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We present a pedagogical review of current density simulation in molecular junction models indicating its advantages and deficiencies in analysis of local junction transport characteristics. In particular, we argue that current density is a…

介观与纳米尺度物理 · 物理学 2018-06-14 Gabriel Cabra , Anders Jensen , Michael Galperin

Transport of a Brownian particle moving along the axis of a three-dimensional asymmetric periodic tube is investigated in the presence of asymmetric unbiased forces. The reduction of the coordinates may involve not only the appearance of…

统计力学 · 物理学 2009-11-13 Bao-quan Ai , Liang-gang Liu

The dynamics of inertial particles in turbulence is modelled and investigated by means of direct numerical simulation of an axisymmetrically expanding homogeneous turbulent strained flow. This flow can mimic the dynamics of particles close…

流体动力学 · 物理学 2023-07-19 Chung-min Lee , Ármann Gylfason , Prasad Perlekar , Federico Toschi

We consider several fundamental optical phenomena involving single molecules in biased metal-molecule-metal junctions. The molecule is represented by its highest occupied and lowest unoccupied molecular orbitals, and the analysis involves…

介观与纳米尺度物理 · 物理学 2007-05-23 Michael Galperin , Abraham Nitzan

It was recently predicted [J. Phys.: Condens. Matter 18, 11059 (2006)] that turbulence of the electron flow may develop at nonadiabatic nanoscale junctions under appropriate conditions. Here we show that such an effect leads to an…

其他凝聚态物理 · 物理学 2008-03-24 Neil Bushong , Yuriy Pershin , Massimiliano Di Ventra

The effect of non-equilibrium constraints and dephasing on the circulating currents in molecular junctions are analyzed. Circulating currents are manifestations of quantum effects and can be induced either by externally applied bias or an…

介观与纳米尺度物理 · 物理学 2016-09-28 Hari Kumar Yadalam , Upendra Harbola

The effect of magnetic turbulence in shaping the current density in axisymmetric magnetized plasma is analyzed using a turbulent extension of Ohm's law derived from the self-consistent action-angle transport theory. Besides the well-known…

等离子体物理 · 物理学 2017-08-02 Ilija Chavdarovski , Renato Gatto

In particle-laden turbulent flows the turbulence in carrier fluid phase gets affected by the dispersed particle phase for volume fraction above $10^{-4}$ and hence reverse coupling or two-way coupling becomes relevant in that volume…

流体动力学 · 物理学 2022-09-14 Swagnik Ghosh , Partha Sarathi Goswami

We investigate both experimentally and theoretically the traffic of particles flowing in microfluidic obstacle networks. We show that the traffic dynamics is a non-linear process: the particle current does not scale with the particle…

统计力学 · 物理学 2015-05-19 Nicolas Champagne , Romain Vasseur , Adrien Montourcy , Denis Bartolo

We study the generic non-equilibrium steady states in asymmetric exclusion processes on a closed network with bottlenecks. To this end we proposes and study closed simple networks with multiply-connected non-identical junctions. Depending…

统计力学 · 物理学 2015-01-13 Rakesh Chatterjee , Anjan Kumar Chandra , Abhik Basu

We extend the Landauer-B\"uttiker probe formalism for conductances to the high bias regime, and study the effects of environmentally-induced elastic and inelastic scattering on charge current in single molecule junctions, focusing on…

介观与纳米尺度物理 · 物理学 2016-04-13 Michael Kilgour , Dvira Segal

The nucleation process of polyethylene under quiescent and shear flow conditions are comparatively studied with all_atom molecular dynamical simulations. At both conditions, nucleation are demonstrated to be two_step processes, which,…

软凝聚态物质 · 物理学 2021-12-08 Xiaoliang Tang , Junsheng Yang , Fucheng Tian , Tingyu Xu , Chun Xie , Liangbin Li

We perform molecular dynamics simulations to characterize the occurrence of inhomogeneous shear flows in soft jammed materials. We use rough walls to impose a simple shear flow and study the athermal motion of jammed assemblies of soft…

软凝聚态物质 · 物理学 2012-02-23 Pinaki Chaudhuri , Ludovic Berthier , Lydéric Bocquet

We theoretically analyze correlation effects on the transport properties of a benzene molecule that are mediated by interactions between the motion of the nuclei and the transmitted charge. We focus on the lowest-lying molecular vibrational…

介观与纳米尺度物理 · 物理学 2013-08-09 Michael Knap , Enrico Arrigoni , Wolfgang von der Linden

The local current flow through three small aromatic carbon molecules, namely benzene, naphthalene and anthracene, is studied. Applying density functional theory and the non-equilibrium Green's function method for transport, we demonstrate…

A simple model of the driven motion of interacting particles in a two dimensional random medium is analyzed, focusing on the critical behavior near to the threshold that separates a static phase from a flowing phase with a steady-state…

统计力学 · 物理学 2008-02-03 Joe Watson , Daniel S. Fisher

We study the buckling of a clamped beam immersed in a creeping flow within a rectangular channel. Via a combination of precision experiments, simulations, and theoretical modeling, we show how the instability depends on a pressure feedback…

软凝聚态物质 · 物理学 2024-07-19 Hemanshul Garg , Pier Giuseppe Ledda , Jon Skov Pedersen , Matteo Pezzulla

The dynamics of entrainment of finite-size heavy particles in a turbulent open channel flow over a smooth surface are analyzed. Three types of simulations, namely with freely moving, rotation-constrained, and spanwise-motion-constrained…

流体动力学 · 物理学 2026-01-28 Tatia Bzikadze , Markus Weyrauch , Markus Uhlmann

We investigate the heat conduction properties of molecular junctions comprising anharmonic interactions. We find that nonlinear interactions can lead to novel phenomena: it negative differential thermal conductance and heat rectification.…

软凝聚态物质 · 物理学 2009-11-11 Dvira Segal

Joint influence of two effects, namely, nonequilibrium spin injection by current, and current induced surface torque, on spin-valve type ferromagnetic metallic junctions is considered theoretically. The CPP configuration is assumed. The…

材料科学 · 物理学 2007-05-23 R. J. Elliott , E. M. Epshtein , Yu. V. Gulyaev , P. E. Zilberman
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