors with layered structure, which is good for thermoelectric applications. In this study, we report on the transport and thermoelectric properties of In2Se3 single crystal. The layered crystal structure of In2Se3 was determined by XRD and FE-SEM measurements. Ellipsometry measurement illustrated the indirect band gap of In2Se3, about 1.61 eV. Transport properties have been studied in the temperature range from 20 to 400 K along axis which is parallel to the layers direction. Interestingly, Seebeck coefficient was n-type and increased with temperature and the electrical conductivity increased with temperature. Therefore, power factor increased up to 2.69 µWcm-1K-2at 400 K. In this talk, we will discuss more on transport properties.
Viscoelastic properties of actin networks influence material transport
NASA Astrophysics Data System (ADS)
Stam, Samantha; Weirich, Kimberly; Gardel, Margaret
2015-03-01
Directed flows of cytoplasmic material are important in a variety of biological processes including assembly of a mitotic spindle, retraction of the cell rear during migration, and asymmetric cell division. Networks of cytoskeletal polymers and molecular motors are known to be involved in these events, but how the network mechanical properties are tuned to perform such functions is not understood. Here, we construct networks of either semiflexible actin filaments or rigid bundles with varying connectivity. We find that solutions of rigid rods, where unimpeded sliding of filaments may enhance transport in comparison to unmoving tracks, are the fastest at transporting network components. Entangled solutions of semiflexible actin filaments also transport material, but the entanglements provide resistance. Increasing the elasticity of the actin networks with crosslinking proteins slows network deformation further. However, the length scale of correlated transport in these networks is increased. Our results reveal how the rigidity and connectivity of biopolymers allows material transport to occur over time and length scales required for physiological processes. This work was supported by the U. Chicago MRSEC
The magnetic and transport properties of template-synthesized carbon-based and related nanomaterials
NASA Astrophysics Data System (ADS)
Friedman, Adam Louis
that the contact resistances, which are normally on the order of mega-ohms for these tubes, can be lowered to the order of kilo-ohms by annealing in H 2/Ar atmosphere. We find that the disorder in these carbon nanotubes allows for the uptake of H during the annealing process. These H-complex hydrogen impurities, along with C and H adatoms, induce ferromagnetism in the carbon nanotubes. We carry out a magnetic study on the annealed carbon nanotubes. Moreover, the ferromagnetism of the carbon nanotubes results in hysteric magnetoresistance. We study this effect, attributing it to strong magneto-viscosity effects and anisotropic magnetoresistance. We also study the transport and magnetotransport properties of the annealed carbon nanotubes as a function of temperature and inner diameter. We find that there is an order-disorder transition that occurs at lower temperatures that resembles behavior predicted in disordered carbon fibers by the Bright model. We also find that the nanotubes behave as one-dimensional Luttinger liquids. Finally, as a means of comparison, we fabricate and study the properties of monolayer graphene devices.
Theoretical study of anisotropic MHD turbulence with low magnetic Reynolds number
NASA Astrophysics Data System (ADS)
Sukoriansky, Semion; Zemach, Efi
2016-03-01
Flows of electrically conducting fluids under the action of external magnetic field present an example of strongly anisotropic turbulence. Such flows are not only important for different engineering applications, but also provide an interesting framework for studies of quasi-two-dimensional turbulence with strongly modified transport properties in easily controllable laboratory experiments. We present theoretical results that advance our understanding of magnetohydrodynamic (MHD) flows with low magnetic Reynolds number by treating this phenomenon within the quasi-normal scale elimination (QNSE) theory. Previous applications of the theory to turbulent flows with stable stratification and solid body rotation have demonstrated that QNSE is a powerful tool for studies of anisotropic turbulent flows. We derive expressions for scale-dependent eddy viscosities and eddy diffusivities in the directions parallel and normal to the external magnetic field and investigate progressive anisotropization of turbulent transport of momentum and passive scalar. The theory yields analytical expressions for anisotropic one-dimensional spectra of MHD turbulence. In particular, the theory sheds light upon the modification of the Kolmogorov k-5/3 spectrum by anisotropic Ohmic (Joule) dissipation.
Spin Dependent Transport Properties of Metallic and Semiconducting Nanostructures
NASA Astrophysics Data System (ADS)
Sapkota, Keshab R.
Present computing and communication devices rely on two different classes of technologies; information processing devices are based on electrical charge transport in semiconducting materials while information storage devices are based on orientation of electron spins in magnetic materials. A realization of a hybrid-type device that is based on charge as well as spin properties of electrons would perform both of these actions thereby enhancing computation power to many folds and reducing power consumptions. This dissertation focuses on the fabrication of such spin-devices based on metallic and semiconducting nanostructures which can utilize spin as well as charge properties of electrons. A simplified design of the spin-device consists of a spin injector, a semiconducting or metallic channel, and a spin detector. The channel is the carrier of the spin signal from the injector to the detector and therefore plays a crucial role in the manipulation of spin properties in the device. In this work, nanostructures like nanowires and nanostripes are used to function the channel in the spin-device. Methods like electrospinning, hydrothermal, and wet chemical were used to synthesize nanowires while physical vapor deposition followed by heat treatment in controlled environment was used to synthesis nanostripes. Spin-devices fabrication of the synthesized nanostructures were carried out by electron beam lithography process. The details of synthesis of nanostructures, device fabrication procedures and measurement techniques will be discussed in the thesis. We have successfully fabricated the spin-devices of tellurium nanowire, indium nanostripe, and indium oxide nanostripe and studied their spin transport properties for the first time. These spin-devices show large spin relaxation length compared to normal metals like copper and offer potentials for the future technologies. Further, Heusler alloys nanowires like nanowires of Co 2FeAl were synthesized and studied for electrical
Space radiation transport properties of polyethylene-based composites.
Kaul, R K; Barghouty, A F; Dahche, H M
2004-11-01
Composite materials that can serve as both effective shielding materials against cosmic-ray and energetic solar particles in deep space, as well as structural materials for habitat and spacecraft, remain a critical and mission enabling component in mission planning and exploration. Polyethylene is known to have excellent shielding properties due to its low density, coupled with high hydrogen content. Polyethylene-fiber reinforced composites promise to combine this shielding effectiveness with the required mechanical properties of structural materials. Samples of polyethylene-fiber reinforced epoxy matrix composite 1-5 cm thick were prepared at the NASA Marshall Space Flight Center and tested against a 500 MeV/nucleon Fe beam at the HIMAC facility of NIRS in Chiba, Japan. This paper presents measured and calculated results for the radiation transport properties of these samples. PMID:15644352
Radiation Transport Properties of Polyethylene-Fiber Composites
NASA Technical Reports Server (NTRS)
Kaul, Raj K.; Barghouty, A. F.; Dahche, H. M.
2003-01-01
Composite materials that can both serve as effective shielding materials against cosmic-ray and energetic solar particles in deep space as well as structural materials for habitat and spacecraft remain a critical and mission enabling piece in mission planning and exploration. Polyethylene is known to have excellent shielding properties due to its low density coupled with high hydrogen content. Polyethylene fiber reinforced composites promise to combine this shielding effectiveness with the required mechanical properties of structural materials. Samples of Polyethylene-fiber reinforced epoxy matrix composite 1-5 cm thick were prepared at NASA's Marshall Space Flight Center and tested against 500 MeV/nucleon Fe beam at the HIMAC facility of NIRS in Chiba, Japan. This paper presents measured and calculated results for the radiation transport properties of these samples.
Space radiation transport properties of polyethylene-based composites
NASA Technical Reports Server (NTRS)
Kaul, R. K.; Barghouty, A. F.; Dahche, H. M.
2004-01-01
Composite materials that can serve as both effective shielding materials against cosmic-ray and energetic solar particles in deep space, as well as structural materials for habitat and spacecraft, remain a critical and mission enabling component in mission planning and exploration. Polyethylene is known to have excellent shielding properties due to its low density, coupled with high hydrogen content. Polyethylene-fiber reinforced composites promise to combine this shielding effectiveness with the required mechanical properties of structural materials. Samples of polyethylene-fiber reinforced epoxy matrix composite 1-5 cm thick were prepared at the NASA Marshall Space Flight Center and tested against a 500 MeV/nucleon Fe beam at the HIMAC facility of NIRS in Chiba, Japan. This paper presents measured and calculated results for the radiation transport properties of these samples.
Linear elastic properties derivation from microstructures representative of transport parameters.
Hoang, Minh Tan; Bonnet, Guy; Tuan Luu, Hoang; Perrot, Camille
2014-06-01
It is shown that three-dimensional periodic unit cells (3D PUC) representative of transport parameters involved in the description of long wavelength acoustic wave propagation and dissipation through real foam samples may also be used as a standpoint to estimate their macroscopic linear elastic properties. Application of the model yields quantitative agreement between numerical homogenization results, available literature data, and experiments. Key contributions of this work include recognizing the importance of membranes and properties of the base material for the physics of elasticity. The results of this paper demonstrate that a 3D PUC may be used to understand and predict not only the sound absorbing properties of porous materials but also their transmission loss, which is critical for sound insulation problems. PMID:24907783
Red Cell Properties after Different Modes of Blood Transportation
Makhro, Asya; Huisjes, Rick; Verhagen, Liesbeth P.; Mañú-Pereira, María del Mar; Llaudet-Planas, Esther; Petkova-Kirova, Polina; Wang, Jue; Eichler, Hermann; Bogdanova, Anna; van Wijk, Richard; Vives-Corrons, Joan-Lluís; Kaestner, Lars
2016-01-01
Transportation of blood samples is unavoidable for assessment of specific parameters in blood of patients with rare anemias, blood doping testing, or for research purposes. Despite the awareness that shipment may substantially alter multiple parameters, no study of that extent has been performed to assess these changes and optimize shipment conditions to reduce transportation-related artifacts. Here we investigate the changes in multiple parameters in blood of healthy donors over 72 h of simulated shipment conditions. Three different anticoagulants (K3EDTA, Sodium Heparin, and citrate-based CPDA) for two temperatures (4°C and room temperature) were tested to define the optimal transportation conditions. Parameters measured cover common cytology and biochemistry parameters (complete blood count, hematocrit, morphological examination), red blood cell (RBC) volume, ion content and density, membrane properties and stability (hemolysis, osmotic fragility, membrane heat stability, patch-clamp investigations, and formation of micro vesicles), Ca2+ handling, RBC metabolism, activity of numerous enzymes, and O2 transport capacity. Our findings indicate that individual sets of parameters may require different shipment settings (anticoagulants, temperature). Most of the parameters except for ion (Na+, K+, Ca2+) handling and, possibly, reticulocytes counts, tend to favor transportation at 4°C. Whereas plasma and intraerythrocytic Ca2+ cannot be accurately measured in the presence of chelators such as citrate and EDTA, the majority of Ca2+-dependent parameters are stabilized in CPDA samples. Even in blood samples from healthy donors transported using an optimized shipment protocol, the majority of parameters were stable within 24 h, a condition that may not hold for the samples of patients with rare anemias. This implies for as short as possible shipping using fast courier services to the closest expert laboratory at reach. Mobile laboratories or the travel of the patients to
Red Cell Properties after Different Modes of Blood Transportation.
Makhro, Asya; Huisjes, Rick; Verhagen, Liesbeth P; Mañú-Pereira, María Del Mar; Llaudet-Planas, Esther; Petkova-Kirova, Polina; Wang, Jue; Eichler, Hermann; Bogdanova, Anna; van Wijk, Richard; Vives-Corrons, Joan-Lluís; Kaestner, Lars
2016-01-01
Transportation of blood samples is unavoidable for assessment of specific parameters in blood of patients with rare anemias, blood doping testing, or for research purposes. Despite the awareness that shipment may substantially alter multiple parameters, no study of that extent has been performed to assess these changes and optimize shipment conditions to reduce transportation-related artifacts. Here we investigate the changes in multiple parameters in blood of healthy donors over 72 h of simulated shipment conditions. Three different anticoagulants (K3EDTA, Sodium Heparin, and citrate-based CPDA) for two temperatures (4°C and room temperature) were tested to define the optimal transportation conditions. Parameters measured cover common cytology and biochemistry parameters (complete blood count, hematocrit, morphological examination), red blood cell (RBC) volume, ion content and density, membrane properties and stability (hemolysis, osmotic fragility, membrane heat stability, patch-clamp investigations, and formation of micro vesicles), Ca(2+) handling, RBC metabolism, activity of numerous enzymes, and O2 transport capacity. Our findings indicate that individual sets of parameters may require different shipment settings (anticoagulants, temperature). Most of the parameters except for ion (Na(+), K(+), Ca(2+)) handling and, possibly, reticulocytes counts, tend to favor transportation at 4°C. Whereas plasma and intraerythrocytic Ca(2+) cannot be accurately measured in the presence of chelators such as citrate and EDTA, the majority of Ca(2+)-dependent parameters are stabilized in CPDA samples. Even in blood samples from healthy donors transported using an optimized shipment protocol, the majority of parameters were stable within 24 h, a condition that may not hold for the samples of patients with rare anemias. This implies for as short as possible shipping using fast courier services to the closest expert laboratory at reach. Mobile laboratories or the travel of the
NASA Astrophysics Data System (ADS)
Kosaka, Masataka; Monde, Masanori
2015-11-01
For safe and fast fueling of hydrogen in a fuel cell electric vehicle at hydrogen fueling stations, an understanding of the heat transferred from the gas into the tank wall (carbon fiber reinforced plastic (CFRP) material) during hydrogen fueling is necessary. Its thermal properties are needed in estimating heat loss accurately during hydrogen fueling. The CFRP has anisotropic thermal properties, because it consists of an adhesive agent and layers of the CFRP which is wound with a carbon fiber. In this paper, the thermal diffusivity and thermal conductivity of the tank wall material were measured by an inverse solution for one-dimensional unsteady heat conduction. As a result, the thermal diffusivity and thermal conductivity were 2.09 × 10^{-6}{ m}2{\\cdot }{s}^{-1} and 3.06{ W}{\\cdot }{m}{\\cdot }^{-1}{K}^{-1} for the axial direction, while they were 6.03 × 10^{-7} {m}2{\\cdot }{s}^{-1} and 0.93 {W}{\\cdot }{m}^{-1}{\\cdot }{K}^{-1} for the radial direction. The thermal conductivity for the axial direction was about three times higher than that for the radial direction. The thermal diffusivity shows the same trend in both directions because the thermal capacity, ρ c, is independent of direction, where ρ is the density and c is the heat capacity.
Transport properties of transition metal impurities on gold nanowires
NASA Astrophysics Data System (ADS)
Pontes, Renato B.; da Silva, Edison Z.; Fazzio, Adalberto; da Silva, Antônio J. R.
2009-03-01
Performing first principles density functional theory (DFT) we calculated the electronic and transport properties of a Au thin nanowire with transition metal atoms (Mn, Fe, Ni or Co) bridging the two sides of the Au nanowire. We will show that these systems have strong spin dependent transport properties and that the local symmetry can dramatically change them, leading to a significant spin polarized conductance. This spin dependent transport is also associated with the transition metal in the nanowire, in particular with the d-level positioning. Using Co, for example [1], when the symmetry permits the mixing between the wire s-orbitals with the transition metal d-states, there are interference effects that resemble Fano-like resonances with an anisotropy of 0.07 at the Fermi level. On the other hand, if this symmetry decouples such states, we simply have a sum of independent transmission channels and the calculated anisotropy was 0.23. The anisotropies for the other transition metals, as well as calculated transmittances for two Co impurities will also be presented [1] R. B. Pontes, E. Z. da Silva, A. Fazzio and Antônio J. R. da Silva, J. Am. Chem. Soc. 130 (30), 9897-903, 2008
Influence of biofilms on transport properties in porous media
NASA Astrophysics Data System (ADS)
Davit, Y.
2015-12-01
Microbial activity and biofilm growth in porous media can drastically modify transport properties such as permeability, longitudinal and transverse dispersion or effective reaction rates. Understanding these effects has proven to be a considerable challenge. Advances in this field have been hindered by the difficulty of modeling and visualizing these multi-phase non-linear effects across a broad range of spatial and temporal scales. To address these issues, we are developing a strategy that combines imaging techniques based on x-ray micro-tomography with homogenization of pore-scale transport equations. Here, we review recent progress in x-ray imaging of biofilms in porous media, with a particular focus on the contrast agents that are used to differentiate between the fluid and biofilm phases. We further show how the 3D distribution of the different phases can be used to extract specific information about the biofilm and how effective properties can be calculated via the resolution of closure problems. These closure problems are obtained using the method of volume averaging and must be adapted to the problem of interest. In hydrological systems, we show that a generic formulation for reactive solute transport is based on a domain decomposition approach at the micro-scale yielding macro-scale models reminiscent of multi-rate mass transfer approaches.
Predicting radiative transport properties of plasma sprayed porous ceramics
NASA Astrophysics Data System (ADS)
Wang, B. X.; Zhao, C. Y.
2016-03-01
The typical yttria-stabilized zirconia material for making the thermal barrier coatings (TBCs) is intrinsically semitransparent to thermal radiation, and the unique disordered microstructures in TBCs make them surprisingly highly scattering. To quantitatively understand the influence of disordered microstructures, this paper presents a quantitative prediction on the radiative properties, especially the transport scattering coefficient of plasma sprayed TBC based on microstructure analysis and rigorous electromagnetic theory. The impact of the porosity, shape, size, and orientation of different types of voids on transport scattering coefficient is comprehensively investigated under the discrete dipole approximation. An inverse model integrating these factors together is then proposed to quantitatively connect transport scattering coefficient with microstructural information, which is also validated by available experimental data. Afterwards, an optimization procedure is carried out based on this model to obtain the optimal size and orientation distribution of the microscale voids to achieve the maximal radiation insulation performance at different operating temperatures, providing guidelines for practical coating design and fabrication. This work suggests that the current model is effective and also efficient for connecting scattering properties to microstructures and can be implemented as a quantitative tool for further studies like non-destructive infrared imaging as well as micro/nanoscale thermal design of TBCs.
Hunt, A. G.
2006-01-06
Abstract: At the United States Department of Energy Hanford Site a spill of radioactive Technetium has been migrating horizontally in the vadose zone rather than flowing vertically to the water table. This result has been interpreted as being due to horizontal anisotropy in the hydraulic conductivity, K, (a tendency for fluids to migrate more easily in the horizontal direction) due to high horizontal connectivity of sedimentary deposits with a tendency for larger values of K. Such layers have larger components of silt and clay than the predominantly sandy soils at the Hanford site. It is generally accepted that effects of such anisotropy tend to be greater at smaller length scales, probably because of the lack of perfect correlations at large length scales. It has also been suggested that this anisotropy in K is maximized under relatively dry conditions when finer soils (with smaller pores) trap moisture more effectively than sands and gravels. The random component of the distribution of the Hanford flood deposits requires a probabilistic framework for the calculation of K. The work on this project had two main components: 1) to use continuum percolation theory applied to random fractal models to produce a general framework for calculating distributions of K under anisotropic conditions and as a function of system scale, 2) to apply the scheme for calculation to the Hanford site. The results of the general calculation (submitted for publication in Philosophical Magazine) are that the mean horizontal and vertical K values become equal in the limit of large system size (in agreement with general perception above) while the distributions of K values cause significant overlap of expected experimental values of K in the vertical and horizontal directions already at intermediate length scales. In order to make these calculation specific to the Hanford site, however, values of the appropriate length scales to describe the Hanford subsurface as well as to describe the
Upscaling flow and transport properties in synthetic porous media
NASA Astrophysics Data System (ADS)
Jasinski, Lukasz; Dabrowski, Marcin
2015-04-01
Flow and transport through the porous media has instances in nature and industry: contaminant migration in geological formations, gas/oil extraction from proppant filled hydraulic fractures and surrounding porous matrix, underground carbon dioxide sequestration and many others. We would like to understand the behavior of propagating solute front in such medium, mainly flow preferential pathways and the solute dispersion due to the porous medium geometry. The motivation of our investigation is to find connection between the effective flow and transport properties and porous media geometry in 2D and 3D for large system sizes. The challenge is to discover a good way of upscaling flow and transport processes to obtain results comparable to these calculated on pore-scale in much faster way. We study synthetic porous media made of densely packed poly-disperse disk-or spherical-shaped grains in 2D and 3D, respectively. We use various protocols such as the random sequential addition (RSA) algorithm to generate densely packed grains. Imposed macroscopic pressure gradient invokes fluid flow through the pore space of generated porous medium samples. As the flow is considered in the low Reynolds number regime, a stationary velocity field is obtained by solving the Stokes equations by means of finite element method. Void space between the grains is accurately discretized by using body-fitting triangular or tetrahedral mesh. Finally, pure advection of a front carried by the velocity field is studied. Periodicity in all directions is applied to microstructure, flow and transport processes. Effective permeability of the media can be calculated by integrating the velocity field on cross sections, whereas effective dispersion coefficient is deduced by application of centered moment methods on the concentration field of transported solute in time. The effective parameters are investigated as a function of geometrical parameters of the media, such as porosity, specific surface area
Reservoir transport and poroelastic properties from oscillating pore pressure experiments
NASA Astrophysics Data System (ADS)
Hasanov, Azar K.
Hydraulic transport properties of reservoir rocks, permeability and storage capacity are traditionally defined as rock properties, responsible for the passage of fluids through the porous rock sample, as well as their storage. The evaluation of both is an important part of any reservoir characterization workflow. Moreover, permeability and storage capacity are main inputs into any reservoir simulation study, routinely performed by reservoir engineers on almost any major oil and gas field in the world. An accurate reservoir simulation is essential for production forecast and economic analysis, hence the transport properties directly control the profitability of the petroleum reservoir and their estimation is vital for oil and gas industry. This thesis is devoted to an integrated study of reservoir rocks' hydraulic, streaming potential and poroelastic properties as measured with the oscillating pore pressure experiment. The oscillating pore pressure method is traditionally used to measure hydraulic transport properties. We modified the method and built an experimental setup, capable of measuring all aforementioned rock properties simultaneously. The measurements were carried out for four conventional reservoir-rock quality samples at a range of oscillation frequencies and effective stresses. An apparent frequency dependence of permeability and streaming potential coupling coefficient was observed. Measured frequency dispersion of drained poroelastic properties indicates an intrinsically inelastic nature of the porous mineral rock frame. Standard Linear Model demonstrated the best fit to the experimental dispersion data. Pore collapse and grain crushing effects took place during hydrostatic loading of the dolomitic sample and were observed in permeability, coupling coefficient and poroelastic measurements simultaneously. I established that hydraulically-measured storage capacities are overestimated by almost one order of magnitude when compared to elastically
Morphologic and transport properties of natural organic floc
Larsen, L.G.; Harvey, J.W.; Crimaldi, J.P.
2009-01-01
The morphology, entrainment, and settling of suspended aggregates ("floc") significantly impact fluxes of organic carbon, nutrients, and contaminants in aquatic environments. However, transport properties of highly organic floc remain poorly understood. In this study detrital floc was collected in the Florida Everglades from two sites with different abundances of periphyton for use in a settling column and in racetrack flume entrainment experiments. Although Everglades flocs are similar to other organic aggregates in terms of morphology and settling rates, they tend to be larger and more porous than typical mineral flocs because of biostabilization processes and relatively low prevailing shear stresses typical of wetlands. Flume experiments documented that Everglades floc was entrained at a low bed shear stress of 1.0 ?? 10-2 Pa, which is considerably smaller than the typical entrainment threshold of mineral floc. Because of similarities between Everglades floc and other organic floc populations, floc transport characteristics in the Everglades typify the behavior of floc in other organic-rich shallow-water environments. Highly organic floc is more mobile than less organic floc, but because bed shear stresses in wetlands are commonly near the entrainment threshold, wetland floc dynamics are often transport-limited rather than supply limited. Organic floc transport in these environments is therefore governed by the balance between entrainment and settling fluxes, which has implications for ecosystem metabolism, materials cycling, and even landscape evolution. Copyright 2009 by the American Geophysical Union.
Geophysical and transport properties of reservoir rocks. Summary annual report
Cook, N.G.W.
1990-04-29
Definition of petrophysical properties, such as porosity, permeability and fluid saturation, on the scale of meters, is the key to planning and control of successful Enhanced Oil Recovery techniques for domestic reservoirs. Macroscopic transport properties in reservoir rocks depend critically upon processes at the pore level involving interactions between the pore topology and the physical and chemical properties of the rock minerals and interstitial fluids. Similar interactions at the pore level determine also the macroscopic electrical and seismic properties of reservoir rocks. The objective of this research is to understand, using analysis and experiment, how fluids in pores affect the geophysical and sport properties of reservoir rocks. The goal is to develop equations-relating seismic and electrical properties of rock to the porosity, permeability and fluid saturations so as to invert geophysical images for improved reservoir management. Results from seismic measurements performed so far in this study suggest that even subtle changes in fluid contacts and the in-situ state of effective stress can be detected using geophysical imaging techniques. The experiments using Wood`s metal and wax are revealing the topology and sport properties of the pore space in clastic sedimentary rocks. A deeper understanding of these properties is considered-to be the key to the recovery of much of the mobile oil left in domestic reservoirs and to the effective management of enhanced oil recovery techniques. The results of Wood`s metal percolation tests indicate that most of the permeability of Berea sandstone resides in the critical percolating paths and these paths occupy only a small fraction of the total porosity. This result may have important implications for flooding in terms of override and efficiency as a function of saturation.
Coefficients for calculating thermodynamic and transport properties of individual species
NASA Technical Reports Server (NTRS)
Mcbride, Bonnie J.; Gordon, Sanford; Reno, Martin A.
1993-01-01
Libraries of thermodynamic data and transport properties are given for individual species in the form of least-squares coefficients. Values of C(sup 0)(sub p)(T), H(sup 0)(T), and S(sup 0)(T) are available for 1130 solid, liquid, and gaseous species. Viscosity and thermal conductivity data are given for 155 gases. The original C(sup 0)(sub p)(T) values were fit to a fourth-order polynomial with integration constants for H(sup 0)(T) and S(sup 0)(T). For each species the integration constant for H(sup 0)(T) includes the heat of formation. Transport properties have a different functional form. The temperature range for most of the data is 300 to 5000 K, although some of the newer thermodynamic data have a range of 200 to 6000 K. Because the species are mainly possible products of reaction, the data are useful for chemical equilibrium and kinetics computer codes. Much of the data has been distributed for several years with the NASA Lewis equilibrium program CET89. The thermodynamic properties of the reference elements were updated along with about 175 species that involve the elements carbon, hydrogen, oxygen, and nitrogen. These sets of data will be distributed with the NASA Lewis personal computer program for calculating chemical equilibria, CETPC.
Thermal transport and thermoelectric properties of beta-graphyne nanostructures.
Ouyang, Tao; Hu, Ming
2014-06-20
Graphyne, an allotrope of graphene, is currently a hot topic in the carbon-based nanomaterials research community. Taking beta-graphyne as an example, we performed a comprehensive study of thermal transport and related thermoelectric properties by means of nonequilibrium Green's function (NEGF). Our simulation demonstrated that thermal conductance of beta-graphyne is only approximately 26% of that of the graphene counterpart and also shows evident anisotropy. Meanwhile, thermal conductance of armchair beta-graphyne nanoribbons (A-BGYNRs) presents abnormal stepwise width dependence. As for the thermoelectric property, we found that zigzag beta-graphyne nanoribbons (Z-BGYNRs) possess superior thermoelectric performance with figure of merit value achieving 0.5 at room temperature, as compared with graphene nanoribbons (~0.05). Aiming at obtaining a better thermoelectric coefficient, we also investigated Z-BGYNRs with geometric modulations. The results show that the thermoelectric performance can be enhanced dramatically (figure of merit exceeding 1.5 at room temperature), and such enhancement strongly depends on the width of the nanoribbons and location and quantity of geometric modulation. Our findings shed light on transport properties of beta-graphyne as high efficiency thermoelectrics. We anticipate that our simulation results could offer useful guidance for the design and fabrication of future thermoelectric devices. PMID:24859889
Multi-scale mechanical and transport properties of a hydrogel.
Salahshoor, Hossein; Rahbar, Nima
2014-09-01
In this paper, molecular dynamic simulation was used to study the effect of water on the equilibrated structure and mechanical properties of cross-linked hydrogel at multiple scales. The hydrogel consisted of Polyethylene glycol diglycidyl ether (PEGDGE) as epoxy and the Jeffamine, poly-oxy-alkylene-amines, as curing agent. The results for systems with various water contents indicated that the cross-links were more hydrophilic within the hydrogel structure. Effects of cross-linking on the transport properties were also investigated by computing diffusion coefficients of water molecules. A new Coarse-Grained (CG) scheme for hydrogels is proposed, and validated by comparing the transport properties with the all-atom method, demonstrating the capability of the model to capture the correct dynamic evolution of the system. The all-atom model of the hydrogel was mapped to the CG model using the MARTINI force field. This method resulted in a more realistic representation of the stiffness of the system, compared to the previous experimental studies in the literature. The variation of the stiffness of the hydrogel as a function of the water content showed that 40% water content is the optimal value for mechanical performance of the hydrogel. PMID:24967978
Thermoelectric transport properties of molybdenum from abinitio simulations
NASA Astrophysics Data System (ADS)
French, Martin; Mattsson, Thomas R.
2014-10-01
We employ abinitio simulations based on density functional theory (DFT) to calculate the electronic transport coefficients (electrical conductivity, thermal conductivity, and thermopower) of molybdenum over a broad range of thermodynamic states. By comparing to available experimental data, we show that DFT is able to describe the desired transport properties of this refractory metal with high accuracy. Most noteworthy, both the positive sign and the quantitative values of the thermopower of solid molybdenum are reproduced very well. We calculate the electrical and thermal conductivity in the solid and the fluid phase between 1000 and 20 000 K and a wide span in density and develop empirical fit formulas for direct use in practical applications, such as magneto-hydrodynamics simulations. The influence of thermal expansion in conductivity measurements at constant pressure is also discussed in some detail.
Transport properties of individual C{sub 60}-molecules
Géranton, G.; Seiler, C.; Evers, F.; Bagrets, A.; Venkataraman, L.
2013-12-21
Electrical and thermal transport properties of C{sub 60} molecules are investigated with density-functional-theory based calculations. These calculations suggest that the optimum contact geometry for an electrode terminated with a single-Au atom is through binding to one or two C-atoms of C{sub 60} with a tendency to promote the sp{sup 2}-hybridization into an sp{sup 3}-type one. Transport in these junctions is primarily through an unoccupied molecular orbital that is partly hybridized with the Au, which results in splitting the degeneracy of the lowest unoccupied molecular orbital triplet. The transmission through these junctions, however, cannot be modeled by a single Lorentzian resonance, as our results show evidence of quantum interference between an occupied and an unoccupied orbital. The interference results in a suppression of conductance around the Fermi energy. Our numerical findings are readily analyzed analytically within a simple two-level model.
Transport properties of zigzag graphene nanoribbon decorated with copper clusters
Berahman, M.; Sheikhi, M. H.
2014-09-07
Using non-equilibrium green function with density functional theory, the present study investigates the transport properties of decorated zigzag graphene nanoribbon with a copper cluster. We have represented the decoration of zigzag graphene nanoribbon with single copper atom and cluster containing two and three copper atoms. In all the cases, copper atoms tend to occupy the edge state. In addition, we have shown that copper can alter the current-voltage characteristic of zigzag graphene nanoribbon and create new fluctuations and negative differential resistance. These alternations are made due to discontinuity in the combination of orbitals along the graphene nanoribbon. Decoration alters these discontinuities and creates more visible fluctuations. However, in low bias voltages, the changes are similar in all the cases. The study demonstrates that in the decorated zigzag graphene nanoribbon, the edge states are the main states for transporting electron from one electrode to another.
Low temperature carrier transport properties in isotopically controlled germanium
Itoh, K.
1994-12-01
Investigations of electronic and optical properties of semiconductors often require specimens with extremely homogeneous dopant distributions and precisely controlled net-carrier concentrations and compensation ratios. The previous difficulties in fabricating such samples are overcome as reported in this thesis by growing high-purity Ge single crystals of controlled {sup 75}Ge and {sup 70}Ge isotopic compositions, and doping these crystals by the neutron transmutation doping (NTD) technique. The resulting net-impurity concentrations and the compensation ratios are precisely determined by the thermal neutron fluence and the [{sup 74}Ge]/[{sup 70}Ge] ratios of the starting Ge materials, respectively. This method also guarantees unprecedented doping uniformity. Using such samples the authors have conducted four types of electron (hole) transport studies probing the nature of (1) free carrier scattering by neutral impurities, (2) free carrier scattering by ionized impurities, (3) low temperature hopping conduction, and (4) free carrier transport in samples close to the metal-insulator transition.
Structural and robustness properties of smart-city transportation networks
NASA Astrophysics Data System (ADS)
Zhang, Zhen-Gang; Ding, Zhuo; Fan, Jing-Fang; Meng, Jun; Ding, Yi-Min; Ye, Fang-Fu; Chen, Xiao-Song
2015-09-01
The concept of smart city gives an excellent resolution to construct and develop modern cities, and also demands infrastructure construction. How to build a safe, stable, and highly efficient public transportation system becomes an important topic in the process of city construction. In this work, we study the structural and robustness properties of transportation networks and their sub-networks. We introduce a complementary network model to study the relevance and complementarity between bus network and subway network. Our numerical results show that the mutual supplement of networks can improve the network robustness. This conclusion provides a theoretical basis for the construction of public traffic networks, and it also supports reasonable operation of managing smart cities. Project supported by the Major Projects of the China National Social Science Fund (Grant No. 11 & ZD154).
Electronic correlation and transport properties of nuclear fuel materials
NASA Astrophysics Data System (ADS)
Yin, Quan; Kutepov, Andrey; Haule, Kristjan; Kotliar, Gabriel; Savrasov, Sergey Y.; Pickett, Warren E.
2011-11-01
The electronic structures and transport properties of a series of actinide monocarbides, mononitrides, and dioxides are studied systematically using a combination of density-functional theory and dynamical mean-field theory. The studied materials present different electronic correlation strength and degree of localization of 5f electrons, where a metal-insulator boundary naturally lies within. In the spectral function of Mott-insulating uranium oxide, a resonance peak is observed in both theory and experiment and may be understood as a generalized Zhang-Rice state. We also investigate the interplay between electron-electron and electron-phonon interactions, both of which are responsible for the transport in the metallic compounds. Our findings allow us to gain insight in the roles played by different scattering mechanisms, and suggest how to improve their thermal conductivities.
Electronic correlation and transport properties of nuclear fuel materials
Yin Quan; Kutepov, Andrey; Haule, Kristjan; Kotliar, Gabriel; Savrasov, Sergey Y.; Pickett, Warren E.
2011-11-15
The electronic structures and transport properties of a series of actinide monocarbides, mononitrides, and dioxides are studied systematically using a combination of density-functional theory and dynamical mean-field theory. The studied materials present different electronic correlation strength and degree of localization of 5f electrons, where a metal-insulator boundary naturally lies within. In the spectral function of Mott-insulating uranium oxide, a resonance peak is observed in both theory and experiment and may be understood as a generalized Zhang-Rice state. We also investigate the interplay between electron-electron and electron-phonon interactions, both of which are responsible for the transport in the metallic compounds. Our findings allow us to gain insight in the roles played by different scattering mechanisms, and suggest how to improve their thermal conductivities.
Transport Properties in Superconducting Wires Coupled to Ferromagnetic Leads
NASA Astrophysics Data System (ADS)
Chen, Qiao; Zhang, Ya-Min; Xu, H. Q.; Xu, Ning
2016-02-01
We investigate the transport properties of a pair of Majorana bound states in both serial configuration and T-shape configuration with ferromagnetic leads. By using a non-equilibrium Green's function method, the formula of current and shot noise are obtained. The numerical results show that the coupling between the Majorana bounds states at the ends of a wire can be tuned by the polarization P and polarization angle θ intimately in serial configuration. However, this coupling in T-shape configuration is only affected by ferromagnetic leads faintly. In addition, the Fano factor in both configurations is influenced by the polarization P and polarization angle θ intimately at low bias region. Because of the different transport mechanisms, the serial configuration and T-shape configuration show sub-Poissonian and super-Poissonian shot noise at low bias, respectively.
Transport properties of the hot and dense sQGP
NASA Astrophysics Data System (ADS)
Berrehrah, H.; Bratkovskaya, E.; Cassing, W.; Marty, R.
2015-05-01
The transport properties of the quark gluon plasma (QGP) are studied in a QCD medium at finite temperature and chemical potential. We calculate the shear viscosity η(T,μq) and the electric conductivity σe(T, μq) for a system of interacting massive and broad quasi-particles as described by the dynamical quasi-particle model “DQPM” at finite temperature T and quark chemical potential μq within the relaxation time approximation. Our results are in a good agreement with lattice QCD at finite temperature and show clearly the increase of the transport coefficients with increasing T and μq. Our results provide the basic ingredients for the study of the hot and dense matter in the Beam Energy Scan (BES) at RHIC and CBM at FAIR.
NASA Astrophysics Data System (ADS)
Forbes Inskip, Nathaniel; Meredith, Philip; Gudmundsson, Agust
2016-04-01
While considerable effort has been expended on the study of fracture propagation in rocks in recent years, our understanding of how fractures propagate through layered sedimentary rocks with different mechanical and elastic properties remains poorly constrained. Yet this is a key issue controlling the propagation of both natural and anthropogenic hydraulic fractures in layered sequences. Here we report measurements of the contrasting mechanical and elastic properties of the Lower Lias at Nash Point, South Wales, which comprises an interbedded sequence of shale and limestone layers, and how those properties may influence fracture propagation. Elastic properties of both materials have been characterised via ultrasonic wave velocity measurements as a function of azimuth on samples cored both normal and parallel to bedding. The shale is highly anisotropic, with P-wave velocities varying from 2231 to 3890 m s-1, giving an anisotropy of ~55%. By contrast, the limestone is essentially isotropic, with a mean P-wave velocity of 5828 m s-1 and an anisotropy of ~2%. The dynamic Young's modulus of the shale, calculated from P- and S-wave velocity data, is also anisotropic with a value of 36 GPa parallel to bedding and 12 GPa normal to bedding. The modulus of the limestone is again isotropic with a value of 80 GPa. It follows that for a vertical fracture propagating (i.e. normal to bedding) the modulus contrast is 6.6. This is important because the contrast in elastic properties is a key factor in controlling whether fractures arrest, deflect, or propagate across interfaces between layers in a sequence. There are three principal mechanisms by which a fracture may deflect across or along an interface, namely: Cook-Gordon debonding, stress barrier, and elastic mismatch. Preliminary numerical modelling results (using a Finite Element Modelling software) of induced fractures at Nash Point suggest that all three are important. The results demonstrate a rotation of the maximum
Synthesis and electrical transport properties of SnS nanoparticles
NASA Astrophysics Data System (ADS)
Chaki, S. H.; Deshpande, M. P.; Chaudhary, M. D.; Tailor, J. P.; Mahato, K. S.
2013-02-01
The SnS nanoparticles were synthesized at ambient temperature by simple wet chemical method. The stoichiometric and structural characterization was done by EDAX and XRD techniques respectively. The crystallite size was determined using Scherrer's formula and Hall-Williamson plot using XRD data. The electrical transport properties studies were carried out on pellets prepared by hydraulic pressing of SnS nanoparticles. The thermoelectric power and dc resistivity variation with temperature was studied on the pellets. Room temperature Hall effect measurement was made on the pellet. The obtained results are discussed in details.
Transport properties in periodically modulated zigzag silicene nanoribbon
NASA Astrophysics Data System (ADS)
Wang, Xiao-Shuang; Shen, Man; An, Xing-Tao; Liu, Jian-Jun
2016-04-01
We study theoretically the electronic transport properties of zigzag silicene nanoribbon superlattices subject to a periodic electric field perpendicular to the surface of silicene. Our results show that the conductivity of the system depends on the superlattice structural parameters and show effects analogous to those found with two-dimensional semiconductor superlattices. For a superlattice with Nb barriers, a series of resonant peaks, each of which is split into (Nb - 1) subpeaks, and transmission blockade regions appear in the conductance spectrum, which indicates the formation of minibands and minigaps. These silicene-based quantum structures can provide concepts for the design nanodevices.
Study of electronic transport properties of doped 8AGNR
Sharma, Uma Shankar; Srivastava, Anurag; Verma, U. P.
2014-04-24
The electronic and transport properties of 8-armchair graphene nanoribbon (8AGNR) with defect at different sites are investigated by performing first-principles calculations based on density functional theory (DFT). The calculated results show that the 8AGNR are semiconductor. The introduction of 3d transition metals, creates the nondegenerate states in the conduction band, makes 8AGNR metallic. The computed transmission spectrum confirms that AGNR are semiconducting in nature and their band gap remain unchanged and localized states appear when there is vacancy in their structures, and the conductance decreases due to defects compared with the pristine nanoribbon.
Thermodynamic and transport properties of cryogenic propellants and related fluids
NASA Technical Reports Server (NTRS)
Johnson, V. J.
1973-01-01
Significant advances have been made in recent years in the quality and range of thermophysical data for the cryogenic propellants, pressurants, and inertants. A review of recently completed and current data compilation projects for helium, hydrogen, argon, nitrogen, oxygen, fluorine, and methane is given together with recommended references for thermodynamic and transport property data tables for these fluids. Modern techniques in the plotting of thermodynamic charts from tabular data (or from functions such as the equation of state) have greatly improved their precision and value. A list of such charts is included.
Transport properties of diluted inverted micelles and microemulsions
Lalanne, J.R.; Pouligny, B.; Sein, E.
1983-02-17
Experimental results concerning 3 transport properties are discussed: viscosity, mass diffusion, and heat transfer in the ternary system sodium bis(2-ethylhexyl) sulfosuccinate (AOT)/water/CCl4. Thermal conductivity has been investigated by a thermal lens technique using a single laser pulse in the microsecond range. The results are discussed and compared by using a model based upon the kinetic theory of fluids. The study shows how such investigations can lead to an original determination of the intermicellar potential in microemulsions. 99 references.
The Effect of Microstructure On Transport Properties of Porous Electrodes
NASA Astrophysics Data System (ADS)
Peterson, Serena W.
The goal of this work is to further understand the relationships between porous electrode microstructure and mass transport properties. This understanding allows us to predict and improve cell performance from fundamental principles. The investigated battery systems are the widely used rechargeable Li-ion battery and the non-rechargeable alkaline battery. This work includes three main contributions in the battery field listed below. Direct Measurement of Effective Electronic Transport in Porous Li-ion Electrodes. An accurate assessment of the electronic conductivity of electrodes is necessary for understanding and optimizing battery performance. The bulk electronic conductivity of porous LiCoO2-based cathodes was measured as a function of porosity, pressure, carbon fraction, and the presence of an electrolyte. The measurements were performed by delamination of thin-film electrodes from their aluminum current collectors and by use of a four-line probe. Imaging and Correlating Microstructure To Conductivity. Transport properties of porous electrodes are strongly related to microstructure. An experimental 3D microstructure is needed not only for computation of direct transport properties, but also for a detailed electrode microstructure characterization. This work utilized X-ray tomography and focused ion beam (FIB)/scanning electron microscopy (SEM) to obtain the 3D structures of alkaline battery cathodes. FIB/SEM has the advantage of detecting carbon additives; thus, it was the main tomography tool employed. Additionally, protocols and techniques for acquiring, processing and segmenting series of FIB/SEM images were developed as part of this work. FIB/SEM images were also used to correlate electrodes' microstructure to their respective conductivities for both Li-ion and alkaline batteries. Electrode Microstructure Metrics and the 3D Stochastic Grid Model. A detailed characterization of microstructure was conducted in this work, including characterization of the
Anisotropic optical film embedded with cellulose nanowhisker.
Kim, Dah Hee; Song, Young Seok
2015-10-01
We investigated anisotropic optical behaviors of composite films embedded with CNWs. To control the orientation of CNWs, elongation was applied to the composite film. Morphological and mechanical analyses of the specimens were carried out to examine the influence of the applied extension. The CNWs were found to be aligned in the elongated direction, yielding remarkable anisotropic microstructure and optical properties. As the applied elongation and CNW loading increased, the resulting degree of polarization and birefringence increased due to increased interactions between the embedded particles. This study suggests a way to prepare an anisotropic optical component with nanoparticles of which the microstructures, such as orientation and filler content, can be controlled. PMID:26076646
Control of photon transport properties in nanocomposite nanowires
NASA Astrophysics Data System (ADS)
Moffa, M.; Fasano, V.; Camposeo, A.; Persano, L.; Pisignano, D.
2016-02-01
Active nanowires and nanofibers can be realized by the electric-field induced stretching of polymer solutions with sufficient molecular entanglements. The resulting nanomaterials are attracting an increasing attention in view of their application in a wide variety of fields, including optoelectronics, photonics, energy harvesting, nanoelectronics, and microelectromechanical systems. Realizing nanocomposite nanofibers is especially interesting in this respect. In particular, methods suitable for embedding inorganic nanocrystals in electrified jets and then in active fiber systems allow for controlling light-scattering and refractive index properties in the realized fibrous materials. We here report on the design, realization, and morphological and spectroscopic characterization of new species of active, composite nanowires and nanofibers for nanophotonics. We focus on the properties of light-confinement and photon transport along the nanowire longitudinal axis, and on how these depend on nanoparticle incorporation. Optical losses mechanisms and their influence on device design and performances are also presented and discussed.
Stacking dependence of carrier transport properties in multilayered black phosphorous.
Sengupta, A; Audiffred, M; Heine, T; Niehaus, T A
2016-02-24
We present the effect of different stacking orders on carrier transport properties of multi-layer black phosphorous. We consider three different stacking orders AAA, ABA and ACA, with increasing number of layers (from 2 to 6 layers). We employ a hierarchical approach in density functional theory (DFT), with structural simulations performed with generalized gradient approximation (GGA) and the bandstructure, carrier effective masses and optical properties evaluated with the meta-generalized gradient approximation (MGGA). The carrier transmission in the various black phosphorous sheets was carried out with the non-equilibrium green's function (NEGF) approach. The results show that ACA stacking has the highest electron and hole transmission probabilities. The results show tunability for a wide range of band-gaps, carrier effective masses and transmission with a great promise for lattice engineering (stacking order and layers) in black phosphorous. PMID:26809017
Electronic and transport properties of LiCoO2.
Andriyevsky, Bohdan; Doll, Klaus; Jacob, Timo
2014-11-14
Using first principles density functional theory (DFT), the electronic and magnetic properties as well as the Li-ion migration in LiCoO2 have been studied with a gradient corrected functional. The magnetic properties were also investigated in addition using a gradient corrected functional in combination with an on-site repulsion U and a hybrid functional. We find LiCoO2 to be non-magnetic under ambient conditions. A magnetic ground state can be obtained by a volume expansion corresponding to a negative pressure of -8 GPa due to a competition between Hund's rules favoring magnetism on the Co(3+) ions and the crystal field splitting, which suppresses magnetism at zero pressure. The barrier for lithium transport is determined to be 0.44 eV from nudged elastic band (NEB) calculations on the Li0.917CoO2 system. PMID:25264622
Diameter Dependence of the Transport Properties of Antimony Telluride Nanowires
NASA Astrophysics Data System (ADS)
Zuev, Yuri; Lee, Jin Sook; Park, Hongkun; Kim, Philip
2010-03-01
We report measurements of electronic, thermoelectric, and galvanometric properties of individual semimetallic single crystal antimony telluride (Sb2Te3) nanowires. Microfabricated heater and thermometer electrodes were used to probe the transport properties of the nanowires with diameters in the range of 22 - 95nm and temperatures in the range of 2 - 300K. Temperature dependent resistivity varies depending on nanowire diameter. Thermoelectric power (TEP) measurements indicate hole dominant diffusive thermoelectric generation, with an enhancement of the TEP for smaller diameter wires. The large surface-to-volume ratio of Sb2Te3 nanowires makes them an excellent platform to explore novel phenomena in this predicted topological insulator. We investigate mesoscopic magnetoresistance effects in magnetic fields both parallel and perpendicular to the nanowire axis.
Simplified curve fits for the transport properties of equilibrium air
NASA Technical Reports Server (NTRS)
Srinivasan, S.; Tannehill, J. C.
1987-01-01
New, improved curve fits for the transport properties of equilibruim air have been developed. The curve fits are for viscosity and Prandtl number as functions of temperature and density, and viscosity and thermal conductivity as functions of internal energy and density. The curve fits were constructed using grabau-type transition functions to model the tranport properties of Peng and Pindroh. The resulting curve fits are sufficiently accurate and self-contained so that they can be readily incorporated into new or existing computational fluid dynamics codes. The range of validity of the new curve fits are temperatures up to 15,000 K densities from 10 to the -5 to 10 amagats (rho/rho sub o).
Stacking dependence of carrier transport properties in multilayered black phosphorous
NASA Astrophysics Data System (ADS)
Sengupta, A.; Audiffred, M.; Heine, T.; Niehaus, T. A.
2016-02-01
We present the effect of different stacking orders on carrier transport properties of multi-layer black phosphorous. We consider three different stacking orders AAA, ABA and ACA, with increasing number of layers (from 2 to 6 layers). We employ a hierarchical approach in density functional theory (DFT), with structural simulations performed with generalized gradient approximation (GGA) and the bandstructure, carrier effective masses and optical properties evaluated with the meta-generalized gradient approximation (MGGA). The carrier transmission in the various black phosphorous sheets was carried out with the non-equilibrium green’s function (NEGF) approach. The results show that ACA stacking has the highest electron and hole transmission probabilities. The results show tunability for a wide range of band-gaps, carrier effective masses and transmission with a great promise for lattice engineering (stacking order and layers) in black phosphorous.
Predicting the transport properties of sedimentary rocks from microgeometry
Schlueter, E.M.
1993-01-01
We investigate through analysis and experiment how pore geometry, topology, and the physics and chemistry of mineral-fluid and fluid-fluid interactions affect the flow of fluids through consolidated/partially consolidated porous media. Our approach is to measure fluid permeability and electrical conductivity of rock samples using single and multiple fluid phases that can be frozen in place (wetting and nonwetting) over a range of pore pressures. These experiments are analyzed in terms of the microphysics and microchemistry of the processes involved to provide a theoretical basis for the macroscopic constitutive relationships between fluid-flow and geophysical properties that we develop. The purpose of these experiments and their analyses is to advance the understanding of the mechanisms and factors that control fluid transport in porous media. This understanding is important in characterizing porous media properties and heterogeneities before simulating and monitoring the progress of complex flow processes at the field scale in permeable media.
Predicting the transport properties of sedimentary rocks from microgeometry
Schlueter, E.M.
1995-02-01
The author investigates through analysis and experiment how pore geometry, topology, and the physics and chemistry of mineral-fluid and fluid-fluid interactions affect the flow of fluids through consolidated/partially consolidated porous media. The approach is to measure fluid permeability and electrical conductivity of rock samples using single and multiple fluid phases that can be frozen in place (wetting and nonwetting) over a range of pore pressures. These experiments are analyzed in terms of the microphysics and microchemistry of the processes involved to provide a theoretical basis for the macroscopic constitutive relationships between fluid-flow and geophysical properties that the authors develop. The purpose of these experiments and their analyses is to advance the understanding of the mechanisms and factors that control fluid transport in porous media. This understanding is important in characterizing porous media properties and heterogeneities before simulating and monitoring the progress of complex flow processes at the field scale in permeable media.
Graphene on graphene antidot lattices: Electronic and transport properties
NASA Astrophysics Data System (ADS)
Gregersen, Søren Schou; Pedersen, Jesper Goor; Power, Stephen R.; Jauho, Antti-Pekka
2015-03-01
Graphene bilayer systems are known to exhibit a band gap when the layer symmetry is broken by applying a perpendicular electric field. The resulting band structure resembles that of a conventional semiconductor with a parabolic dispersion. Here, we introduce a bilayer graphene heterostructure, where single-layer graphene is placed on top of another layer of graphene with a regular lattice of antidots. We dub this class of graphene systems GOAL: graphene on graphene antidot lattice. By varying the structure geometry, band-structure engineering can be performed to obtain linearly dispersing bands (with a high concomitant mobility), which nevertheless can be made gapped with a perpendicular field. We analyze the electronic structure and transport properties of various types of GOALs, and draw general conclusions about their properties to aid their design in experiments.
FLUID- THERMODYNAMIC AND TRANSPORT PROPERTIES OF FLUIDS (IBM PC VERSION)
NASA Technical Reports Server (NTRS)
Fessler, T. E.
1994-01-01
The accurate computation of the thermodynamic and transport properties of fluids is a necessity for many engineering calculations. The FLUID program was developed to calculate the thermodynamic and transport properties of pure fluids in both the liquid and gas phases. Fluid properties are calculated using a simple gas model, empirical corrections, and an efficient numerical interpolation scheme. FLUID produces results that are in very good agreement with measured values, while being much faster than older more complex programs developed for the same purpose. A Van der Waals equation of state model is used to obtain approximate state values. These values are corrected for real-gas effects by model correction factors obtained from tables based on experimental data. These tables also accurately compensate for the special circumstances which arise whenever phase conditions occur. Viscosity and thermal conductivity values are computed directly from tables. Interpolation within tables is based on Lagrange's three point formula. A set of tables must be generated for each fluid implemented. FLUID currently contains tables for nine fluids including dry air and steam. The user can add tables for any fluid for which adequate thermal property data is available. The FLUID routine is structured so that it may easily be incorporated into engineering programs. The IBM 360 version of FLUID was developed in 1977. It is written in FORTRAN IV and has been implemented on an IBM 360 with a central memory requirement of approximately 222K of 8 bit bytes. The IBM PC version of FLUID is written in Microsoft FORTRAN 77 and has been implemented on an IBM PC with a memory requirement of 128K of 8 bit bytes. The IBM PC version of FLUID was developed in 1986.
FLUID- THERMODYNAMIC AND TRANSPORT PROPERTIES OF FLUIDS (IBM VERSION)
NASA Technical Reports Server (NTRS)
Fessler, T. E.
1994-01-01
The accurate computation of the thermodynamic and transport properties of fluids is a necessity for many engineering calculations. The FLUID program was developed to calculate the thermodynamic and transport properties of pure fluids in both the liquid and gas phases. Fluid properties are calculated using a simple gas model, empirical corrections, and an efficient numerical interpolation scheme. FLUID produces results that are in very good agreement with measured values, while being much faster than older more complex programs developed for the same purpose. A Van der Waals equation of state model is used to obtain approximate state values. These values are corrected for real-gas effects by model correction factors obtained from tables based on experimental data. These tables also accurately compensate for the special circumstances which arise whenever phase conditions occur. Viscosity and thermal conductivity values are computed directly from tables. Interpolation within tables is based on Lagrange's three point formula. A set of tables must be generated for each fluid implemented. FLUID currently contains tables for nine fluids including dry air and steam. The user can add tables for any fluid for which adequate thermal property data is available. The FLUID routine is structured so that it may easily be incorporated into engineering programs. The IBM 360 version of FLUID was developed in 1977. It is written in FORTRAN IV and has been implemented on an IBM 360 with a central memory requirement of approximately 222K of 8 bit bytes. The IBM PC version of FLUID is written in Microsoft FORTRAN 77 and has been implemented on an IBM PC with a memory requirement of 128K of 8 bit bytes. The IBM PC version of FLUID was developed in 1986.
Bipolar Charge Transport Properties of Poly(imide-thienyl(thienylenevinylene))
NASA Astrophysics Data System (ADS)
Lafalce, Evan; Jiang, Xiaomei; Zhang, Cheng
2014-03-01
The charge transport properties of π-conjugated polymers are of interest from a fundamental perspective and also because they are a limiting factor for many optoelectronic device applications. In this work, we study the charge carrier mobility and recombination in Poly(imide-thienyl(thienylenevinylene)) (imide-PTV), a novel PTV derivative with imide side group. The electron and hole mobility are determined separately through the Space Charge Limited Current (SCLC) analysis of single carrier diodes. These devices are fabricated using interfacial layers that provide carrier selective contacts. A mobility asymmetry factor of approximately 20 that favors hole transport is observed, with the hole mobility of the order of 10-5 [cm2/V*s]. Similar results are obtained from the analysis of the intensity dependence of photoconductivity. Complimentary analysis of the ambipolar carrier mobility through carrier extraction under linearly increasing voltage (CELIV) and double injection transient techniques are also presented. The effects of carrier recombination and trapping are discussed. We conclude that the hole transport is not the limiting factor for power conversion efficiency of photovoltaic device based on imide-PTV and PCBM.
Nonlinear Transport and Noise Properties of Acoustic Phonons
NASA Astrophysics Data System (ADS)
Walczak, Kamil
We examine heat transport carried by acoustic phonons in molecular junctions composed of organic molecules coupled to two thermal baths of different temperatures. The phononic heat flux and its dynamical noise properties are analyzed within the scattering (Landauer) formalism with transmission probability function for acoustic phonons calculated within the method of atomistic Green's functions (AGF technique). The perturbative computational scheme is used to determine nonlinear corrections to phononic heat flux and its noise power spectral density with up to the second order terms with respect to temperature difference. Our results show the limited applicability of ballistic Fourier's law and fluctuation-dissipation theorem to heat transport in quantum systems. We also derive several noise-signal relations applicable to nanoscale heat flow carried by phonons, but valid for electrons as well. We also discuss the extension of the perturbative transport theory to higher order terms in order to address a huge variety of problems related to nonlinear thermal effects which may occur at nanoscale and at strongly non-equilibrium conditions with high-intensity heat fluxes. This work was supported by Pace University Start-up Grant.
Soil properties and preferential solute transport at the field scale
NASA Astrophysics Data System (ADS)
Koestel, J. K.; Luong, N. M.; Nørgaard, T.; Vendelboe, A. L.; Moldrup, P.; Jarvis, N. J.; Lamandé, M.; Iversen, B. V.; Wollesen de Jonge, L.
2012-04-01
An important fraction of water flow and solute transport through soil takes place through preferential flow paths. Although this had been already observed in the nineteenth century, it had been forgotten by the scientific community until it was rediscovered during the 1970s. The awareness of the relevance of preferential flow was broadly re-established in the community by the early 1990s. However, since then, the notion remains widespread among soil scientists that the occurrence and strength of preferential flow cannot be predicted from measurable proxy variables such as soil properties or land management practices (e.g. Beven, K., 1991, Modeling preferential flow - an uncertain future, Preferential Flow, 1-11). In our study, we present evidence that disproves this notion. We evaluated breakthrough curve experiments under a constant irrigation rate of 1 cm/h conducted on 65 soil columns (20 cm diameter and 20 height) which had been sampled from an approximately 1 ha large loamy field-site in Silstrup, Denmark. We show that the holdback factor, which is an indicator for the strength of preferential transport, is strongly correlated to the bulk density, which in turn is correlated to the organic matter content. By applying multiple linear regression in a bootstrapping framework, we could estimate the holdback factor from the bulk density and the very fine sand fraction with a coefficient of determination of 0.65. Our results raise hopes that it is indeed possible to establish pedotransfer functions for soil susceptibility to preferential flow and transport.
Akiyama, Y.; Kawazu, T.; Noda, T.; Sakaki, H.
2010-01-04
We have studied electron transport in n-AlGaAs/GaAs heterojunction FET channels, in which chains of InGaAs nano-islands are embedded along quasi-periodic steps. By using two samples, conductance G{sub para}(V{sub g}) parallel to the steps and G{sub perp}(V{sub g}) perpendicular to them were measured at 80 K as functions of gate voltage V{sub g}. At sufficiently high V{sub g}, G{sub para} at 80 K is several times as high as G{sub perp}, which manifests the anisotropic two-dimensional transport of electrons. When V{sub g} is reduced to -0.7 V, G{sub perp} almost vanishes, while {sub Gpara} stays sizable unless V{sub g} is set below -0.8 V. These results indicate that 'inter-chain' barriers play stronger roles than 'intra-chain' barriers.
TASK 7 DEMONSTRATION OF THAMES FOR MICROSTRUCTURE AND TRANSPORT PROPERTIES
Langton, C.; Bullard, J.; Stutzman, P.; Snyder, K.; Garboczi, E.
2010-03-29
The goal of the Cementitious Barriers Partnership (CBP) is to develop a reasonable and realible set of tools to reduce the uncertainty in predicting the structural, hydraulic and chemical performance of cement barriers used in nuclear applications that are exposed to dynamic environmental conditions over extended time frames. One of these tools, the responsibility of NIST, is THAMES (Thermodynamic Hydration and Microstructure Evolution Simulator), which is being developed to describe cementitious binder microstructures and calculate important engineering properties during hydration and degradation. THAMES is designed to be a 'micro-probe', used to evaluate changes in microstructure and properties occurring over time because of hydration or degradation reactions in a volume of about 0.001 mm{sup 3}. It will be used to map out microstructural and property changes across reaction fronts, for example, with spatial resolution adequate to be input into other models (e.g., STADIUM{reg_sign}, LeachSX{trademark}) in the integrated CBP package. THAMES leverages thermodynamic predictions of equilibrium phase assemblages in aqueous geochemical systems to estimate 3-D virtual microstructures of a cementitious binder at different times during the hydration process or potentially during degradation phenomena. These virtual microstructures can then be used to calculate important engineering properties of a concrete made from that binder at prescribed times. In this way, the THAMES model provides a way to calculate the time evolution of important material properties such as elastic stiffness, compressive strength, diffusivity, and permeability. Without this model, there would be no way to update microstructure and properties for the barrier materials considered as they are exposed to the environment, thus greatly increasing the uncertainty of long-term transport predictions. This Task 7 report demonstrates the current capabilities of THAMES. At the start of the CBP project, THAMES
NASA Astrophysics Data System (ADS)
Proust, Gwénaëlle; Kalidindi, Surya R.
2006-08-01
Microstructure-sensitive design (MSD) is a novel mathematical framework that facilitates a rigorous consideration of the material microstructure as a continuous design variable in the engineering design enterprise [Adams, B.L., Henrie, A., Henrie, B., Lyon, M., Kalidindi, S.R., Garmestani, H., 2001. Microstructure-sensitive design of a compliant beam. J. Mech. Phys. Solids 49(8), 1639-1663; Adams, B.L., Lyon, M., Henrie, B., 2004. Microstructures by design: linear problems in elastic-plastic design. Int. J. Plasticity 20(8-9), 1577-1602; Kalidindi, S.R., Houskamp, J.R., Lyons, M., Adams, B.L., 2004. Microstructure sensitive design of an orthotropic plate subjected to tensile load. Int. J. Plasticity 20(8-9), 1561-1575]. MSD employs spectral representations of the local state distribution functions in describing the microstructure quantitatively, and these in turn enable development of invertible linkages between microstructure and effective properties using established homogenization (composite) theories. As a natural extension of the recent publications in MSD, we provide in this paper a detailed account of the methods that can be readily used by mechanical designers to construct first-order elastic-plastic property closures. The main focus in this paper is on the crystallographic texture (also called Orientation Distribution Function or ODF) as the main microstructural parameter controlling the elastic and yield properties of cubic (fcc and bcc) polycrystalline metals. The following specific advances are described in this paper: (i) derivation of rigorous first-order bounds for the off-diagonal terms of the effective elastic stiffness tensor and their incorporation in the MSD framework, (ii) delineation of the union of the property closures corresponding to both the upper and lower bound theories resulting in comprehensive first-order closures, (iii) development of generalized and readily usable expressions for effective anisotropic elastic-plastic properties
Hydrophobic organic contaminant transport property heterogeneity in the Borden Aquifer
NASA Astrophysics Data System (ADS)
Allen-King, Richelle M.; Kalinovich, Indra; Dominic, David F.; Wang, Guohui; Polmanteer, Reid; Divine, Dana
2015-03-01
We determined that the spatial heterogeneity in aquifer properties governing the reactive transport of volatile organic contaminants is defined by the arrangement of lithofacies. We measured permeability (k) and perchloroethene sorption distribution coefficient (Kd) for lithofacies that we delineated for samples from the Canadian Forces Base Borden Aquifer. We compiled existing data and collected 57 new cores to characterize a 30 m section of the aquifer near the test location of Mackay et al. (1986). The k and Kd were measured for samples taken at six elevations from all cores to create a data set consisting of nearly 400 colocated measurements. Through analysis of variance (corrected for multiple comparisons), we determined that the 12 originally mapped lithofacies could be grouped into five relatively distinct chemohydrofacies that capture the variability of both transport properties. The mean of ln k by lithofacies was related to the grain size and the variance was relatively consistent. In contrast, both the mean and variance of ln Kd were greater for more poorly sorted lithofacies, which were also typically more coarse-grained. Half of the aquifer sorption capacity occurred in the three highest-sorbing lithofacies but comprised only 20% of its volume. The model of the aquifer that emerged is that of discontinuous scour-fill deposits of medium sand, generally characterized by greater Kd and k, within laterally extensive fine-grained to very fine-grained sands of lower Kd and k. Our findings demonstrate the importance of considering source rock composition, transport, and deposition processes when constructing conceptual models of chemohydrofacies.
Overview of anisotropic flow measurements from ALICE
NASA Astrophysics Data System (ADS)
Zhou, You
2016-05-01
Anisotropic flow is an important observable to study the properties of the hot and dense matter, the Quark Gluon Plasma (QGP), created in heavy-ion collisions. Measurements of anisotropic flow for inclusive and identified charged hadrons are reported in Pb-Pb, p-Pb and pp collisions with the ALICE detector. The comparison of experimental measurements to various theoretical calculations are also presented in these proceedings.
Anisotropic System of Quasiparticles in Superfluid Helium
Adamenko, I.N.; Nemchenko, K.E.; Slipko, V.A.; Wyatt, A.F.G.
2006-02-17
The thermodynamic properties of anisotropic quasiparticle systems of He II are considered for all degrees of anisotropy. It is shown that the thermodynamic functions of a strongly anisotropic phonon-roton system are mainly determined by rotons at all temperatures. Analytical expressions for the roton thermodynamic functions are obtained for all degrees of anisotropy. The maximum anisotropy is limited by the criterion for thermodynamic stability, which is here derived for the whole temperature range.
Wu, Linmin; Zhang, Jing
2015-12-14
The mechanical properties of Li{sub x}CoO{sub 2} under various Li concentrations and associated anisotropy have been systematically studied using the first principles method. During the lithium intercalation process, the Young's modulus, bulk modulus, shear modulus, and ultimate strength increase with increasing lithium concentration. Strong anisotropy of mechanical properties between a-axis and c-axis in Li{sub x}CoO{sub 2} is identified at low lithium concentrations, and the anisotropy decreases with increasing lithium concentration. The observed lithium concentration dependence and anisotropy are explained by analyzing the charge transfer using Bader charge analysis, bond order analysis, and bond strength by investigating partial density of states and charge density difference. With the decrease of Li concentration, the charge depletion in the bonding regions increases, indicating a weaker Co-O bond strength. Additionally, the Young's modulus, bulk modulus, shear modulus, and toughness are obtained by simulating ab initio tensile tests. From the simulated stress-strain curves, Li{sub x}CoO{sub 2} shows the highest toughness, which is in contraction with Pugh criterion prediction based on elastic properties only.
NASA Astrophysics Data System (ADS)
Wu, Linmin; Zhang, Jing
2015-12-01
The mechanical properties of LixCoO2 under various Li concentrations and associated anisotropy have been systematically studied using the first principles method. During the lithium intercalation process, the Young's modulus, bulk modulus, shear modulus, and ultimate strength increase with increasing lithium concentration. Strong anisotropy of mechanical properties between a-axis and c-axis in LixCoO2 is identified at low lithium concentrations, and the anisotropy decreases with increasing lithium concentration. The observed lithium concentration dependence and anisotropy are explained by analyzing the charge transfer using Bader charge analysis, bond order analysis, and bond strength by investigating partial density of states and charge density difference. With the decrease of Li concentration, the charge depletion in the bonding regions increases, indicating a weaker Co-O bond strength. Additionally, the Young's modulus, bulk modulus, shear modulus, and toughness are obtained by simulating ab initio tensile tests. From the simulated stress-strain curves, LixCoO2 shows the highest toughness, which is in contraction with Pugh criterion prediction based on elastic properties only.
Epitaxial growth and electrical transport properties of Cr{sub 2}GeC thin films
Eklund, Per; Bugnet, Matthieu; Mauchamp, Vincent; Dubois, Sylvain; Tromas, Christophe; Jaouen, Michel; Cabioc'h, Thierry; Jensen, Jens; Piraux, Luc; Gence, Loiek
2011-08-15
Cr{sub 2}GeC thin films were grown by magnetron sputtering from elemental targets. Phase-pure Cr{sub 2}GeC was grown directly onto Al{sub 2}O{sub 3}(0001) at temperatures of 700-800 deg. C. These films have an epitaxial component with the well-known epitaxial relationship Cr{sub 2}GeC(0001)//Al{sub 2}O{sub 3}(0001) and Cr{sub 2}GeC(1120)//Al{sub 2}O{sub 3}(1100) or Cr{sub 2}GeC(1120)//Al{sub 2}O{sub 3}(1210). There is also a large secondary grain population with (1013) orientation. Deposition onto Al{sub 2}O{sub 3}(0001) with a TiN(111) seed layer and onto MgO(111) yielded growth of globally epitaxial Cr{sub 2}GeC(0001) with a virtually negligible (1013) contribution. In contrast to the films deposited at 700-800 deg. C, the ones grown at 500-600 deg. C are polycrystalline Cr{sub 2}GeC with (1010)-dominated orientation; they also exhibit surface segregations of Ge as a consequence of fast Ge diffusion rates along the basal planes. The room-temperature resistivity of our samples is 53-66 {mu}{Omega}cm. Temperature-dependent resistivity measurements from 15-295 K show that electron-phonon coupling is important and likely anisotropic, which emphasizes that the electrical transport properties cannot be understood in terms of ground state electronic structure calculations only.
Vinogradov, A V; Milichko, V A; Zaake-Hertling, H; Aleksovska, A; Gruschinski, S; Schmorl, S; Kersting, B; Zolnhofer, E M; Sutter, J; Meyer, K; Lönnecke, P; Hey-Hawkins, E
2016-05-01
A highly stable metal-organic framework, [{Fe3(ACTBA)2}X·6DEF]n (1; X = monoanion), based on trinuclear iron(iii) secondary building units connected by tetracarboxylates with an anthracene core, 2,6,9,10-tetrakis(p-carboxylatophenyl)anthracene (ACTBA), is reported. Depending on the direction of light polarisation, crystals of 1 exhibit anisotropic optical properties with birefringence Δn = 0.3 (λ = 590 nm). PMID:26906040
Golovan, L. A.; Zabotnov, S. V. Timoshenko, V. Yu.; Kashkarov, P. K.
2009-02-15
The effective-medium model has been generalized within the dipole approximation, with allowance for the shape anisotropy and dynamic depolarization of semiconductor nanoparticles. The calculations revealed nonmonotonic dependences for the birefringence and dichroism on the nanoparticle size. Comparison of the measured and calculated refractive index dispersion of birefringent porous silicon layers in the near-IR region indicates that consideration for the dynamic depolarization gives a better description of the optical properties for this material in comparison with the generally used effective-medium electrostatic approximation.
NASA Astrophysics Data System (ADS)
Spinner, Neil S.; Hinnant, Katherine M.; Mazurick, Ryan; Brandon, Andrew; Rose-Pehrsson, Susan L.; Tuttle, Steven G.
2016-04-01
Cylindrical 18650-type surrogate cells were designed and fabricated to mimic the thermophysical properties and behavior of active lithium-ion batteries. An internal jelly roll geometry consisting of alternating stainless steel and mica layers was created, and numerous techniques were used to estimate thermophysical properties. Surrogate cell density was measured to be 1593 ± 30 kg/m3, and heat capacity was found to be 727 ± 18 J/kg-K. Axial thermal conductivity was determined to be 5.1 ± 0.6 W/m-K, which was over an order of magnitude higher than radial thermal conductivity due to jelly roll anisotropy. Radial heating experiments were combined with numerical and analytical solutions to the time-dependent, radial heat conduction equation, and from the numerical method an additional estimate for heat capacity of 805 ± 23 J/kg-K was found. Using both heat capacities and analysis techniques, values for radial thermal conductivity were between 0.120 and 0.197 W/m-K. Under normal operating conditions, relatively low radial temperature distributions were observed; however, during extreme battery failure with a hexagonal cell package, instantaneous radial temperature distributions as high as 43-71 °C were seen. For a vertical cell package, even during adjacent cell failure, similar homogeneity in internal temperatures were observed, demonstrating thermal anisotropy.
Ionic transport properties of template-synthesized gold nanotube membranes
NASA Astrophysics Data System (ADS)
Gao, Peng
Ionic transport in nanotubes exhibits unique properties due to the strong interactions between ions and the nanotube surface. The main objective of my research is to explore and regulate the ionic transport in gold nanotube membranes. Chapter 1 overviews a versatile method of fabricating nanostructured materials, called the template synthesis. Important parameters of the template synthesis are introduced such as templates and deposition methods. The template synthesis method is used to prepare membranes used in this dissertation. Chapter 2 describes a method to increase the ionic conductivity in membranes containing gold nanotubes with small diameter (4 nm). The gold nanotube membrane is prepared by the electroless plating of gold in a commercially available polycarbonate membrane. Voltages are applied to the gold nanotube membrane and fixed charges are injected on the gold nanotube walls. We show that ionic conductivity of the gold nanotube membrane can be enhanced in aqueous potassium chloride (KCl) solution at negative applied voltages. When the most negative voltage (-0.8 V vs. Ag/AgCl) is applied to the membrane, the ionic conductivity of the solution inside the gold nanotube (94 mS.cm-1) is comparable to that of 1 M aqueous KCl, over two orders of magnitude higher than that of the 0.01 M KCl contacting the membrane. Chapter 3 explores another important transport property of the gold nanotube membrane -- ion permselectivity. When the permselective membrane separates two electrolyte solutions at different concentrations, a membrane potential is developed and measured by the potentiometric method. Surface charge density and the ion mobilities are estimated by fitting the experimental data with a pre-existing model. The surface charge density of the gold nanotube membrane in this research is estimated to be 2 muC/cm2. Chapter 4 describes voltage-controlled ionic transport in a gold/polypyrrole membrane doped with sodium dodecylbenzene sulfonate (DBS). Polypyrrole
Electrical transport properties of single-layer WS2.
Ovchinnikov, Dmitry; Allain, Adrien; Huang, Ying-Sheng; Dumcenco, Dumitru; Kis, Andras
2014-08-26
We report on the fabrication of field-effect transistors based on single layers and bilayers of the semiconductor WS2 and the investigation of their electronic transport properties. We find that the doping level strongly depends on the device environment and that long in situ annealing drastically improves the contact transparency, allowing four-terminal measurements to be performed and the pristine properties of the material to be recovered. Our devices show n-type behavior with a high room-temperature on/off current ratio of ∼10(6). They show clear metallic behavior at high charge carrier densities and mobilities as high as ∼140 cm(2)/(V s) at low temperatures (above 300 cm(2)/(V s) in the case of bilayers). In the insulating regime, the devices exhibit variable-range hopping, with a localization length of about 2 nm that starts to increase as the Fermi level enters the conduction band. The promising electronic properties of WS2, comparable to those of single-layer MoS2 and WSe2, together with its strong spin-orbit coupling, make it interesting for future applications in electronic, optical, and valleytronic devices. PMID:25069042
Anisotropic thermal properties of the polar crystal Cs{sub 2}TeMo{sub 3}O{sub 12}
Zhang, Junjie; Zhang, Zhonghan; Sun, Youxuan; Zhang, Chengqian; Tao, Xutang
2012-11-15
A Cs{sub 2}TeMo{sub 3}O{sub 12} single crystal with dimensions of 17 mm Multiplication-Sign 17 mm Multiplication-Sign 18 mm was grown using the top-seeded solution growth method. Thermal properties, including thermal expansion, specific heat, thermal diffusivity and thermal conductivity, were investigated as a function of temperature. The average linear thermal expansion coefficients along different crystallographic directions were measured to be {alpha}{sub a}=7.34 Multiplication-Sign 10{sup -6} K{sup -1} and {alpha}{sub c}=32.02 Multiplication-Sign 10{sup -6} K{sup -1} over the temperature range of 30-430 Degree-Sign C. The specific heat was measured to be 0.400-0.506 J g{sup -1} K{sup -1} from 22 Degree-Sign C to 440 Degree-Sign C. The thermal conductivity was calculated to be 1.86 and 0.76 W m{sup -1} K{sup -1} at 22 Degree-Sign C along the a and c axes, respectively. With increasing temperature from 22 to 430 Degree-Sign C, the thermal conductivity decreases by 33.0% along the a axis, while it decreases by 18.5% below 200 Degree-Sign C and then remains unchanged along the c axis. The relationship between structure and the thermal properties is also discussed. - Graphical Abstract: Centimeter-sized crystals of polar Cs{sub 2}TeMo{sub 3}O{sub 12} were grown using the top-seeded solution growth method. The relative large anisotropy in thermal expansion and thermal conductivity of Cs{sub 2}TeMo{sub 3}O{sub 12} is attributable to its layered structure. Highlights: Black-Right-Pointing-Pointer Cs{sub 2}TeMo{sub 3}O{sub 12} single crystals with dimensions of 17 Multiplication-Sign 17 Multiplication-Sign 18 mm{sup 3} were grown. Black-Right-Pointing-Pointer Thermal properties of Cs{sub 2}TeMo{sub 3}O{sub 12} were studied as a function of temperature. Black-Right-Pointing-Pointer The thermal expansion anisotropy of Cs{sub 2}TeMo{sub 3}O{sub 12} is explained using its structure. Black-Right-Pointing-Pointer To protect Cs{sub 2}TeMo{sub 3}O{sub 12} crystal, a small
Anisotropic elastic and vibrational properties of Ru2B3 and Os2B3: a first-principles investigation
NASA Astrophysics Data System (ADS)
Ozisik, Haci; Deligoz, Engin; Surucu, Gokhan; Bogaz Ozisik, Havva
2016-07-01
The structural, mechanical and lattice dynamical properties of Ru2B3 and Os2B3 have been investigated by using a first-principles method based on the density functional theory within the generalized gradient approximation. The single crystal elastic constants are numerically estimated using strain–stress approach. The polycrystalline aggregate elastic parameters are calculated from the single elastic constants via the Voigt–Reuss–Hill approximations. Subsequently, the ductility and brittleness are characterized with the estimation from Pugh’s rule (B/G) and Cauchy pressure. Additionally, the Debye temperature is calculated from the average elastic wave velocity obtained from bulk and shear moduli. The calculated parameters are consistent with the previous experimental and theoretical data. These borides are both mechanically and dynamically stable in the considered structure.
Ren, Hongru; Li, Xiongying; Li, Hui; Zhang, Leining; Wu, Weikang
2015-05-01
Molecular dynamics (MD) simulations are carried out to study the coalescence of identical adjacent and nonadjacent water films on graphene (G), vertically or horizontally stacked carbon nanotube arrays (VCNTA and HCNTA respectively). We highlight the key importance of carbon-based substrates in the growth of the liquid bridge connecting the two water films. This simulation provides reliable evidence to confirm a linear increase of the liquid bridge height, which is sensitive to the surface properties and the geometric structure. In the case of nonadjacent water films, the meniscus liquid bridge occurs solely on the VCNTA, which is attributed to the spreading of water films driven by the capillary force. Our results provide an available method to tune the coalescence of adjacent or nonadjacent films with alteration of topographically patterned surfaces, which has important implications in the design of condensation, ink-jet printing and drop manipulation on a substrate. PMID:25839066
Physicochemical properties determine nanomaterial cellular uptake, transport and fate
Zhu, Motao; Nie, Guangjun; Meng, Huan; Xia, Tian; Nel, Andre; Zhao, Yuliang
2015-01-01
CONSPECTUS There are a growing range of innovations in the field of nanobiotechnology and nanomedicine. However, the increased number of engineered nanomaterials (ENMs) and their novel physicochemical properties pose a new challenge of understanding the full spectrum of their interactions at the nano/bio interface, including the potential to engage in hazardous interactions. A comprehensive understanding of these interactions is required, including the physicochemical properties that control bioavailability and how this knowledge could be used for safer nanomaterial design. To this end, considerable knowledge generation and exploration is required to understand how material properties influence ENM uptake, transport and fate, as well as the biological consequences of these interactions at cellular level. The toxicity mechanisms of different ENMs differ with nanosize/nanosurface which directly correlates to the physicochemical activities of ENMs in vivo. So, to explore their underlying physicochemical processes of ENMs in cells will be essentially helpful for definitely understanding the toxicity of ENMs. In addition, the in vitro results are indispensable for modeling the biokinetics of ENMs. Nevertheless, we need to proceed such extrapolation with due caution, because the dosage relevance between the in vitro and in vivo exposure largely influences outcomes of the toxic response. In this Account, we delineate our view of the impact of ENM physicochemical properties on cellular bioprocessing based on the research performed in our laboratories. Because organic, inorganic, and hybrid ENMs can be produced in various sizes, shapes, surface modifications and compositions, and their widely tunable compositions and structures that can be dynamically modified under different biological and environmental use conditions. Therefore, a description of how ENM chemical properties such as (1) hydrophobicity and hydropholicity, (2) material composition, (3) surface
Optical and transport properties of dense liquid silica
Qi, Tingting; Millot, Marius; Kraus, Richard G.; Hamel, Sebastien; Root, Seth
2015-06-15
Using density-functional-theory based molecular dynamics and the Kubo-Greenwood linear response theory, we evaluated the high-pressure equation of state and the optical and transport properties of quartz and fused silica shock-compressed to 2000 GPa. The computed Hugoniots and corresponding optical reflectivity values are in very good agreement with published data for quartz, and new data that we obtained on fused silica using magnetically launched flyer plate experiments. The rise of optical reflectivity upon shock compression appears to be primarily a temperature-driven mechanism, which is relatively insensitive to small density variation. We observed that the electrical conductivity does not display Drude-like frequency dependence, especially at lower temperatures. In addition, the Wiedemann-Franz relation between electrical and thermal conductivities was found to be invalid. It suggests that even at three-fold compression, warm dense liquid silica on the Hugoniot curve is still far away from the degenerate limit.
Electrical Transport Properties of Liquid Sn-Sb Binary Alloys
NASA Astrophysics Data System (ADS)
Thakore, B. Y.; Suthar, P. H.; Khambholja, S. G.; Jani, A. R.
2010-06-01
The study of electrical transport properties viz. electrical resistivity, thermo electrical power and thermal conductivity of liquid Sn-Sb binary alloys have been made by our well recognized single parametric model potential. In the present work, screening functions due to Hartree, Taylor, Ichimaru et al.. Farid et al.. and Sarkar et al.. have been employed to incorporate the exchange and correlation effects. The liquid alloy is studied as a function of its composition at temperature 823 K according to the Faber-Ziman model. Further, thermoelectric power and thermal conductivity have been predicted. The values of electrical resistivity of binary alloys computed with Ichimaru et al. and Farid et al.. screening function are in good agreement with the experimental data.
The electrical transport properties of liquid Rb using pseudopotential theory
Patel, A. B. Bhatt, N. K. Thakore, B. Y. Jani, A. R.; Vyas, P. R.
2014-04-24
Certain electric transport properties of liquid Rb are reported. The electrical resistivity is calculated by using the self-consistent approximation as suggested by Ferraz and March. The pseudopotential due to Hasegawa et al for full electron-ion interaction, which is valid for all electrons and contains the repulsive delta function due to achieve the necessary s-pseudisation was used for the calculation. Temperature dependence of structure factor is considered through temperature dependent potential parameter in the pair potential. Finally, thermo-electric power and thermal conductivity are obtained. The outcome of the present study is discussed in light of other such results, and confirms the applicability of pseudopotential at very high temperature via temperature dependent pair potential.
The electrical transport properties of liquid Rb using pseudopotential theory
NASA Astrophysics Data System (ADS)
Patel, A. B.; Bhatt, N. K.; Thakore, B. Y.; Vyas, P. R.; Jani, A. R.
2014-04-01
Certain electric transport properties of liquid Rb are reported. The electrical resistivity is calculated by using the self-consistent approximation as suggested by Ferraz and March. The pseudopotential due to Hasegawa et al for full electron-ion interaction, which is valid for all electrons and contains the repulsive delta function due to achieve the necessary s-pseudisation was used for the calculation. Temperature dependence of structure factor is considered through temperature dependent potential parameter in the pair potential. Finally, thermo-electric power and thermal conductivity are obtained. The outcome of the present study is discussed in light of other such results, and confirms the applicability of pseudopotential at very high temperature via temperature dependent pair potential.
Transport properties of highly asymmetric hard-sphere mixtures.
Bannerman, Marcus N; Lue, Leo
2009-04-28
The static and dynamic properties of binary mixtures of hard spheres with a diameter ratio of sigma(B)/sigma(A)=0.1 and a mass ratio of m(B)/m(A)=0.001 are investigated using event driven molecular dynamics. The contact values of the pair correlation functions are found to compare favorably with recently proposed theoretical expressions. The transport coefficients of the mixture, determined from simulation, are compared to the predictions of the revised Enskog theory using both a third-order Sonine expansion and direct simulation Monte Carlo. Overall, the Enskog theory provides a fairly good description of the simulation data, with the exception of systems at the smallest mole fraction of larger spheres (x(A)=0.01) examined. A "fines effect" was observed at higher packing fractions, where adding smaller spheres to a system of large spheres decreases the viscosity of the mixture; this effect is not captured by the Enskog theory. PMID:19405594
Transport properties of highly asymmetric hard-sphere mixtures
NASA Astrophysics Data System (ADS)
Bannerman, Marcus N.; Lue, Leo
2009-04-01
The static and dynamic properties of binary mixtures of hard spheres with a diameter ratio of σB/σA=0.1 and a mass ratio of mB/mA=0.001 are investigated using event driven molecular dynamics. The contact values of the pair correlation functions are found to compare favorably with recently proposed theoretical expressions. The transport coefficients of the mixture, determined from simulation, are compared to the predictions of the revised Enskog theory using both a third-order Sonine expansion and direct simulation Monte Carlo. Overall, the Enskog theory provides a fairly good description of the simulation data, with the exception of systems at the smallest mole fraction of larger spheres (xA=0.01) examined. A "fines effect" was observed at higher packing fractions, where adding smaller spheres to a system of large spheres decreases the viscosity of the mixture; this effect is not captured by the Enskog theory.
Spin transport properties of triarylamine-based nanowires.
Bhattacharya, Sandip; Akande, Akinlolu; Sanvito, Stefano
2014-06-25
Triarylamine-derivatives can self-assemble upon light irradiation in one-dimensional nanowires with remarkable hole transport properties. We use a combination of density functional theory and Monte Carlo simulations to predict the nanowires spin-diffusion length. The orbital nature of the nanowires valence band, namely a singlet π-like band localised on N, suggests that hyperfine coupling may be weak and that spin-orbit interaction is the primary source of intrinsic spin relaxation. Thus, we construct a model where the spin-orbit interaction mixes the spins of the valence band with that of three degenerate lower valence bands of sp(2) nature. The model includes also electron-phonon interaction with a single longitudinal mode. We find a room temperature spin-diffusion length of the order of 100 nm, which increases to 300 nm at 200 K. Our results indicate that triarylamine-based nanowires are attractive organic semiconductors for spintronics applications. PMID:24825819
Optical and transport properties of dense liquid silica
NASA Astrophysics Data System (ADS)
Qi, Tingting; Millot, Marius; Kraus, Richard G.; Root, Seth; Hamel, Sebastien
2015-06-01
Using density-functional-theory based molecular dynamics and the Kubo-Greenwood linear response theory, we evaluated the high-pressure equation of state and the optical and transport properties of quartz and fused silica shock-compressed to 2000 GPa. The computed Hugoniots and corresponding optical reflectivity values are in very good agreement with published data for quartz, and new data that we obtained on fused silica using magnetically launched flyer plate experiments. The rise of optical reflectivity upon shock compression appears to be primarily a temperature-driven mechanism, which is relatively insensitive to small density variation. We observed that the electrical conductivity does not display Drude-like frequency dependence, especially at lower temperatures. In addition, the Wiedemann-Franz relation between electrical and thermal conductivities was found to be invalid. It suggests that even at three-fold compression, warm dense liquid silica on the Hugoniot curve is still far away from the degenerate limit.
Structural and Transport Properties of Dielectrophoretically Assembled Interconnects
NASA Astrophysics Data System (ADS)
Ozturk, Birol; Talukdar, Ishan; Thapa, Prem; Blackledge, Charles; Grischkowsky, Daniel; Flanders, Bret
2006-03-01
Dielectrophoresis was used to form ˜140nm diameter interconnects composed of gold nanorods between targeted points in a circuit. Cleanroom-based lithographic procedures were used to produce identical arrays of electrodes, improving the sample-to-sample reproducibility of the interconnect-conductances to ˜10%. Transmission electron microscopy and low temperature conductivity analyses indicate that the Coulomb Blockade associated with the individual nanorods is the primary conductance-limiting feature. To further improve the reproducibility of the structural and transport properties of dielectrophoretic interconnects, we investigate submicron wire formation in aqueous solutions of indium acetate. Our preliminary data show that single crystal wires with submicron diameters may be fabricated from such solutions.
Coarse grained modeling of transport properties in monoclonal antibody solution
NASA Astrophysics Data System (ADS)
Swan, James; Wang, Gang
Monoclonal antibodies and their derivatives represent the fastest growing segment of the bio pharmaceutical industry. For many applications such as novel cancer therapies, high concentration, sub-cutaneous injections of these protein solutions are desired. However, depending on the peptide sequence within the antibody, such high concentration formulations can be too viscous to inject via human derived force alone. Understanding how heterogenous charge distribution and hydrophobicity within the antibodies leads to high viscosities is crucial to their future application. In this talk, we explore a coarse grained computational model of therapeutically relevant monoclonal antibodies that accounts for electrostatic, dispersion and hydrodynamic interactions between suspended antibodies to predict assembly and transport properties in concentrated antibody solutions. We explain the high viscosities observed in many experimental studies of the same biologics.
Transport Properties of n-POLYANILINE/p-POROUS Silicon Heterojunctions
NASA Astrophysics Data System (ADS)
Farag, A. A. M.; Ashery, A.; Yahia Abed, M.; Shenashen, M. A.; Hindia, T. A.
The donor/acceptor heterojunction devices having configuration n-PANI/p-PSi were fabricated by in-situ chemical oxidative polymerization method of aniline on p-type porous silicon. The structure of n-PANI/p-PSi junctions was examined by scanning electron microscopy and X-ray diffraction spectroscopy. The dark current-voltage measurements were performed in the temperature range of 303-393 K to determine the electrical transport mechanisms of these devices. Rectifying properties were obtained and capacitance-voltage at 1 MHz behavior indicates an abrupt interface. At low forward bias, the current was found to be limited by thermionic emission of holes from p-PSi over the PANI/PSi barrier in the PANI thin film. For relatively higher voltage, the conduction was dominated by a space charge limited current mechanism, with an exponential distribution of traps. Also, various electrical parameters were determined from the I-V and C-V analysis.
Transport timescales and tracer properties in the extratropical UTLS
NASA Astrophysics Data System (ADS)
Hoor, P.; Wernli, H.; Hegglin, M. I.; Bönisch, H.
2010-08-01
A comprehensive evaluation of seasonal backward trajectories initialized in the northern hemisphere lowermost stratosphere (LMS) has been performed to investigate the factors that determine the temporal and spatial structure of troposphere-to-stratosphere-transport (TST) and it's impact on the LMS. In particular we explain the fundamental role of the transit time since last TST (tTST) for the chemical composition of the LMS. According to our results the structure of the LMS can be characterized by a layer with tTST<40 days forming a narrow band around the local tropopause. This layer extends about 30 K above the local dynamical tropopause, corresponding to the extratropical tropopause transition layer (ExTL) as identified by CO. The LMS beyond this layer shows a relatively well defined separation as marked by an aprupt transition to longer tTST indicating less frequent mixing and a smaller fraction of tropospheric air. Thus the LMS constitutes a region of two well defined regimes of tropospheric influence. These can be characterized mainly by different transport times from the troposphere and different fractions of tropospheric air. Carbon monoxide (CO) mirrors this structure of tTST due to it's finite lifetime on the order of three months. Water vapour isopleths, on the other hand, do not uniquely indicate TST and are independent of tTST, but are determined by the Lagrangian Cold Point (LCP) of air parcels. Most of the backward trajectories from the LMS experienced their LCP in the tropics and sub-tropics, and TST often occurs 20 days after trajectories have encountered their LCP. Therefore, ExTL properties deduced from CO and H2O provide totally different informations on transport and particular TST for the LMS.
Transport properties of ultrathin black phosphorus on hexagonal boron nitride
Doganov, Rostislav A.; Özyilmaz, Barbaros; Koenig, Steven P.; Yeo, Yuting; Watanabe, Kenji; Taniguchi, Takashi
2015-02-23
Ultrathin black phosphorus, or phosphorene, is a two-dimensional material that allows both high carrier mobility and large on/off ratios. Similar to other atomic crystals, like graphene or layered transition metal dichalcogenides, the transport behavior of few-layer black phosphorus is expected to be affected by the underlying substrate. The properties of black phosphorus have so far been studied on the widely utilized SiO{sub 2} substrate. Here, we characterize few-layer black phosphorus field effect transistors on hexagonal boron nitride—an atomically smooth and charge trap-free substrate. We measure the temperature dependence of the field effect mobility for both holes and electrons and explain the observed behavior in terms of charged impurity limited transport. We find that in-situ vacuum annealing at 400 K removes the p-doping of few-layer black phosphorus on both boron nitride and SiO{sub 2} substrates and reduces the hysteresis at room temperature.
Tuning transport properties on graphene multiterminal structures by mechanical deformations
NASA Astrophysics Data System (ADS)
Latge, Andrea; Torres, Vanessa; Faria, Daiara
The realization of mechanical strain on graphene structures is viewed as a promise route to tune electronic and transport properties such as changing energy band-gaps and promoting localization of states. Using continuum models, mechanical deformations are described by effective gauge fields, mirrored as pseudomagnetic fields that may reach quite high values. Interesting symmetry features are developed due to out of plane deformations on graphene; lift sublattice symmetry was predicted and observed in centrosymmetric bumps and strained nanobubbles. Here we discuss the effects of Gaussian-like strain on a hexagonal graphene flake connected to three leads, modeled as perfect graphene nanoribbons. The Green function formalism is used within a tight-binding approximation. For this particular deformation sharp resonant states are achieved depending on the strained structure details. We also study a fold-strained structure in which the three leads are deformed extending up to the very center of the hexagonal flake. We show that conductance suppressions can be controlled by the strain intensity and important transport features are modeled by the electronic band structure of the leads.
Magnetocaloric-transport properties correlation in doped manganites
NASA Astrophysics Data System (ADS)
Mohamed, Abd El-Moez A.; Hernando, B.; Ahmed, A. M.
2016-05-01
This investigation is interested in studying the relation between magnetocaloric effect and transport properties in La0.7Ba0.3MnO3 manganite compound. The resistivity shows a metal-semiconductor transition at Tms temperature near to its reported Curie temperature (Tc). Magnetic field application decreases resistivity and increases Tms towards higher temperatures. The magnetoresistance shows a peak around Tc and increases in value with the applied magnetic field. A similar behavior has been observed between magnetic entropy change (ΔS), resistivity and magnetoresistance around Tc, this is attributed to the spin order/disorder feature that plays a main role in the magnetocaloric-transport correlation. In spite of this similarity, the correspondence among the experimental ΔS and ΔS based resistivity calculations is missing because of lattice polarons effect on resistivity as a result of the electron-phonon interaction. The magnetocaloric-magnetoresistance relation is also studied and results show the contribution of additional factors in the magnetoresistance mechanism other than spin disorder suppression as Jahn-Teller effect and electronic phase separation.
Electron Transport Materials: Synthesis, Properties and Device Performance
Cosimbescu, Lelia; Wang, Liang; Helm, Monte L.; Polikarpov, Evgueni; Swensen, James S.; Padmaperuma, Asanga B.
2012-06-01
We report the design, synthesis and characterization, thermal and photophysical properties of two silane based electron transport materials, dibenzo[b,d]thiophen-2-yltriphenylsilane (Si{phi}87) and (dibenzo[b,d]thiophen-2-yl)diphenylsilane (Si{phi}88) and their performance in blue organic light emitting devices (OLEDs). The utility of these materials in blue OLEDs with iridium (III) bis[(4,6-difluorophenyl)-pyridinato-N,C']picolinate (Firpic) as the phosphorescent emitter was demonstrated. Using the silane Si{phi}87 as the electron transport material (ETm) an EQE of 18.2% was obtained, with a power efficiency of 24.3 lm/W (5.8V at 1mA/cm{sup 2}), in a heterostructure. When Si{phi}88 is used, the EQE is 18.5% with a power efficiency of 26.0 lm/W (5.5V at 1mA/cm{sup 2}).
Transport properties of elastically coupled fractional Brownian motors
NASA Astrophysics Data System (ADS)
Lv, Wangyong; Wang, Huiqi; Lin, Lifeng; Wang, Fei; Zhong, Suchuan
2015-11-01
Under the background of anomalous diffusion, which is characterized by the sub-linear or super-linear mean-square displacement in time, we proposed the coupled fractional Brownian motors, in which the asymmetrical periodic potential as ratchet is coupled mutually with elastic springs, and the driving source is the external harmonic force and internal thermal fluctuations. The transport mechanism of coupled particles in the overdamped limit is investigated as the function of the temperature of baths, coupling constant and natural length of the spring, the amplitude and frequency of driving force, and the asymmetry of ratchet potential by numerical stimulations. The results indicate that the damping force involving the information of historical velocity leads to the nonlocal memory property and blocks the traditional dissipative motion behaviors, and it even plays a cooperative role of driving force in drift motion of the coupled particles. Thus, we observe various non-monotonic resonance-like behaviors of collective directed transport in the mediums with different diffusion exponents.
Transport properties of polyaniline-cellulose-acetate blends
NASA Astrophysics Data System (ADS)
Planès, Jérôme; Wolter, Andreas; Cheguettine, Yasmina; Proń, Adam; Genoud, Françoise; Nechtschein, Maxime
1998-09-01
Transport properties of polyaniline (PANI)-cellulose acetate (CA) conducting blends have been investigated at various length scales and temperatures. We report on the results of dc and ac conductivity measurements, magnetoresistance and electron-spin resonance (ESR) performed on composite films with PANI weight fraction p ranging from the percolation threshold-pc~=0.1%-to a few percent. Three different PANI doping agents have been tested, namely, camphor sulfonic acid (CSA), di(i-octyl phosphate) (DiOP) and phenyl phosphonic acid (PPA). The percolative behavior of σdc resembles that of published results on PANI/PMMA blends. The onset frequency ωξ of the dispersion in σac appears to follow the scaling law: ωξ~σzdc with z~=1. The temperature dependence is of the form of lnσ(T)~-(T0/T)γ the exponent decreasing from 0.75 to 0.5 with increasing p. The microscopic metallic character of transport is found in ESR and microwave measurements. Spin-dependent conductivity is inferred from the (B/T)2 universal behavior of magnetoresistance. Those results are discussed in conjunction with the ongoing debate on the nature of disorder in conducting polymers-homogeneous versus heterogeneous.
Predicting the transport properties of sedimentary rocks from microstructure
Schlueter, E.M.
1995-01-01
Understanding transport properties of sedimentary rocks, including permeability, relative permeability, and electrical conductivity, is of great importance for petroleum engineering, waste isolation, environmental restoration, and other applications. These transport properties axe controlled to a great extent by the pore structure. How pore geometry, topology, and the physics and chemistry of mineral-fluid and fluid-fluid interactions affect the flow of fluids through consolidated/partially consolidated porous media are investigated analytically and experimentally. Hydraulic and electrical conductivity of sedimentary rocks are predicted from the microscopic geometry of the pore space. Cross-sectional areas and perimeters of individual pores are estimated from two-dimensional scanning electron microscope (SEM) photomicrographs of rock sections. Results, using Berea, Boise, Massilon, and Saint-Gilles sandstones show close agreement between the predicted and measured permeabilities. Good to fair agreement is found in the case of electrical conductivity. In particular, good agreement is found for a poorly cemented rock such as Saint-Gilles sandstone, whereas the agreement is not very good for well-cemented rocks. The possible reasons for this are investigated. The surface conductance contribution of clay minerals to the overall electrical conductivity is assessed. The effect of partial hydrocarbon saturation on overall rock conductivity, and on the Archie saturation exponent, is discussed. The region of validity of the well-known Kozeny-Carman permeability formulae for consolidated porous media and their relationship to the microscopic spatial variations of channel dimensions are established. It is found that the permeabilities predicted by the Kozeny-Carman equations are valid within a factor of three of the observed values methods.
Yin, Jun; Chaitanya, Kadali; Ju, Xue-Hai
2016-03-01
The crystal structures of known anthra-tetrathiophene (ATT) and its three fluorinated derivatives (ATT1, ATT2 and ATT3) were predicted by the Monte Carlo-simulated annealing method with the embedded electrostatic potential (ESP) charges. The most stable crystal structures were further optimized by the density functional theory with the dispersion energy (DFT-D) method. In addition, the effect of the electron-withdrawing fluorine atoms on the molecular geometry, molecular stacking, electronic and transport properties of title compounds were investigated by the density functional theory and the incoherent charge-hopping model. The calculated results show that the introduction of fluorine atoms does not affect the molecular planarity but decreases the HOMO-LUMO gap, which is beneficial to electron injection and provides more charge carrier stabilization. The improved electron mobility from ATT to ATT3 is attributed to the favorable molecular packing with strong π-π interaction and the short stacking distance. ATT2 and ATT3 exhibit remarkable angular dependence of mobilities and anisotropic behaviors. The band structures reveal that all the paths with larger transfer integrals are along the directions of large dispersions in the valence band (VB) and conduction band (CB). ATT3 has the largest electron mobility (0.48 cm(2)V(-1)s(-1)) among the four compounds, indicating that fluorination is an effective approach to improve electron transport. PMID:26774641
Anisotropic models for compact stars
NASA Astrophysics Data System (ADS)
Maurya, S. K.; Gupta, Y. K.; Ray, Saibal; Dayanandan, Baiju
2015-05-01
In the present paper we obtain an anisotropic analog of the Durgapal and Fuloria (Gen Relativ Gravit 17:671, 1985) perfect fluid solution. The methodology consists of contraction of the anisotropic factor with the help of both metric potentials and . Here we consider the same as Durgapal and Fuloria (Gen Relativ Gravit 17:671, 1985) did, whereas is as given by Lake (Phys Rev D 67:104015, 2003). The field equations are solved by the change of dependent variable method. The solutions set mathematically thus obtained are compared with the physical properties of some of the compact stars, strange star as well as white dwarf. It is observed that all the expected physical features are available related to the stellar fluid distribution, which clearly indicates the validity of the model.
RELATIONSHIP BETWEEN CELL SURFACE PROPERTIES AND TRANSPORT OF BACTERIA THROUGH SOIL
A study was conducted to relate the properties of Enterobacter, Pseudomonas, Bacillus, Achromobacter, Flavobacterium, and Arthrobacter strains to their transport with water moving through soil. the bacteria differed markedly in their extent of transport; their hydrophobicity, as...
NASA Astrophysics Data System (ADS)
Vargas, Jose M.; Gómez, Javier
2014-10-01
The effects of the electric and magnetic field variation on multiferroic heterostructure were studied in this work. Thin films of polycrystalline Fe50Pt50 (FePt) were grown by dc-sputtering on top of the commercial slabs of lead magnesium niobate-lead titanate (PMN-PT). The sample was a (011)-cut single crystal and had one side polished. In this condition, the PMN-PT/FePt operates in the L-T (longitudinal magnetized-transverse polarized) mode. A FePt thin film of 20 nm was used in this study to avoid the characteristic broad microwave absorption line associated with these films above thicknesses of 40 nm. For the in-plane easy magnetization axis (01-1), a microwave magnetoelectric (ME) coupling of 28 Oe cm kV -1 was estimated, whereas a value of 42 Oe cm kV -1 was obtained through the hard magnetization axis (100). Insight into the effects of the in-plane strain anisotropy on the ME coupling is obtained from the dc-magnetization loops. It was observed that the trend was opposite along the easy and hard magnetic directions. In particular, along the easy-magnetic axis (01-1), a square and narrow loop with a factor of Mr/MS of 0.96 was measured at 10 kV/cm. Along the hard-magnetic axis, a factor of 0.16 at 10 kV/cm was obtained. Using electric tuning via microwave absorption at X-band (9.78 GHz), we observe completely different trends along the easy and hard magnetic directions; Multiple absorption lines along the latter axis compared to a single and narrower absorption line along the former. In spite of its intrinsic complexity, we propose a model which gives good agreement both for static and microwave properties. These observations are of fundamental interest for future ME microwave components, such as filters, phase-shifters, and resonators.
Soh, Wee Tee; Ong, C. K.; Zhong, Xiaoxi
2014-09-15
FeAlSi (Sendust) is known to possess excellent soft magnetic properties comparable to traditional soft magnetic alloys such as NiFe (Permalloy), while having a relatively higher resistance for lower eddy current losses. However, their dynamic magnetic and magneto-transport properties are not well-studied. Via the spin rectification effect, we electrically characterize a series of obliquely sputtered FeAlSi films at ferromagnetic resonance. The variations of the anisotropy fields and damping with oblique angle are extracted and discussed. In particular, two-magnon scattering is found to dominate the damping behavior at high oblique angles. An analysis of the results shows large anomalous Hall effect and anisotropic magneto-resistance across all samples, which decreases sharply with increasing oblique incidence.
Transport Properties of Gate Tunable Graphene-Based Tunnel Diodes
NASA Astrophysics Data System (ADS)
Farmer, Damon; Perebeinos, Vasili; Avouris, Phaedon
2012-02-01
Due to its linear dispersion relation and unique physical properties, graphene has become a material of intense experimental and theoretical investigation. There has been rapid progress in the fabrication and understanding of graphene devices, particularly those based on the field effect transistor (FET) configuration. These three-terminal switches rely on a gate field to control electronic transport (diffusive or quasi-ballistic) in the graphene channel, where the field is perpendicular to the current flow. Here, a different type of three-terminal graphene device is demonstrated, one based on quantum tunneling. These devices build upon the convention two-terminal metal-insulator-metal (MIM) tunnel diode configuration by replacing one of the metal electrodes with graphene. Incorporation of a third (gate) electrode allows for modulation of the accessible density of states in the graphene electrode, thereby tuning the threshold voltage for tunneling in the diode. This tunable diode concept, where the gate field is parallel to the tunneling direction, is novel for a purely solid-state system. The device characteristics owing to the unique properties of graphene will be discussed, as will the underlying physics of device operation.
Testing different formulations of leading-order anisotropic hydrodynamics
NASA Astrophysics Data System (ADS)
Tinti, Leonardo; Ryblewski, Radoslaw; Florkowski, Wojciech; Strickland, Michael
2016-02-01
A recently obtained set of the equations for leading-order (3+1)D anisotropic hydrodynamics is tested against exact solutions of the Boltzmann equation with the collisional kernel treated in the relaxation time approximation. In order to perform detailed comparisons, the new anisotropic hydrodynamics equations are reduced to the boost-invariant and transversally homogeneous case. The agreement with the exact solutions found using the new anisotropic hydrodynamics equations is similar to that found using previous, less general formulations of anisotropic hydrodynamics. In addition, we find that, when compared to a state-of-the-art second-order viscous hydrodynamics framework, leading-order anisotropic hydrodynamics better reproduces the exact solution for the pressure anisotropy and gives comparable results for the bulk pressure evolution. Finally, we compare the transport coefficients obtained using linearized anisotropic hydrodynamics with results obtained using second-order viscous hydrodynamics.
Anisotropic nanomaterials: structure, growth, assembly, and functions
Sajanlal, Panikkanvalappil R.; Sreeprasad, Theruvakkattil S.; Samal, Akshaya K.; Pradeep, Thalappil
2011-01-01
Comprehensive knowledge over the shape of nanomaterials is a critical factor in designing devices with desired functions. Due to this reason, systematic efforts have been made to synthesize materials of diverse shape in the nanoscale regime. Anisotropic nanomaterials are a class of materials in which their properties are direction-dependent and more than one structural parameter is needed to describe them. Their unique and fine-tuned physical and chemical properties make them ideal candidates for devising new applications. In addition, the assembly of ordered one-dimensional (1D), two-dimensional (2D), and three-dimensional (3D) arrays of anisotropic nanoparticles brings novel properties into the resulting system, which would be entirely different from the properties of individual nanoparticles. This review presents an overview of current research in the area of anisotropic nanomaterials in general and noble metal nanoparticles in particular. We begin with an introduction to the advancements in this area followed by general aspects of the growth of anisotropic nanoparticles. Then we describe several important synthetic protocols for making anisotropic nanomaterials, followed by a summary of their assemblies, and conclude with major applications. PMID:22110867
Optical and Transport Properties of Organic Molecules: Methods and Applications
NASA Astrophysics Data System (ADS)
Strubbe, David Alan
Organic molecules are versatile and tunable building blocks for technology, in nanoscale and bulk devices. In this dissertation, I will consider some important applications for organic molecules involving optical and transport properties, and develop methods and software appropriate for theoretical calculations of these properties. Specifically, we will consider second-harmonic generation, a nonlinear optical process; photoisomerization, in which absorption of light leads to mechanical motion; charge transport in junctions formed of single molecules; and optical excitations in pentacene, an organic semiconductor with applications in photovoltaics, optoelectronics, and flexible electronics. In the Introduction (Chapter 1), I will give an overview of some phenomenology about organic molecules and these application areas, and discuss the basics of the theoretical methodology I will use: density-functional theory (DFT), time-dependent density-functional theory (TDDFT), and many-body perturbation theory based on the GW approximation. In the subsequent chapters, I will further discuss, develop, and apply this methodology. 2. I will give a pedagogical derivation of the methods for calculating response properties in TDDFT, with particular focus on the Sternheimer equation, as will be used in subsequent chapters. I will review the many different response properties that can be calculated (dynamic and static) and the appropriate perturbations used to calculate them. 3. Standard techniques for calculating response use either integer occupations (as appropriate for a system with an energy gap) or fractional occupations due to a smearing function, used to improve convergence for metallic systems. I will present a generalization which can be used to compute response for a system with arbitrary fractional occupations. 4. Chloroform (CHCl3) is a small molecule commonly used as a solvent in measurements of nonlinear optics. I computed its hyperpolarizability for second
Unusual Transport and Strongly Anisotropic Thermopower in PtCoO_{2} and PdCoO_{2}
Ong, Khuong P.; Singh, David J.; Wu, Ping
2010-04-28
We show, using Boltzmann transport calculations and analysis of experimental data, that hexagonal PdCoO_{2} and PtCoO_{2} have a highly unusual metallic transport. The in-plane transport is typical of a very good metal, with high conductivity and low positive thermopower. The c-axis transport is completely different, with 2 orders of magnitude lower, but still coherent, conductivity and remarkably a very large negative thermopower. This large anisotropy of the thermopower provides an opportunity for investigating transport in a highly unusual regime using bulk materials.
NASA Astrophysics Data System (ADS)
Zheng, Jing-Jing; Margine, E. R.
2016-08-01
The ab initio anisotropic Migdal-Eliashberg formalism has been used to examine the pairing mechanism and the nature of the superconducting gap in the recently discovered lithium-decorated monolayer graphene superconductor. Our results provide evidence that the superconducting transition in Li-decorated monolayer graphene can be explained within a standard phonon-mediated mechanism. We predict a single anisotropic superconducting gap and a critical temperature Tc=5.1 -7.6 K , in very good agreement with the experimental results.
Microstructure and water vapor transport properties of temperature sensitive polyurethanes
NASA Astrophysics Data System (ADS)
Ding, Xuemei
Temperature sensitive polyurethane (TS-PU) is one novel type of smart polymers. The water vapor permeability (WVP) of its membrane could undergo a significant increase as temperature increases within a predetermined temperature range. Such smart property enables this material to have a broad range of potential applications to textile industry, medicine, environmental fields and so on. However, based on the literature review, contradicting results were found on some TS-PUs. The aims of this project are to synthesize TS-PU with Tm in the broader temperature range including ambient temperature range, and then investigate systematically the relationships between microstructure and water vapor transport properties of TS-PU. For this purpose, in this project, a series of polyurethanes (PU) were synthesized using five different crystalline polyols with approximately similar molecule weight and three different hydrophilic contents, and dense membranes were prepared accordingly. The microstructure and properties of these PUs were investigated using DSC, WAXD, DMA, FTIR, GPC, POM, TEM, SEM and PALS. Their equilibrium water sorption and water vapor permeability were measured accordingly. Results show that crystal melting of these resulting PUs take place in the temperature range from -10--60°C as desired. Storage modulus (E') drops down quickly in the temperature range of crystal melting, suggesting a great transition in the predetermined temperature range. The decreased HSC as well as regular chemical structure of polyols results in the larger spherulites and higher melting end temperature, and the higher crystallinity induces the more obvious incompatibility of soft segment and hard segment in the PUs. These PUs are proved to have good enough tensile properties for textile application. The mean free volume size and fractional free volume increase more significantly in the temperature range of crystal melting than in other temperature intervals. Finally, as expected, the
Oxygen nonstoichiometry and transport properties of strontium substituted lanthanum ferrite
Sogaard, Martin Vang Hendriksen, Peter; Mogensen, Mogens
2007-04-15
This study presents an investigation of the properties of (La{sub 0.6}Sr{sub 0.4}){sub 0.99}FeO{sub 3-{delta}} (LSF40) covering thermomechanical properties, oxygen nonstoichiometry and electronic and ionic conductivity. Finally, oxygen permeation experiments have been carried out and the oxygen flux has been determined as a function of temperature and driving force. The electrical conductivity was measured using a 4 probe method. It is shown that the electrical conductivity is a function of the charge carrier concentration only. The electron hole mobility is found to decrease with increasing charge carrier concentration in agreement with recent literature. Values of the chemical diffusion coefficient, D{sub Chem}, and the surface exchange coefficient, k{sub Ex}, have been determined using electrical conductivity relaxation. At 800 deg. CD{sub Chem} is determined to be 6.2x10{sup -6}cm{sup 2}s{sup -1} with an activation energy of 137kJmol{sup -1}. The surface exchange coefficient is found to decrease with decreasing oxygen partial pressure. Oxygen permeation experiments were carried out. The flux through a membrane placed between air and wet hydrogen/nitrogen was J{sub O{sub 2}}{approx}1.8x10{sup -6}molcm{sup -2}s{sup -1} (corresponding to an equivalent electrical current density of 670mAcm{sup -2}). The oxygen permeation measurements are successfully interpreted based on the oxygen nonstoichiometry data and the determined transport parameters.
NASA Astrophysics Data System (ADS)
Tayarani-Yoosefabadi, Z.; Harvey, D.; Bellerive, J.; Kjeang, E.
2016-01-01
Gas diffusion layer (GDL) materials in polymer electrolyte membrane fuel cells (PEMFCs) are commonly made hydrophobic to enhance water management by avoiding liquid water blockage of the pores and facilitating reactant gas transport to the adjacent catalyst layer. In this work, a stochastic microstructural modeling approach is developed to simulate the transport properties of a commercial carbon paper based GDL under a range of PTFE loadings and liquid water saturation levels. The proposed novel stochastic method mimics the GDL manufacturing process steps and resolves all relevant phases including fiber, binder, PTFE, liquid water, and gas. After thorough validation of the general microstructure with literature and in-house data, a comprehensive set of anisotropic transport properties is simulated for the reconstructed GDL in different PTFE loadings and liquid water saturation levels and validated through a comparison with in-house ex situ experimental data and empirical formulations. In general, the results show good agreement between simulated and measured data. Decreasing trends in porosity, gas diffusivity, and permeability is obtained by increasing the PTFE loading and liquid water content, while the thermal conductivity is found to increase with liquid water saturation. Using the validated model, new correlations for saturation dependent GDL properties are proposed.
NASA Technical Reports Server (NTRS)
Gordon, S.
1982-01-01
Thermodynamic and transport combustion properties were calculated for a wide range of conditions for the reaction of hydrocarbons with air. Three hydrogen-carbon atom ratios (H/C = 1.7, 2.0, 2.1) were selected to represent the range of aircraft fuels. For each of these H/C ratios, combustion properties were calculated for the following conditions: Equivalence ratio: 0, 0.25, 0.5, 0.75, 1.0, 1.25 Water - dry air mass ratio: 0, 0.03 Pressure, kPa: 1.01325, 10.1325, 101.325, 1013.25, 5066.25 (or in atm: 0.01, 0.1, 1, 10, 50) Temperature, K: every 10 degrees from 200 to 900 K; every 50 degrees from 900 to 3000 K Temperature, R: every 20 degrees from 360 to 1600 R; very 100 degrees from 1600 to 5400 R. The properties presented are composition, density, molecular weight, enthalphy, entropy, specific heat at constant pressure, volume derivatives, isentropic exponent, velocity of sound, viscosity, thermal conductivity, and Prandtl number. Property tables are based on composites that were calculated by assuming both: (1) chemical equilibrium (for both homogeneous and heterogeneous phases) and (2) constant compositions for all temperatures. Properties in SI units are presented in this report for the Kelvin temperature schedules.
NASA Astrophysics Data System (ADS)
Gordon, S.
1982-07-01
Thermodynamic and transport combustion properties were calculated for a wide range of conditions for the reaction of hydrocarbons with air. Three hydrogen-carbon atom ratios (H/C = 1.7, 2.0, 2.1) were selected to represent the range of aircraft fuels. For each of these H/C ratios, combustion properties were calculated for the following conditions: Equivalence ratio: 0, 0.25, 0.5, 0.75, 1.0, 1.25 Water - dry air mass ratio: 0, 0.03 Pressure, kPa: 1.01325, 10.1325, 101.325, 1013.25, 5066.25 (or in atm: 0.01, 0.1, 1, 10, 50) Temperature, K: every 10 degrees from 200 to 900 K; every 50 degrees from 900 to 3000 K Temperature, R: every 20 degrees from 360 to 1600 R; very 100 degrees from 1600 to 5400 R. The properties presented are composition, density, molecular weight, enthalphy, entropy, specific heat at constant pressure, volume derivatives, isentropic exponent, velocity of sound, viscosity, thermal conductivity, and Prandtl number. Property tables are based on composites that were calculated by assuming both: (1) chemical equilibrium (for both homogeneous and heterogeneous phases) and (2) constant compositions for all temperatures. Properties in SI units are presented in this report for the Kelvin temperature schedules.
Transport Properties of Nanoscale Materials by First-principles Calculations
NASA Astrophysics Data System (ADS)
Mizuseki, Hiroshi; Belosludov, Rodion V.; Lee, S.-U.; Kawazoe, Yoshiyuki
2009-03-01
Molecular devices are potential candidates for the next step towards nanoelectronic technology. Our group has covered a wide range of nanoscale wires, which have potential application in molecular electronics using first-principles calculations and nonequilibrium Green's function formalism [1]. Our target materials are supramolecular enamel wires (covered wires) [2], connection between organic molecules and metal electrodes, self-assembled nanowires on silicon surface [3], porphyrin [4], phthalocyanine, metallocene [5], fused-ring thiophene molecules, length dependence of conductance in alkanedithiols and so on. Namely, we have investigated a relationship of the energy levels of delocalized frontier orbitals (HOMO and LUMO) and Fermi level of metal electrodes and estimate the electronic transport properties through atomic and molecular wires using Green's function approach. References [1] http://www-lab.imr.edu/˜mizuseki/nanowire.html [2] R. V. Belosludov, A. A. Farajian, H. Baba, H. Mizuseki, and Y. Kawazoe, Jpn. J. Appl. Phys., 44, 2823 (2005). [3] R. V. Belosludov, A. A. Farajian, H. Mizuseki, K. Miki, and Y. Kawazoe, Phys. Rev. B, 75, 113411 (2007). [4] S.-U. Lee, R. V. Belosludov, H. Mizuseki, and Y. Kawazoe, Small 4 (2008) 962. [5] S.-U Lee, R. V. Belosludov, H. Mizuseki, and Y. Kawazoe, J. Phys. Chem. C. 111 (2007) 15397.
Magnetic and transport properties of PrRhSi3.
Anand, V K; Adroja, D T; Hillier, A D
2013-05-15
We have investigated the magnetic and transport properties of a noncentrosymmetric compound PrRhSi3 by dc magnetic susceptibility χ(T), isothermal magnetization M(H), thermoremanent magnetization M(t), specific heat Cp(T), electrical resistivity ρ(T,H) and muon spin relaxation (μSR) measurements. At low fields χ(T) shows two anomalies near 15 and 7 K with an irreversibility between ZFC and FC data below 15 K. In contrast, no anomaly is observed in Cp(T) or ρ(T) data. M(H) data at 2 K exhibit very sharp increase below 0.5 T and a weak hysteresis. M(t) exhibits very slow relaxation, typical for a spin-glass system. Even though the absence of any anomaly in Cp(T) is consistent with the spin-glass type behavior, there is no obvious origin of spin-glass behavior in this structurally well ordered compound. The crystal electric field (CEF) analysis of Cp(T) data indicates a CEF-split singlet ground state lying below a doublet at 81(1) K and a quasi-triplet at 152(2) K. The ρ(T) data indicate a metallic behavior, and ρ(H) exhibits a very high positive magnetoresistance, as high as ~300% in 9 T at 2 K. No long range magnetic order or spin-glass behavior was detected in a μSR experiment down to 1.2 K. PMID:23604428
Experimental investigation of electron transport properties of gallium nitride nanowires
NASA Astrophysics Data System (ADS)
Motayed, Abhishek; Davydov, Albert V.; Mohammad, S. N.; Melngailis, John
2008-07-01
We report transport properties of gallium nitride (GaN) nanowires grown using direct reaction of ammonia and gallium vapor. Reliable devices, such as four-terminal resistivity measuring structures and field-effect transistors, were realized by dielectrophoretically aligning the nanowires on an oxidized silicon substrate and subsequently applying standard microfabrication techniques. Room-temperature resistivity in the range of (1.0-6.2)×10-2 Ω cm was obtained for the nanowires with diameters ranging from 200 to 90 nm. Temperature-dependent resistivity and mobility measurements indicated the possible sources for the n-type conductivity and high background charge carrier concentration in these nanowires. Specific contact resistance in the range of 5.0×10-5 Ω cm2 was extracted for Ti/Al/Ti/Au metal contacts to GaN nanowires. Significant reduction in the activation energy of the dopants at low temperatures (<200 K) was observed in the temperature-dependent resistivity measurement of these nanowires, which is linked to the onset of degeneracy. Temperature-dependent field-effect mobility measurements indicated that the ionized impurity scattering is the dominant mechanism in these nanowires at all temperatures.
Directional wetting in anisotropic inverse opals.
Phillips, Katherine R; Vogel, Nicolas; Burgess, Ian B; Perry, Carole C; Aizenberg, Joanna
2014-07-01
Porous materials display interesting transport phenomena due to restricted motion of fluids within the nano- to microscale voids. Here, we investigate how liquid wetting in highly ordered inverse opals is affected by anisotropy in pore geometry. We compare samples with different degrees of pore asphericity and find different wetting patterns depending on the pore shape. Highly anisotropic structures are infiltrated more easily than their isotropic counterparts. Further, the wetting of anisotropic inverse opals is directional, with liquids filling from the side more easily. This effect is supported by percolation simulations as well as direct observations of wetting using time-resolved optical microscopy. PMID:24941308
NASA Astrophysics Data System (ADS)
Sahoo, Pranati
Increasing energy demands and decreasing natural energy resources have sparked search for alternative clean and renewable energy sources. For instance, currently there is a tremendous interest in thermoelectric and photovoltaic solar energy production technologies. Half-Heusler (HH) alloys are among the most popular material systems presently under widespread investigations for high temperature thermoelectric energy conversion. Approaches to increase the thermoelectric figure of merit (ZT) of HH range from (1) chemical substitution of atoms with different masses within the same atomic position in the crystal structure to optimize carrier concentration and enhance phonon scattering via mass fluctuation and (2) embedding secondary phonon scattering centers in the matrix (nanostructuring) to further reduce thermal conductivity. This work focuses on three material systems. The first part describes the synthesis and properties (thermal conductivity, electrical conductivity, magnetic) of various oxide nanostructures (NiO, Co3O4) which were subsequently used as inclusion phases in a HH matrix to reduce the thermal conductivity. Detailed reviews of the past efforts along with the current effort to optimize synthetic routes are presented. The effects of the synthesis conditions on the thermoelectric properties of compacted pellets of NiO and Co3O4 are also discussed. The second part of the work discusses the development of synthetic strategies for the fabrication of p-type and n-type bulk nanostructured thermoelectric materials made of a half-Heusler matrix based on (Ti,Hf)CoSb, containing nanostructures with full-Heusler (FH) compositions and structures coherently embedded inside the half-Heusler matrix. The role of the nanostructures in the regulation of phonon and charge carrier transports within the half-heusler matrix is extensively discussed by combining transport data and electron microscopy images. It was found that the FH nanoinclusions form staggered
On uniqueness and non-degeneracy of anisotropic polarons
NASA Astrophysics Data System (ADS)
Ricaud, Julien
2016-05-01
We study the anisotropic Choquard-Pekar equation which describes a polaron in an anisotropic medium. We prove the uniqueness and non-degeneracy of minimizers in a weakly anisotropic medium. In addition, for a wide range of anisotropic media, we derive the symmetry properties of minimizers and prove that the kernel of the associated linearized operator is reduced, apart from three functions coming from the translation invariance, to the kernel on the subspace of functions that are even in each of the three principal directions of the medium.
Understanding electronic structure and transport properties in nanoscale junctions
NASA Astrophysics Data System (ADS)
Dhungana, Kamal B.
Understanding the electronic structure and the transport properties of nanoscale materials are pivotal for designing future nano-scale electronic devices. Nanoscale materials could be individual or groups of molecules, nanotubes, semiconducting quantum dots, and biomolecules. Among these several alternatives, organic molecules are very promising and the field of molecular electronics has progressed significantly over the past few decades. Despite these progresses, it has not yet been possible to achieve atomic level control at the metal-molecule interface during a conductance measurement, which hinders the progress in this field. The lack of atomic level information of the interface also makes it much harder for theorist to interpret the experimental results. To identify the junction configuration that possibly exists during the experimental measurement of conductance in molecular junction, we created an ensemble of Ruthanium-bis(terpyridine) molecular devices, and studied the transport behavior in these molecular junctions. This helps us identifying the junction geometry that yields the experimentally measured current-voltage characteristics. Today's electronic devices mostly ignore the spin effect of an electron. The inclusion of spin effect of an electron on solid-state transistor allows us to build more efficient electronic devices; this also alleviates the problem of huge heat dissipation in the nanoscale electronic devices. Different materials have been utilized to build three terminals spin transistor since its inception in 1950. In search of suitable candidates for the molecular spin transistor, we have recently designed a spin-valve transistor based on an organometallic molecule; a large amplification (320 %) in tunnel magneto-resistance (TMR) is found to occur at an experimentally accessible gate field. This suggests that the organic molecules can be utilized for making the next generation three terminal spintronic devices. Similarly, we have designed a
NASA Astrophysics Data System (ADS)
Li, P.; Xie, J.; Cheng, J.; Wu, K. K.
2014-07-01
Micro-characterized variables are proposed to precisely characterize a micro-V-grooved Si surface through the 3D measured topography rather than the designed one. In this study, level and gradient micro-grooved surfaces with depth of 25-80 µm were precisely and smoothly fabricated using a new micro-grinding process rather than laser machining and chemical etching. The objective is to investigate how these accurate micro-characterized variables systematically influence anisotropic wetting and droplet self-movement on such regular micro-structured surfaces without surface chemical modification. First, the anisotropic wetting, droplet sliding, pinning effect and droplet impact were experimentally investigated; then, theoretical anisotropic wetting models were constructed to predict and design the anisotropic wetting. The experiments show that the level micro-V-grooved surface produces the anisotropic wetting and pinning effects. It not only approximates superhydrophobicity but also produces high surface free energy. Moreover, the gradient micro-V-grooved surface with large pitch may lead to much easier droplet sliding than the level one along the micro-groove. The droplet self-movement trend increases with increasing the micro-groove gradient and micro-V-groove ratio. The micro-groove pitch and depth also influence the droplet impact. Theoretical analyses show that the wetting anisotropy and the droplet anisotropy both reach their largest value and disappear for a sharp micro-groove top when the micro-V-groove ratio is equal to 0.70 and 2.58, respectively, which may change the wetting between the composite state and the non-composite state. It is confirmed that the wetting behavior may be designed and predicted by the accurate micro-characterized variables of a regular micro-structured surface.
NASA Technical Reports Server (NTRS)
Thompson, R. A.
1994-01-01
Accurate numerical prediction of high-temperature, chemically reacting flowfields requires a knowledge of the physical properties and reaction kinetics for the species involved in the reacting gas mixture. Assuming an 11-species air model at temperatures below 30,000 degrees Kelvin, SPECIES (Computer Codes for the Evaluation of Thermodynamic Properties, Transport Properties, and Equilibrium Constants of an 11-Species Air Model) computes values for the species thermodynamic and transport properties, diffusion coefficients and collision cross sections for any combination of the eleven species, and reaction rates for the twenty reactions normally occurring. The species represented in the model are diatomic nitrogen, diatomic oxygen, atomic nitrogen, atomic oxygen, nitric oxide, ionized nitric oxide, the free electron, ionized atomic nitrogen, ionized atomic oxygen, ionized diatomic nitrogen, and ionized diatomic oxygen. Sixteen subroutines compute the following properties for both a single species, interaction pair, or reaction, and an array of all species, pairs, or reactions: species specific heat and static enthalpy, species viscosity, species frozen thermal conductivity, diffusion coefficient, collision cross section (OMEGA 1,1), collision cross section (OMEGA 2,2), collision cross section ratio, and equilibrium constant. The program uses least squares polynomial curve-fits of the most accurate data believed available to provide the requested values more quickly than is possible with table look-up methods. The subroutines for computing transport coefficients and collision cross sections use additional code to correct for any electron pressure when working with ionic species. SPECIES was developed on a SUN 3/280 computer running the SunOS 3.5 operating system. It is written in standard FORTRAN 77 for use on any machine, and requires roughly 92K memory. The standard distribution medium for SPECIES is a 5.25 inch 360K MS-DOS format diskette. The contents of the
NASA Astrophysics Data System (ADS)
Reshak, A. H.; Khan, Saleem Ayaz
2014-03-01
First principle calculation was performed for the electronic structure, electronic charge density, Fermi surface, optical and thermoelectric properties of Ba2Tl2CuO6 compound. From the electronic band structure the two overlapping bands and the density of state at Fermi level (29.2 states/Ryd-cell) confirms the superconducting behavior. Colors of the Fermi surface elucidate speed of electrons and strength of the superconductivity as well. The bonding nature was investigated using the calculated charge density contour plot, it shows mixed ionic-covalent nature of Cu3O and Tl3O while Ba3O shows dominant ionic nature with small covalency. The optical properties were calculated and discussed in details. The calculated uniaxial anisotropy value (0.7913) clarifies a considerable anisotropy between two dominant tensor components of dielectric function. Moreover the evaluation of Seebeck coefficient and thermal conductivity conform that the compound is much suitable for thermoelectric applications.
Avalanche properties in a transport model based on critical-gradient fluctuation dynamics
Garcia, L.; Carreras, B.A.
2005-09-15
A simple one-dimensional transport model based on critical-gradient fluctuation dynamics is applied to describe some of the properties of plasma-turbulence-induced transport. This model combines avalanche-like transport with diffusion. The particle flux is self-regulated by the stability properties of the fluctuations. A high-gradient edge region emerges where transport dynamics is close to marginal stability. In steady state, the core remains at the subcritical gradient. The avalanches change from quasiperiodic events triggered mostly near the edge region to intermittent transport events depending on the noise level of the particle source.
NASA Technical Reports Server (NTRS)
Gordon, S.; Mcbride, B.; Zeleznik, F. J.
1984-01-01
An addition to the computer program of NASA SP-273 is given that permits transport property calculations for the gaseous phase. Approximate mixture formulas are used to obtain viscosity and frozen thermal conductivity. Reaction thermal conductivity is obtained by the same method as in NASA TN D-7056. Transport properties for 154 gaseous species were selected for use with the program.
The synthesis and transport properties of the complex salt /TMPD/ /TCNQ/2
NASA Technical Reports Server (NTRS)
Somoano, R.; Hadek, V.; Yen, S. P. S.; Rembaum, A.; Deck, R.
1975-01-01
The syntheses and transport properties of the complex salt /TMPD/ /TCNQ/2 are described. At high temperatures, the complex is a magnetic semiconductor with transport properties intermediate between those found in the highly conducting and poorly conducting TCNQ salts. The complex undergoes a transition below 50-60 K to a state exhibiting singlet-triplet behavior with weakly alternating exchange coupling.
Correlating Transport Behavior with Cell Properties for Eight Porcine Escherichia coli Isolates
Technology Transfer Automated Retrieval System (TEKTRAN)
In this study we investigate how growth stage and depositional environment affect variability of cell properties and transport behavior of eight porcine E. coli isolates. We compared the surface properties and transport behavior for cells harvested at two different growth stages (exponential and sta...
Remarks on inhomogeneous anisotropic cosmology
NASA Astrophysics Data System (ADS)
Kaya, Ali
2016-08-01
Recently a new no-global-recollapse argument was given for some inhomogeneous and anisotropic cosmologies that utilizes surface deformation by the mean curvature flow. In this paper we discuss important properties of the mean curvature flow of spacelike surfaces in Lorentzian manifolds. We show that singularities may form during cosmic evolution, and the theorems forbidding the global recollapse lose their validity. The time evolution of the spatial scalar curvature that may kinematically prevent the recollapse is determined in normal coordinates, which shows the impact of inhomogeneities explicitly. Our analysis indicates a caveat in numerical solutions that give rise to inflation.
Evaluation of Baltic Sea transport properties using particle tracking
NASA Astrophysics Data System (ADS)
Dargahi, Bijan; Cvetkovic, Vladimir
2014-05-01
Particle tracking model (PTM) is an effective tool for quantifying transport properties of large water bodies such as the Baltic Sea. We have applied PTM to our fully calibrated and validated Baltic Sea 3D hydrodynamic model for a 10-years period (2000-9). One hundred particles were released at a constant rate during an initial 10-days period from all the Baltic Sea sub-basins, the major rivers, and the open boundary in the Arkona Basin. In each basin, the particles were released at two different depths corresponding to the deep water and middle water layers. The objectives of the PTM simulations were to analyse the intra-exchange processes between the Baltic Sea basins and to estimate the arrival times and the paths of particles released from the rivers. The novel contribution of this study is determining the paths and arrival times of deeper water masses rather than the surface masses. Advective and diffusive transport processes in the Bornholm and Arkona basins are both driven by the interacting flows of the northern basins of the Baltic Sea and the North Sea. Particles released from Arkona basin flows northwards along the Stople Channel. The Gotland basins are the major contributors to the exchange process in the Baltic Sea. We find high values of the advection ratio, indicative of a forced advective transport process. The Bay of Gdansk is probably the most vulnerable region in the Baltic Sea. This is despite the fact that the main exchanging basins are the Bornholm Sea and the Easter Gotland Basin. The main reason is the intensive supply of the particles from the northern basins that normally take about 3000 days to reach the Bay of Gdansk. The process maintains a high level of particle concentration (90%) along its coastlines even after the 10-years period. Comparing the particle paths in the Western and Eastern Gotland basins two interesting features were found. Particles travelled in all four directions in the former basin and the middle layer particles
Magnetization and transport properties of single RPd2P2 (R=Y, La-Nd, Sm-Ho, Yb)
NASA Astrophysics Data System (ADS)
Drachuck, Gil; Boehmer, Anna; Bud'Ko, Sergey L.; Canfield, Paul
Single crystals of RPd2P2 (R=Y, La-Nd, Sm-Ho, Yb) were grown using a self-flux method and were characterized by room-temperature powder X-ray diffraction, anisotropic temperature and field dependent magnetization and temperature dependent in-plane resistivity. Anisotropic magnetic properties, arising mostly from crystal electric field (CEF) effects, were observed for most magnetic rare earths. The experimentally estimated CEF parameters B02 were calculated from the anisotropic paramagnetic θab and θcvalues. Ordering temperatures, as well as the polycrystalline averaged paramagnetic Curie-Weiss temperature, θave, were extracted from magnetization and resistivity measurements. Work done at Ames Laboratory was supported by US Department of Energy, Basic Energy Sciences, Division of Materials Sciences and Engineering under Contract No. DE-AC02-07CH111358.
Decoupling Mechanical and Ion Transport Properties in Polymer Electrolyte Membranes
NASA Astrophysics Data System (ADS)
McIntosh, Lucas D.
Polymer electrolytes are mixtures of a polar polymer and salt, in which the polymer replaces small molecule solvents and provides a dielectric medium so that ions can dissociate and migrate under the influence of an external electric field. Beginning in the 1970s, research in polymer electrolytes has been primarily motivated by their promise to advance electrochemical energy storage and conversion devices, such as lithium ion batteries, flexible organic solar cells, and anhydrous fuel cells. In particular, polymer electrolyte membranes (PEMs) can improve both safety and energy density by eliminating small molecule, volatile solvents and enabling an all-solid-state design of electrochemical cells. The outstanding challenge in the field of polymer electrolytes is to maximize ionic conductivity while simultaneously addressing orthogonal mechanical properties, such as modulus, fracture toughness, or high temperature creep resistance. The crux of the challenge is that flexible, polar polymers best-suited for polymer electrolytes (e.g., poly(ethylene oxide)) offer little in the way of mechanical robustness. Similarly, polymers typically associated with superior mechanical performance (e.g., poly(methyl methacrylate)) slow ion transport due to their glassy polymer matrix. The design strategy is therefore to employ structured electrolytes that exhibit distinct conducting and mechanically robust phases on length scales of tens of nanometers. This thesis reports a remarkably simple, yet versatile synthetic strategy---termed polymerization-induced phase separation, or PIPS---to prepare PEMs exhibiting an unprecedented combination of both high conductivity and high modulus. This performance is enabled by co-continuous, isotropic networks of poly(ethylene oxide)/ionic liquid and highly crosslinked polystyrene. A suite of in situ, time-resolved experiments were performed to investigate the mechanism by which this network morphology forms, and it appears to be tied to the
Single and Few Layer Silicene: Structural, Electronic and Transport Properties
NASA Astrophysics Data System (ADS)
Carey, J. David; Roome, Nathanael
Single layer silicene has weaker π bonding that graphene resulting in buckling of the Si atoms in different sub-lattices. Despite the loss of planarity, a linear bandstructure emerges where we find a Fermi velocity of about 5.3 x 105 m/s. Determination of the phonon dispersion characteristics reveals a Γ point optical phonon with an energy of 69 meV and a K point optical phonon with an energy of 62 meV. In graphene these phonons play important role in scattering electrons, and in Raman spectroscopy, but have larger energies of 194 and 166 meV, respectively. The lower phonon energies in silicene, arising from the higher atomic masses, would be expected to scatter carriers efficiently and limit carrier mobility. We have calculated, however, that the electron-optical phonon coupling matrix elements are about a factor of 25 times smaller than in graphene and this important result will help with the further development of silicene based devices due to reduced phonon scattering. The two stable stacking configurations of bilayer silicene, AA and AB, now have to account of the position of the atomic buckling in the two layers, leading to four possible atomic configurations with the buckling between the layers being in- or out-of-phase with each other. We find that in contrast to graphene, the two stable configurations are based on AA type stacking being about 70 meV per atom more stable than AB stacking. The potential for elemental layered materials beyond graphene for device applications will also be discussed. Single and Few Layer Silicene: Structural, Electronic and Transport Properties.
Fabrication transport properties of QMG current limiting elements
NASA Astrophysics Data System (ADS)
Morita, Mitsuru; Hirano, H.; Hayashi, H.; Terazono, K.; Kajikawa, K.; Funaki, K.; Hamajima, T.
2004-10-01
A high durability design for QMG current limiting elements was developed by reinforcement using metal bypasses. Metal bypasses with high specific resistivity were bonded to both surfaces of QMG bulk superconductor using solder. I-shaped short QMG current limiting elements with cross-sections of 2.2 × 0.8 mm and an effective length of 20 mm were reinforced by I-shaped NiCr or SUS bypasses. Meander-shaped QMG with cross-sections of 2.2 × 0.8 mm and an effective length of 180 mm was reinforced by meander-shaped NiCr bypasses. These elements were molded by resin and GFRP. The external bypass was jointed to the element in parallel electrically. The current limiting elements have a current capacity of 1 kA class in 77 K. In order to measure transport properties in fault conditions, a half cycle of sinusoidal current up to about 4 kA was applied to the elements. I-shaped short samples with 0.5 mm thick NiCr showed an endurance voltage of 13 V(electric field strength of 6.5 V/cm) without damage, when the peak value of applied current was 4.2 kA. For the meander-shaped samples, endurance voltage of 92 V was observed through one element, when the peak value of applied current was 4.0 kA. This voltage is about four times higher than that tolerated by conventional meander-shaped elements that have no NiCr bypass reinforcement. In the case of metal bypassing both sides of a superconductor in fault conditions, fault current flows through the metal bypasses. Then, both the superconductor and metal bypass expand by Joule heating. Therefore, the mechanical stress on a superconductor is reduced relative to the presence of metal bypasses. It is considered that metal bypasses lead to high durability against thermal shock.
Gray, K.E.; Hettinger, J.D.; Kim, D.H.
1994-06-01
The effect of interlayer coupling on the transport properties and dissipation in a magnetic field is reviewed for superconducting multilayers including highly-anisotropic high-temperature superconductors (HTS). For the applied field parallel to the superconducting layers the absence of any Lorentz-force dependence of the dissipation leads to an explanation other than flux motion. This is consistent with a Josephson junction dissipation which dominates flux motion of the insulating regions between layers. However, in is seen to cross over from phase slips at Josephson junctions to depinning of vortices from the external field at high fields and temperatures. For fields perpendicular to the superconducting layers the much greater resistive broadening in HTS is due to dissipation by thermally-activated flux motion, consistent with a lack of intrinsic pinning. We show experimental evidence that the associated flux motion occurs as a result of a crossover from three dimensional (3D) vortex lines to 2D independent pancake-like vortices, residing in the Cu-O layers. This 3D to 2D crossover occurs after k{sub B}T exceeds the Josephson coupling energy.
NASA Astrophysics Data System (ADS)
Zhang, W.-L.; Yin, Z. P.; Ignatov, A.; Bukowski, Z.; Karpinski, Janusz; Sefat, Athena S.; Ding, H.; Richard, P.; Blumberg, G.
2016-05-01
We present a polarization-resolved and temperature-dependent Raman scattering study of A Fe2As2 (A =Ca , Eu). In the spin-density-wave phase, spectral weight redistribution is observed in the fully symmetric and nonsymmetric scattering channels at different energies. An anisotropic Raman response is observed in the fully symmetric channel in spontaneously detwinned CaFe2As2 samples. We calculate the orbital-resolved electronic structures using a combination of density functional theory and dynamical mean field theory. We identify the electronic transitions corresponding to these two spectral features and find that the anisotropic Raman response originates from the lifted degeneracy of the dx z /y z orbitals in the broken-symmetry phase.
NASA Technical Reports Server (NTRS)
Hansen, C Frederick; Heims, Steve P
1958-01-01
Thermodynamic and transport properties of high temperature air, and the reaction rates for the important chemical processes which occur in air, are reviewed. Semiempirical, analytic expressions are presented for thermodynamic and transport properties of air. Examples are given illustrating the use of these properties to evaluate (1) equilibrium conditions following shock waves, (2) stagnation region heat flux to a blunt high-speed body, and (3) some chemical relaxation lengths in stagnation region flow.
Structural Properties of the Brazilian Air Transportation Network.
Couto, Guilherme S; da Silva, Ana Paula Couto; Ruiz, Linnyer B; Benevenuto, Fabrício
2015-09-01
The air transportation network in a country has a great impact on the local, national and global economy. In this paper, we analyze the air transportation network in Brazil with complex network features to better understand its characteristics. In our analysis, we built networks composed either by national or by international flights. We also consider the network when both types of flights are put together. Interesting conclusions emerge from our analysis. For instance, Viracopos Airport (Campinas City) is the most central and connected airport on the national flights network. Any operational problem in this airport separates the Brazilian national network into six distinct subnetworks. Moreover, the Brazilian air transportation network exhibits small world characteristics and national connections network follows a power law distribution. Therefore, our analysis sheds light on the current Brazilian air transportation infrastructure, bringing a novel understanding that may help face the recent fast growth in the usage of the Brazilian transport network. PMID:26312421
Highly Anisotropic, Highly Transparent Wood Composites.
Zhu, Mingwei; Song, Jianwei; Li, Tian; Gong, Amy; Wang, Yanbin; Dai, Jiaqi; Yao, Yonggang; Luo, Wei; Henderson, Doug; Hu, Liangbing
2016-07-01
For the first time, two types of highly anisotropic, highly transparent wood composites are demonstrated by taking advantage of the macro-structures in original wood. These wood composites are highly transparent with a total transmittance up to 90% but exhibit dramatically different optical and mechanical properties. PMID:27147136
Oscillatory Behavior in the Transport Properties of Transition Metal Superlattices
NASA Astrophysics Data System (ADS)
Kim, Sihong
Oscillations in the low temperature electrical resistivity, as a function of the individual layer thickness and/or superlattice period, have been recently observed in Co/Ni superlattices. This was believed to be a superlattice effect because the oscillations disappeared with decreasing number of bilayers. In this thesis, systematic studies have been made to understand the origin of this unusual behavior in the electrical transport of Co/Ni superlattices. First, Co/Ni was investigated extensively because Co and Ni have very similar material properties. They are both ferromagnetic, have fcc lattices in thin film form, and have almost identical electronic band structure. Superlattice films were grown by molecular beam epitaxy (MBE) and these structure was characterized by reflection high energy electron diffraction (RHEED), low energy electron diffraction (LEED), Auger electron spectroscopy (AES), and X-ray diffraction (XRD). The measured residual resistivity, usually caused by impurity atoms, lattice defects, interfaces, or grain boundaries, is very small in Co/Ni superlattice films. Due to this small background resistivity, unusual intrinsic resistivity oscillations have been clearly observed in these films. The oscillation amplitude does not change with temperature. However, a small amount of random fluctuation in the superlattice period, artificially introduced during film growth, significantly increases the oscillation amplitude. The resistivity at a minimum rm( rho_{min}) and maximum rm(rho_{max}) of oscillations was also measured as a function of film thickness in order to study the evolution of this effect. rho_{min} increases monotonically with decreasing thickness due to surface scattering, which is well described by the quantum size effect theory. However, rho_{max} becomes nonmonotonic by proper choice of superlattice period, indicating the presence of an additional scattering mechanism associated with the superlattice structure. Similar resistivity
Transport and optical properties of low-dimensional complex systems
NASA Astrophysics Data System (ADS)
Iurov, Andrii
Over the last five years of my research work, I, my research was mainly concerned with certain crucial tunneling, transport and optical properties of novel low-dimensional graphitic and carbon-based materials as well as topological insulators. Both single-electron and many-body problems were addressed. We investigated the Dirac electrons transmission through a potential barrier in the presence of circularly polarized light. An anomalous photon-assisted enhanced transmission is predicted and explained in a comparison with the well-known Klein paradox. It is demonstrated that the perfect transmission for nearly-head-on collision in an infinite graphene is suppressed in gapped dressed states of electrons, which is further accompanied by shift of peaks as a function of the incident angle away from the head-on collision. We calculate the energy bands for graphene monolayers when electrons move through a periodic electrostatic potential in the presence of a uniform perpendicular magnetic field. We clearly demonstrate the quantum fractal nature of the energy bands at reasonably low magnetic fields. We present results for the energy bands as functions of both wave number and magnetic flux through the unit cells of the resulting moiŕe superlattice. This feature is also observed at extremely high magnetic fields. We have discovered a novel feature in the plasmon excitations for a pair of Coulomb-coupled non-concentric spherical two-dimensional electron gases (S2DEGs). Our results show that the plasmon excitations for such pairs depend on the orientation with respect to the external electromagnetic probe field. The origin of this anisotropy of the inter-sphere Coulomb interaction is due to the directional asymmetry of the electrostatic coupling of electrons in excited states which depend on both the angular momentum quantum number L and its projection M on the axis of quantization taken as the probe E-field direction. Such an effect from the plasmon spatial correlation is
Thermodynamic and transport properties of air/water mixtures
NASA Technical Reports Server (NTRS)
Fessler, T. E.
1981-01-01
Subroutine WETAIR calculates properties at nearly 1,500 K and 4,500 atmospheres. Necessary inputs are assigned values of combinations of density, pressure, temperature, and entropy. Interpolation of property tables obtains dry air and water (steam) properties, and simple mixing laws calculate properties of air/water mixture. WETAIR is used to test gas turbine engines and components operating in relatively humid air. Program is written in SFTRAN and FORTRAN.
EquilTheTA: Thermodynamic and transport properties of complex equilibrium plasmas
Colonna, G.; D'Angola, A.
2012-11-27
EquilTheTA (EQUILibrium for plasma THErmodynamics and Transport Applications) is a web-based software which calculates chemical equilibrium product concentrations from any set of reactants and determines thermodynamic and transport properties for the product mixture in wide temperature and pressure ranges. The program calculates chemical equilibrium by using a hierarchical approach, thermodynamic properties and transport coefficients starting from recent and accurate databases of atomic and molecular energy levels and collision integrals. In the calculations, Debye length and cut-off are consistently updated and virial corrections (up to third order) can be considered. Transport coefficients are calculated by using high order approximations of the Chapman-Enskog method.
Quasiparticle band structures and thermoelectric transport properties of p-type SnSe
Shi, Guangsha; Kioupakis, Emmanouil
2015-02-14
We used density functional and many-body perturbation theory to calculate the quasiparticle band structures and electronic transport parameters of p-type SnSe both for the low-temperature Pnma and high-temperature Cmcm phases. The Pnma phase has an indirect band gap of 0.829 eV, while the Cmcm has a direct band gap of 0.464 eV. Both phases exhibit multiple local band extrema within an energy range comparable to the thermal energy of carriers from the global extrema. We calculated the electronic transport coefficients as a function of doping concentration and temperature for single-crystal and polycrystalline materials to understand the previous experimental measurements. The electronic transport coefficients are highly anisotropic and are strongly affected by bipolar transport effects at high temperature. Our results indicate that SnSe exhibits optimal thermoelectric performance at high temperature when doped in the 10{sup 19}–10{sup 20 }cm{sup −3} range.
[Transport properties of disordered porous media from the microstructure
Not Available
1993-01-01
Progress was made in 4 general areas: quantitative characterization of microstructure via n-point distribution functions; determination of bounds on effective properties that depend on these n-point functions (conductivity, NMR, permeability); derivation of cross- property relations; and development of efficient first-passage time algorithms (Brownian-motion simulations) to compute effective diffusion properties.
Equations of state and transport properties of mixtures in the warm dense regime
Hou, Yong; Dai, Jiayu; Kang, Dongdong; Ma, Wen; Yuan, Jianmin
2015-02-15
We have performed average-atom molecular dynamics to simulate the CH and LiH mixtures in the warm dense regime, and obtained equations of state and the ionic transport properties. The electronic structures are calculated by using the modified average-atom model, which have included the broadening of energy levels, and the ion-ion pair potentials of mixtures are constructed based on the temperature-dependent density functional theory. The ionic transport properties, such as ionic diffusion and shear viscosity, are obtained through the ionic velocity correlation functions. The equations of state and transport properties for carbon, hydrogen and lithium, hydrogen mixtures in a wide region of density and temperature are calculated. Through our computing the average ionization degree, average ion-sphere diameter and transition properties in the mixture, it is shown that transport properties depend not only on the ionic mass but also on the average ionization degree.
Gravitational stresses in anisotropic rock masses
Amadei, B.; Savage, W.Z.; Swolfs, H.S.
1987-01-01
This paper presents closed-form solutions for the stress field induced by gravity in anisotropic rock masses. These rocks are assumed to be laterally restrained and are modelled as a homogeneous, orthotropic or transversely isotropic, linearly elastic material. The analysis, constrained by the thermodynamic requirement that strain energy be positive definite, gives the following important result: inclusion of anisotropy broadens the range of permissible values of gravity-induced horizontal stresses. In fact, for some ranges of anisotropic rock properties, it is thermodynamically admissible for gravity-induced horizontal stresses to exceed the vertical stress component; this is not possible for the classical isotropic solution. Specific examples are presented to explore the nature of the gravity-induced stress field in anisotropic rocks and its dependence on the type, degree and orientation of anisotropy with respect to the horizontal ground surface. ?? 1987.
NASA Technical Reports Server (NTRS)
Svehla, R. A.; Mcbride, B. J.
1973-01-01
Program performs calculations such as chemical equilibrium for assigned thermodynamic states, theoretical rocket performance for both equilibrium and frozen compositions during expansion, incident and reflected shock properties, and Chapman-Jouget detonation properties. Features include simplicity of input and storage of all thermodynamic and transport property data on master tape.
Matter sourced anisotropic stress for dark energy
NASA Astrophysics Data System (ADS)
Chang, Baorong; Lu, Jianbo; Xu, Lixin
2014-11-01
Usually a dark energy as a perfect fluid is characterized by the ratio of pressure to energy density (w =p /ρ ) and the ratio of their perturbations in its rest frame (cs2=δ p /δ ρ ). However, a dark energy would have other characteristics beyond its equation of state and the effective speed of sound. Here the extra property is the anisotropic stress sourced by matter as a simple extension to the perfect fluid model. At the background level, this anisotropic stress is zero with respect to the cosmological principle, but not at the first-order perturbation. We tested the viability of the existence of this kind of anisotropic stress by using the currently available cosmic observations through the geometrical and dynamical measurements. Using the Markov-chain Monte Carlo method, we found that the upper bounds on the anisotropic stress which enters into the summation of the Newtonian potentials should be of the order O (1 0-3)Δm . We did not find any strong evidence for the existence of this matter-sourced anisotropic stress, even in the 1 σ region.
Electrolytes: transport properties and non-equilibrium thermodynamics
Miller, D.G.
1980-12-01
This paper presents a review on the application of non-equilibrium thermodynamics to transport in electrolyte solutions, and some recent experimental work and results for mutual diffusion in electrolyte solutions.
Anisotropic permeabilities evolution of reservoir rocks under pressure
NASA Astrophysics Data System (ADS)
Jeremie, D.; Nicolas, G.; Alexandre, D.; Olga, V.
2006-12-01
The aim of our study is to measure, to model and to forecast the evolutions of porosity and permeability under anisotropic stresses representative of hydrocarbon reservoir conditions. Reservoir field exploitation induces a decrease of the pore pressure, hence modifying the effective stress-state at the reservoir scale. To optimize production and recovery rates of the reservoir it is of fundamental interest to understand all the physical and mechanical evolutions of the host-rock and their influence on transport properties. In the case of weakly consolidated reservoirs the variations of stresses are modest, yet they can induce significant porosity and permeability changes due to their high compressibility. In the case of deeply buried and consolidated reservoirs the stress variations might be pronounced enough to influence flow properties as well. Because of reservoir boundaries conditions, the fluid pressure drop influences essentially the vertical stress. The recovery rate is a function of horizontal permeability. In order to understand how the anisotropic stress-states induced during production may influence the transport properties experiments must be designed to measure simultaneously both horizontal and vertical permeabilities under deviatoric stresses. For this purpose we developed a specific triaxial cell operating in conditions representative of the field conditions. Preliminary results obtained with low permeability sandstones allowed a coupled observation of deformation and directional permeability evolution. Because of complex geometrical conditions the results required numerical interpretations. A finite-element inversion of our data allowed the determination of the complete permeability tensor. In addition the study aims on the identification of the microphysical mechanics that induce the pore scale microstructural evolution, which is ultimately responsible of the permeability decrease. For this purpose we used synthetic hot-pressed calcite
NASA Astrophysics Data System (ADS)
Zhou, Jiawei; Liao, Bolin; Chen, Gang
2016-04-01
The transport properties of semiconductors are key to the performance of many solid-state devices (transistors, data storage, thermoelectric cooling and power generation devices, etc). An understanding of the transport details can lead to material designs with better performances. In recent years simulation tools based on first-principles calculations have been greatly improved, being able to obtain the fundamental ground-state properties of materials (such as band structure and phonon dispersion) accurately. Accordingly, methods have been developed to calculate the transport properties based on an ab initio approach. In this review we focus on the thermal, electrical, and thermoelectric transport properties of semiconductors, which represent the basic transport characteristics of the two degrees of freedom in solids—electronic and lattice degrees of freedom. Starting from the coupled electron-phonon Boltzmann transport equations, we illustrate different scattering mechanisms that change the transport features and review the first-principles approaches that solve the transport equations. We then present the first-principles results on the thermal and electrical transport properties of semiconductors. The discussions are grouped based on different scattering mechanisms including phonon-phonon scattering, phonon scattering by equilibrium electrons, carrier scattering by equilibrium phonons, carrier scattering by polar optical phonons, scatterings due to impurities, alloying and doping, and the phonon drag effect. We show how the first-principles methods allow one to investigate transport properties with unprecedented detail and also offer new insights into the electron and phonon transport. The current status of the simulation is mentioned when appropriate and some of the future directions are also discussed.
Enhancement of non-resonant dielectric cloaks using anisotropic composites
Takezawa, Akihiro Kitamura, Mitsuru
2014-01-15
Cloaking techniques conceal objects by controlling the flow of electromagnetic waves to minimize scattering. Herein, the effectiveness of homogenized anisotropic materials in non-resonant dielectric multilayer cloaking is studied. Because existing multilayer cloaking by isotropic materials can be regarded as homogenous anisotropic cloaking from a macroscopic view, anisotropic materials can be efficiently designed through optimization of their physical properties. Anisotropic properties can be realized in two-phase composites if the physical properties of the material are within appropriate bounds. The optimized anisotropic physical properties are identified by a numerical optimization technique based on a full-wave simulation using the finite element method. The cloaking performance measured by the total scattering width is improved by about 2.8% and 25% in eight- and three-layer cylindrical cloaking materials, respectively, compared with multilayer cloaking by isotropic materials. In all cloaking examples, the optimized microstructures of the two-phase composites are identified as the simple lamination of two materials, which maximizes the anisotropy. The same performance as published for eight-layer cloaking by isotropic materials is achieved by three-layer cloaking using the anisotropic material. Cloaking with an approximately 50% reduction of total scattering width is achieved even in an octagonal object. Since the cloaking effect can be realized using just a few layers of the laminated anisotropic dielectric composite, this may have an advantage in the mass production of cloaking devices.
Enhancement of non-resonant dielectric cloaks using anisotropic composites
NASA Astrophysics Data System (ADS)
Takezawa, Akihiro; Kitamura, Mitsuru
2014-01-01
Cloaking techniques conceal objects by controlling the flow of electromagnetic waves to minimize scattering. Herein, the effectiveness of homogenized anisotropic materials in non-resonant dielectric multilayer cloaking is studied. Because existing multilayer cloaking by isotropic materials can be regarded as homogenous anisotropic cloaking from a macroscopic view, anisotropic materials can be efficiently designed through optimization of their physical properties. Anisotropic properties can be realized in two-phase composites if the physical properties of the material are within appropriate bounds. The optimized anisotropic physical properties are identified by a numerical optimization technique based on a full-wave simulation using the finite element method. The cloaking performance measured by the total scattering width is improved by about 2.8% and 25% in eight- and three-layer cylindrical cloaking materials, respectively, compared with multilayer cloaking by isotropic materials. In all cloaking examples, the optimized microstructures of the two-phase composites are identified as the simple lamination of two materials, which maximizes the anisotropy. The same performance as published for eight-layer cloaking by isotropic materials is achieved by three-layer cloaking using the anisotropic material. Cloaking with an approximately 50% reduction of total scattering width is achieved even in an octagonal object. Since the cloaking effect can be realized using just a few layers of the laminated anisotropic dielectric composite, this may have an advantage in the mass production of cloaking devices.
NASA Astrophysics Data System (ADS)
Sun, Yeran; Mburu, Lucy; Wang, Shaohua
2016-05-01
Akin to most infrastructures, intraurban bus networks are large and highly complex. Understanding the composition of such networks requires an intricate decomposition of the network into modules, taking into account the manner in which network links are distributed among the nodes. There exists for each set of highly interlinked nodes little connectivity with the next set of highly interlinked nodes. This inherent property of nodes makes community detection a popular approach for analyzing the structure of complex networks. In this study, we attempt to understand the structure of the intraurban bus network of Ireland's capital city, Dublin in a two-step approach. We first analyze the modular structure of the network by identifying potential communities. Secondly, we assess the prominence of each network node by examining the module-based topological properties of the nodes. Results of this empirical study reveal a clear pattern of independent communities, indicating thus, an implicit multi-community structure of the intraurban bus network. Examination of the geographic characteristics of the identified communities shows a degree of socio-economic divisions of the Dublin city. Furthermore, a large majority of the important nodes (vital transportation hubs) are located at the city center, implying that most of the bus lines in Dublin city tend to intersect the city's core.
Anisotropic eddy viscosity models
NASA Technical Reports Server (NTRS)
Carati, D.; Cabot, W.
1996-01-01
A general discussion on the structure of the eddy viscosity tensor in anisotropic flows is presented. The systematic use of tensor symmetries and flow symmetries is shown to reduce drastically the number of independent parameters needed to describe the rank 4 eddy viscosity tensor. The possibility of using Onsager symmetries for simplifying further the eddy viscosity is discussed explicitly for the axisymmetric geometry.
NASA Astrophysics Data System (ADS)
Gutzov, S.; Danchova, N.; Tsekov, R.; Barreno, I.; Ruiz del Portal, X.; Ulbikas, J.
2015-10-01
A new hybrid woven micromesh containing metal and polyester wires with a 2D porosity of about 30% has been created. The anisotropic microcomposite is developed as a new material with wide applications in thermal and electrical engineering. The mesh material is carefully characterized using electron microscopy, fluorescence microscopy, chemical analysis, thermal conductivity measurements and differential scanning calorimetry.
Anisotropic Ambient Volume Shading.
Ament, Marco; Dachsbacher, Carsten
2016-01-01
We present a novel method to compute anisotropic shading for direct volume rendering to improve the perception of the orientation and shape of surface-like structures. We determine the scale-aware anisotropy of a shading point by analyzing its ambient region. We sample adjacent points with similar scalar values to perform a principal component analysis by computing the eigenvectors and eigenvalues of the covariance matrix. In particular, we estimate the tangent directions, which serve as the tangent frame for anisotropic bidirectional reflectance distribution functions. Moreover, we exploit the ratio of the eigenvalues to measure the magnitude of the anisotropy at each shading point. Altogether, this allows us to model a data-driven, smooth transition from isotropic to strongly anisotropic volume shading. In this way, the shape of volumetric features can be enhanced significantly by aligning specular highlights along the principal direction of anisotropy. Our algorithm is independent of the transfer function, which allows us to compute all shading parameters once and store them with the data set. We integrated our method in a GPU-based volume renderer, which offers interactive control of the transfer function, light source positions, and viewpoint. Our results demonstrate the benefit of anisotropic shading for visualization to achieve data-driven local illumination for improved perception compared to isotropic shading. PMID:26529745
Anisotropic epitaxial ZnO/CdO core/shell heterostructure nanorods
2012-01-01
Various surface structures and polarities of one-dimensional nanostructures offer additional control in synthesizing heterostructures suitable for optoelectronic and electronic applications. In this work, we report synthesis and characterization of ZnO-CdO nanorod-based heterostructures grown on a-plane sapphire. The heterojunction formed on the sidewall surface of the nanorod shows that wurtzite ZnO {1010} planes are interfaced with rocksalt CdO {100}. This is evidently different from the heterojunction formed on the nanorod top surface, where a ZnO (0001) top plane is interfaced with a CdO (111) plane. Such anisotropic heterostructures are determined by different surface structures of the nanorods and their polarities. Revelation of such anisotropic heterojunctions will provide a clue for understanding charge transport properties in electronic and optoelectronic nanodevices. PMID:23151180
Functional properties of ion channels and transporters in tumour vascularization
Fiorio Pla, Alessandra; Munaron, Luca
2014-01-01
Vascularization is crucial for solid tumour growth and invasion, providing metabolic support and sustaining metastatic dissemination. It is now accepted that ion channels and transporters play a significant role in driving the cancer growth at all stages. They may represent novel therapeutic, diagnostic and prognostic targets for anti-cancer therapies. On the other hand, although the expression and role of ion channels and transporters in the vascular endothelium is well recognized and subject of recent reviews, only recently has their involvement in tumour vascularization been recognized. Here, we review the current literature on ion channels and transporters directly involved in the angiogenic process. Particular interest will be focused on tumour angiogenesis in vivo as well as in the different steps that drive this process in vitro, such as endothelial cell proliferation, migration, adhesion and tubulogenesis. Moreover, we compare the ‘transportome’ system of tumour vascular network with the physiological one. PMID:24493751
The spin-dependent transport properties of zigzag α-graphyne nanoribbons and new device design.
Ni, Yun; Wang, Xia; Tao, Wei; Zhu, Si-Cong; Yao, Kai-Lun
2016-01-01
By performing first-principle quantum transport calculations, we studied the electronic and transport properties of zigzag α-graphyne nanoribbons in different magnetic configurations. We designed the device based on zigzag α-graphyne nanoribbon and studied the spin-dependent transport properties, whose current-voltage curves show obvious spin-polarization and conductance plateaus. The interesting transport behaviours can be explained by the transport spectra under different magnetic configurations, which basically depends on the symmetry matching of the electrodes' bandstructures. Simultaneously, spin Seebeck effect is also found in the device. Thus, according to the transport behaviours, zigzag α-graphyne nanoribbons can be used as a dual spin filter diode, a molecule signal converter and a spin caloritronics device, which indicates that α-graphyne is a promising candidate for the future application in spintronics. PMID:27180808
The spin-dependent transport properties of zigzag α-graphyne nanoribbons and new device design
NASA Astrophysics Data System (ADS)
Ni, Yun; Wang, Xia; Tao, Wei; Zhu, Si-Cong; Yao, Kai-Lun
2016-05-01
By performing first-principle quantum transport calculations, we studied the electronic and transport properties of zigzag α-graphyne nanoribbons in different magnetic configurations. We designed the device based on zigzag α-graphyne nanoribbon and studied the spin-dependent transport properties, whose current-voltage curves show obvious spin-polarization and conductance plateaus. The interesting transport behaviours can be explained by the transport spectra under different magnetic configurations, which basically depends on the symmetry matching of the electrodes’ bandstructures. Simultaneously, spin Seebeck effect is also found in the device. Thus, according to the transport behaviours, zigzag α-graphyne nanoribbons can be used as a dual spin filter diode, a molecule signal converter and a spin caloritronics device, which indicates that α-graphyne is a promising candidate for the future application in spintronics.
The spin-dependent transport properties of zigzag α-graphyne nanoribbons and new device design
Ni, Yun; Wang, Xia; Tao, Wei; Zhu, Si-Cong; Yao, Kai-Lun
2016-01-01
By performing first-principle quantum transport calculations, we studied the electronic and transport properties of zigzag α-graphyne nanoribbons in different magnetic configurations. We designed the device based on zigzag α-graphyne nanoribbon and studied the spin-dependent transport properties, whose current-voltage curves show obvious spin-polarization and conductance plateaus. The interesting transport behaviours can be explained by the transport spectra under different magnetic configurations, which basically depends on the symmetry matching of the electrodes’ bandstructures. Simultaneously, spin Seebeck effect is also found in the device. Thus, according to the transport behaviours, zigzag α-graphyne nanoribbons can be used as a dual spin filter diode, a molecule signal converter and a spin caloritronics device, which indicates that α-graphyne is a promising candidate for the future application in spintronics. PMID:27180808
NASA Astrophysics Data System (ADS)
Guedj, C.; Hung, L.; Zobelli, A.; Blaise, P.; Sottile, F.; Olevano, V.
2014-12-01
The effect of nanocrystal orientation on the energy loss spectra of monoclinic hafnia (m-HfO2) is measured by high resolution transmission electron microscopy (HRTEM) and valence energy loss spectroscopy (VEELS) on high quality samples. For the same momentum-transfer directions, the dielectric properties are also calculated ab initio by time-dependent density-functional theory (TDDFT). Experiments and simulations evidence anisotropy in the dielectric properties of m-HfO2, most notably with the direction-dependent oscillator strength of the main bulk plasmon. The anisotropic nature of m-HfO2 may contribute to the differences among VEELS spectra reported in literature. The good agreement between the complex dielectric permittivity extracted from VEELS with nanometer spatial resolution, TDDFT modeling, and past literature demonstrates that the present HRTEM-VEELS device-oriented methodology is a possible solution to the difficult nanocharacterization challenges given in the International Technology Roadmap for Semiconductors.
Guedj, C.; Hung, L.; Sottile, F.; Zobelli, A.; Blaise, P.; Olevano, V.
2014-12-01
The effect of nanocrystal orientation on the energy loss spectra of monoclinic hafnia (m-HfO{sub 2}) is measured by high resolution transmission electron microscopy (HRTEM) and valence energy loss spectroscopy (VEELS) on high quality samples. For the same momentum-transfer directions, the dielectric properties are also calculated ab initio by time-dependent density-functional theory (TDDFT). Experiments and simulations evidence anisotropy in the dielectric properties of m-HfO{sub 2}, most notably with the direction-dependent oscillator strength of the main bulk plasmon. The anisotropic nature of m-HfO{sub 2} may contribute to the differences among VEELS spectra reported in literature. The good agreement between the complex dielectric permittivity extracted from VEELS with nanometer spatial resolution, TDDFT modeling, and past literature demonstrates that the present HRTEM-VEELS device-oriented methodology is a possible solution to the difficult nanocharacterization challenges given in the International Technology Roadmap for Semiconductors.
NASA Technical Reports Server (NTRS)
Lanyi, Janos K.
1977-01-01
Cell envelope vesicles prepared from H. halobium contain bacteriorhodopsin and upon illumination protons are ejected. Coupled to the proton motive force is the efflux of Na(+). Measurements of Na-22 flux, exterior pH change, and membrane potential, Delta(psi) (with the dye 3,3'-dipentyloxadicarbocyanine) indicate that the means of Na(+) transport is sodium/proton exchange. The kinetics of the pH changes and other evidence suggests that the antiport is electrogenic (H(+)/Na(++ greater than 1). The resulting large chemical gradient for Na(+) (outside much greater than inside), as well as the membrane potential, will drive the transport of 18 amino acids. The I9th, glutamate, is unique in that its accumulation is indifferent to Delta(psi): this amino acid is transported only when a chemical gradient for Na(+) is present. Thus, when more and more NaCl is included in the vesicles glutamate transport proceeds with longer and longer lags. After illumination the gradient of H+() collapses within 1 min, while the large Na(+) gradient and glutamate transporting activity persists for 10- 15 min, indicating that proton motive force is not necessary for transport. A chemical gradient of Na(+), arranged by suspending vesicles loaded with KCl in NaCl, drives glutamate transport in the dark without other sources of energy, with V(sub max) and K(sub m) comparable to light-induced transport. These and other lines of evidence suggest that the transport of glutamate is facilitated by symport with Na(+), in an electrically neutral fashion, so that only the chemical component of the Na(+) gradient is a driving force.
Temperature dependence of electronic transport property in ferroelectric polymer films
NASA Astrophysics Data System (ADS)
Zhao, X. L.; Wang, J. L.; Tian, B. B.; Liu, B. L.; Zou, Y. H.; Wang, X. D.; Sun, S.; Sun, J. L.; Meng, X. J.; Chu, J. H.
2014-10-01
The leakage current mechanism of ferroelectric copolymer of polyvinylidene fluoride with trifluoroethylene prepared by Langmuir-Blodgett was investigated in the temperature range from 100 K to 350 K. The electron as the dominant injected carrier was observed in the ferroelectric copolymer films. The transport mechanisms in copolymer strongly depend on the temperature and applied voltage. From 100 K to 200 K, Schottky emission dominates the conduction. With temperature increasing, the Frenkel-Poole emission instead of the Schottky emission to conduct the carrier transport. When the temperature gets to 260 K, the leakage current becomes independent of temperature, and the space charge limited current conduction was observed.
Transport properties of high-temperature air in a magnetic field
Bruno, D.; Capitelli, M.; Catalfamo, C.; Giordano, D.
2011-01-15
Transport properties of equilibrium air plasmas in a magnetic field are calculated with the Chapman-Enskog method. The range considered for the temperature is [50-50 000] K and for the magnetic induction is [0-300] T.
Transport Properties of the Dust Components in Weakly Ionized Plasma
Vaulina, O. S.; Adamovich, X. G.; Petrov, O. F.; Fortov, V. E.
2008-09-07
The experimental study of transport processes are presented for the dusty plasma in radio-frequency (RF-) capacitive discharge. Validity of the Langevin and Green-Kubo equations for the description of dynamics of dusty grains is verified. Experimental examination of the Einstein-Stokes relation between the viscosity and diffusion constants is carried out.
ELECTRONIC AND TRANSPORT PROPERTIES OF THERMOELECTRIC Ru2Si3
NASA Astrophysics Data System (ADS)
Singh, David J.; Parker, David
2013-10-01
We report calculations of the doping and temperature dependent thermopower of Ru2Si3 based on Boltzmann transport theory and the first principles electronic structure. We find that the performance reported to date can be significantly improved by optimization of the doping level and that ultimately n-type should have higher ZT than p-type.
NASA Astrophysics Data System (ADS)
Lima, L. S.
2016-07-01
We use the SU(3) Schwinger's boson theory to study the spin transport properties of the two-dimensional anisotropic frustrated Heisenberg model in a honeycomb lattice at T=0. We have investigated the behavior of the spin conductivity for this model which presents a single-ion anisotropy and J1 and J2 exchange interactions. We study the spin transport in the Bose-Einstein condensation regime where we have that the tz bosons are condensed and the following condition is valid:
Spin superfluidity in the anisotropic XY model in the triangular lattice
NASA Astrophysics Data System (ADS)
Lima, L. S.
2016-07-01
We use the SU(3) Schwinger's boson theory to study the spin transport properties in the two-dimensional anisotropic frustrated Heisenberg model in the triangular lattice at T=0. We have investigated the behavior of the spin conductivity for this model which presents an single-ion anisotropy. We study the spin transport in the Bose-Einstein condensation regime where we have that the tz bosons are condensed and the following condition is valid:
Kondo effect goes anisotropic in vanadate oxide superlattices
NASA Astrophysics Data System (ADS)
Rotella, H.; Pautrat, A.; Copie, O.; Boullay, P.; David, A.; Mercey, B.; Morales, M.; Prellier, W.
2015-11-01
We study the transport properties in SrVO3/LaVO3 (SVO/LVO) superlattices deposited on SrTiO3 (STO) substrates. We show that the electronic conduction occurs in the metallic LVO layers with a galvanomagnetism typical of a 2D Fermi surface. In addition, a Kondo-like component appears in both the thermal variation of resistivity and the magnetoresistance. Surprisingly, in this system where the STO interface does not contribute to the measured conduction, the Kondo correction is strongly anisotropic. We show that the growth temperature allows a direct control of this contribution. Finally, the key role of vanadium mixed valency stabilized by oxygen vacancies is enlightened.
A generalized anisotropic deformation formulation for geomaterials
NASA Astrophysics Data System (ADS)
Lei, Z.; Rougier, Esteban; Knight, E. E.; Munjiza, A.; Viswanathan, H.
2016-04-01
In this paper, the combined finite-discrete element method (FDEM) has been applied to analyze the deformation of anisotropic geomaterials. In the most general case geomaterials are both non-homogeneous and non-isotropic. With the aim of addressing anisotropic material problems, improved 2D FDEM formulations have been developed. These formulations feature the unified hypo-hyper elastic approach combined with a multiplicative decomposition-based selective integration for volumetric and shear deformation modes. This approach is significantly different from the co-rotational formulations typically encountered in finite element codes. Unlike the co-rotational formulation, the multiplicative decomposition-based formulation naturally decomposes deformation into translation, rotation, plastic stretches, elastic stretches, volumetric stretches, shear stretches, etc. This approach can be implemented for a whole family of finite elements from solids to shells and membranes. This novel 2D FDEM based material formulation was designed in such a way that the anisotropic properties of the solid can be specified in a cell by cell basis, therefore enabling the user to seed these anisotropic properties following any type of spatial variation, for example, following a curvilinear path. In addition, due to the selective integration, there are no problems with volumetric or shear locking with any type of finite element employed.
Autofocus imaging: Experimental results in an anisotropic austenitic weld
NASA Astrophysics Data System (ADS)
Zhang, J.; Drinkwater, B. W.; Wilcox, P. D.; Hunter, A.
2012-05-01
The quality of an ultrasonic array image, especially for anisotropic material, depends on accurate information about acoustic properties. Inaccuracy of acoustic properties causes image degradation, e.g., blurring, errors in locating of reflectors and introduction of artifacts. In this paper, for an anisotropic austenitic steel weld, an autofocus imaging technique is presented. The array data from a series of beacons is captured and then used to statistically extract anisotropic weld properties by using a Monte-Carlo inversion approach. The beacon and imaging systems are realized using two separated arrays; one acts as a series of beacons and the other images these beacons. Key to the Monte-Carlo inversion scheme is a fast forward model of wave propagation in the anisotropic weld and this is based on the Dijkstra algorithm. Using this autofocus approach a measured weld map was extracted from an austenitic weld and used to reduce location errors, initially greater than 6mm, to less than 1mm.
NASA Technical Reports Server (NTRS)
Ghorai, S. K.
1983-01-01
The purpose of this project was to use a one-dimensional discrete coordinates transport code called ANISN in order to determine the energy-angle-spatial distribution of neutrons in a 6-feet cube rock box which houses a D-T neutron generator at its center. The project was two-fold. The first phase of the project involved adaptation of the ANISN code written for an IBM 360/75/91 computer to the UNIVAC system at JSC. The second phase of the project was to use the code with proper geometry, source function and rock material composition in order to determine the neutron flux distribution around the rock box when a 14.1 MeV neutron generator placed at its center is activated.
NASA Astrophysics Data System (ADS)
Ghorai, S. K.
1983-09-01
The purpose of this project was to use a one-dimensional discrete coordinates transport code called ANISN in order to determine the energy-angle-spatial distribution of neutrons in a 6-feet cube rock box which houses a D-T neutron generator at its center. The project was two-fold. The first phase of the project involved adaptation of the ANISN code written for an IBM 360/75/91 computer to the UNIVAC system at JSC. The second phase of the project was to use the code with proper geometry, source function and rock material composition in order to determine the neutron flux distribution around the rock box when a 14.1 MeV neutron generator placed at its center is activated.
Comparison on thermal transport properties of graphene and phosphorene nanoribbons
Peng, Xiao-Fang; Chen, Ke-Qiu
2015-01-01
We investigate ballistic thermal transport at low temperatures in graphene and phosphorene nanoribbons (PNRS) modulated with a double-cavity quantum structure. A comparative analysis for thermal transport in these two kinds of nanomaterials is made. The results show that the thermal conductance in PNRS is greater than that in graphene nanoribbons (GNRS). The ratio kG/kP (kG is the thermal conductivity in GNRS and kP is the thermal conductivity in PNRS) decreases with lower temperature or for narrower nanoribbons, and increases with higher temperature or for wider nanoribbons. The greater thermal conductance and thermal conductivity in PNRS originate from the lower cutoff frequencies of the acoustic modes. PMID:26577958
Opto-electronic transport properties of graphene oxide based devices
Das, Poulomi; Ibrahim, Sk; Pal, Tanusri; Chakraborty, Koushik; Ghosh, Surajit
2015-06-24
Large area, solution-processed, graphene oxide (GO)nanocomposite based photo FET has been successfully fabricated. The device exhibits p-type charge transport characteristics in dark condition. Our measurements indicate that the transport characteristics are gate dependent and extremely sensitive to solar light. Photo current decay mechanism of GO is well explained and is associated with two phenomena: a) fast response process and b) slow response process. Slow response photo decay can be considered as the intrinsic phenomena which are present for both GO and reduced GO (r-GO), whereas the first response photo decay is controlled by the surface defect states. Demonstration of photo FET performance of GO thin film is a significant step forward in integrating these devices in various optoelectronic circuits.
Comparison on thermal transport properties of graphene and phosphorene nanoribbons
NASA Astrophysics Data System (ADS)
Peng, Xiao-Fang; Chen, Ke-Qiu
2015-11-01
We investigate ballistic thermal transport at low temperatures in graphene and phosphorene nanoribbons (PNRS) modulated with a double-cavity quantum structure. A comparative analysis for thermal transport in these two kinds of nanomaterials is made. The results show that the thermal conductance in PNRS is greater than that in graphene nanoribbons (GNRS). The ratio kG/kP (kG is the thermal conductivity in GNRS and kP is the thermal conductivity in PNRS) decreases with lower temperature or for narrower nanoribbons, and increases with higher temperature or for wider nanoribbons. The greater thermal conductance and thermal conductivity in PNRS originate from the lower cutoff frequencies of the acoustic modes.
Understanding hopping transport and thermoelectric properties of conducting polymers
NASA Astrophysics Data System (ADS)
Ihnatsenka, S.; Crispin, X.; Zozoulenko, I. V.
2015-07-01
We calculate the conductivity σ and the Seebeck coefficient S for the phonon-assisted hopping transport in conducting polymers poly(3,4-ethylenedioxythiophene) or PEDOT, experimentally studied by Bubnova et al. [J. Am. Chem. Soc. 134, 16456 (2012)], 10.1021/ja305188r. We use the Monte Carlo technique as well as the semianalytical approach based on the transport energy concept. We demonstrate that both approaches show a good qualitative agreement for the concentration dependence of σ and S . At the same time, we find that the semianalytical approach is not in a position to describe the temperature dependence of the conductivity. We find that both Gaussian and exponential density of states (DOS) reproduce rather well the experimental data for the concentration dependence of σ and S giving similar fitting parameters of the theory. The obtained parameters correspond to a hopping model of localized quasiparticles extending over 2-3 monomer units with typical jumps over a distance of 3-4 units. The energetic disorder (broadening of the DOS) is estimated to be 0.1 eV. Using the Monte Carlo calculation we reproduce the activation behavior of the conductivity with the calculated activation energy close to the experimentally observed one. We find that for a low carrier concentration a number of free carriers contributing to the transport deviates strongly from the measured oxidation level. Possible reasons for this behavior are discussed. We also study the effect of the dimensionality on the charge transport by calculating the Seebeck coefficient and the conductivity for the cases of three-, two-, and one-dimensional motion.
The effect of electron induced hydrogenation of graphene on its electrical transport properties
Woo, Sung Oh; Teizer, Winfried
2013-07-22
We report a deterioration of the electrical transport properties of a graphene field effect transistor due to energetic electron irradiation on a stack of Poly Methyl Methacrylate (PMMA) on graphene (PMMA/graphene bilayer). Prior to electron irradiation, we observed that the PMMA layer on graphene does not deteriorate the carrier transport of graphene but improves its electrical properties instead. As a result of the electron irradiation on the PMMA/graphene bilayer, the Raman “D” band appears after removal of PMMA. We argue that the degradation of the transport behavior originates from the binding of hydrogen generated during the PMMA backbone secession process.
Theoretical studies of the transport properties in compound semiconductors
NASA Technical Reports Server (NTRS)
Segall, Benjamin
1994-01-01
This final report is an overview of the work done on Cooperative Agreement NCC 3-55 with the Solid State Technology Branch of the NASA-Lewis Research Center (LeRC). Over the period of time that the agreement was in effect, the principal investigator and, in the last three years, the co-principal investigator worked on a significant number of projects and interacted with members of the Solid State Technology (SST) branch in a number of different ways. For the purpose of this report, these efforts will be divided into five categories: 1) work directly with experimental electrical transport studies conducted by members of the SST branch; 2) theoretical work on electrical transport in compound semiconductors; 3) electronic structure calculations which are relevant to the electrical transport in polytypes of SiC and SiC-AlN alloys; 4) the electronic structure calculations of polar interfaces; and 5) consultative and supportive activities related to experiments and other studies carried out by SST branch members. Work in these categories is briefly discussed.
Theoretical studies of the transport properties in compound semiconductors
NASA Astrophysics Data System (ADS)
Segall, Benjamin
1994-06-01
This final report is an overview of the work done on Cooperative Agreement NCC 3-55 with the Solid State Technology Branch of the NASA-Lewis Research Center (LeRC). Over the period of time that the agreement was in effect, the principal investigator and, in the last three years, the co-principal investigator worked on a significant number of projects and interacted with members of the Solid State Technology (SST) branch in a number of different ways. For the purpose of this report, these efforts will be divided into five categories: 1) work directly with experimental electrical transport studies conducted by members of the SST branch; 2) theoretical work on electrical transport in compound semiconductors; 3) electronic structure calculations which are relevant to the electrical transport in polytypes of SiC and SiC-AlN alloys; 4) the electronic structure calculations of polar interfaces; and 5) consultative and supportive activities related to experiments and other studies carried out by SST branch members. Work in these categories is briefly discussed.