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Related papers: Self Consistent NEGF-LLG Model for Spin-Torque Bas…

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Driven by Moore's Law, the dimensions of transistors have been pushed down to the nanometer scale. Advanced quantum transport (QT) solvers are required to accurately simulate such nano-devices. The non-equilibrium Green's function (NEGF)…

Distributed, Parallel, and Cluster Computing · Computer Science 2026-01-09 Vincent Maillou , Matthias Bollhofer , Olaf Schenk , Alexandros Nikolaos Ziogas , Mathieu Luisier

A self-consistent method for calculating electron transport through a molecular device is proposed. It is based on density functional theory electronic structure calculations under periodic boundary conditions and implemented in the…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 San-Huang Ke , Harold U. Baranger , Weitao Yang

Experiments observing spin density and spin currents (responsible for, e.g., spin-transfer torque) in spintronic devices measure only the nonequilibrium contributions to these quantities, typically driven by injecting unpolarized charge…

Mesoscale and Nanoscale Physics · Physics 2013-10-18 Farzad Mahfouzi , Branislav K. Nikolic

We present an atomistic quantum transport simulation framework based on the Non-Equilibrium Green's Function (NEGF) formalism to model impact ionization in semiconductor avalanche devices, with direct relevance to near-term quantum…

Quantum Physics · Physics 2026-05-05 Colin Burdine , Nischal Binod Gautam , Enrique P. Blair

We propose a three-dimensional micromagnetic model that dynamically solves the Landau-Lifshitz-Gilbert equation coupled to the full spin-diffusion equation. In contrast to previous methods, we solve for the magnetization dynamics and the…

We investigate the spin-polarized ballistic transport in a three-terminal Zigzag graphene nanoribbon (ZGNR) device using a tight binding model, non-equilibrium Green function formalism within the Landauer-B\"{u}ttiker framework. We study…

Mesoscale and Nanoscale Physics · Physics 2025-07-30 Niharika Tamuli , Saumen Acharjee

We derive a general expression for the electron nonequilibrium (NE) distribution function in the context of steady state quantum transport through a two-terminal nanodevice with interaction. The central idea for the use of NE distributions…

Mesoscale and Nanoscale Physics · Physics 2014-02-26 H. Ness

We propose an efficient procedure to obtain Green's functions by combining the shifted conjugate orthogonal conjugate gradient (shifted COCG) method with the nonequilibrium Green's function (NEGF) method based on a real-space…

Computational Physics · Physics 2015-02-03 Shigeru Iwase , Takeo Hoshi , Tomoya Ono

This paper describes a robust, modular, and physics- based circuit framework to model conventional and emerging Magnetic Tunnel Junction (MTJ) devices. Magnetization dynamics are described by the stochastic Landau-Lifshitz-Gilbert (sLLG)…

Mesoscale and Nanoscale Physics · Physics 2018-08-23 Mustafa Mert Torunbalci , Pramey Upadhyaya , Sunil A. Bhave , Kerem Y. Camsari

We study time-dependent electronic and spin transport through an electronic level connected to two leads and coupled with a single-molecule magnet via exchange interaction. The molecular spin is treated as a classical variable and precesses…

Mesoscale and Nanoscale Physics · Physics 2013-07-24 Milena Filipovic , Cecilia Holmqvist , Federica Haupt , Wolfgang Belzig

We study electronic transport through a strongly interacting quantum dot by using the finite temperature extension of Wilson's numerical renormalization group (NRG) method. This allows the linear conductance to be calculated at all…

Strongly Correlated Electrons · Physics 2007-05-23 T. A. Costi

We develop a Green's function formalism for spin transport through heterostructures that contain metallic leads and insulating ferromagnets. While this formalism in principle allows for the inclusion of various magnonic interactions, we…

Mesoscale and Nanoscale Physics · Physics 2017-11-22 Jiansen Zheng , Scott Bender , Jogundas Armaitis , Roberto E. Troncoso , R. A. Duine

Structural and electronic properties, including deformation, magnetic moment, Mulliken population, bond order as well as electronic transport properties, of zigzag graphene nanoribbon (ZGNR) with Co adatom on hollow site are investigated by…

Mesoscale and Nanoscale Physics · Physics 2013-02-19 G. P. Zhang , Xiaojie Liu , C. Z. Wang , Y. X. Yao , Jian Zhang , K. M. Ho

We present a unified transport theory of hybrid structures, in which a confined normal state ($N$) sample is sandwiched between two leads each of which can be either a ferromagnet ($F$) or a superconductor ($S$) via tunnel barriers. By…

Mesoscale and Nanoscale Physics · Physics 2009-11-10 Z. Y. Zeng , Baowen Li , F. Claro

Thermal-bias-induced spin angular momentum transfer between a paramagnetic metal and ferromagnetic insulator is studied theoretically based on the stochastic Landau-Lifshitz-Gilbert (LLG) phenomenology. Magnons in the ferromagnet establish…

Mesoscale and Nanoscale Physics · Physics 2013-08-14 Silas Hoffman , Koji Sato , Yaroslav Tserkovnyak

Through the Non-Equilibrium Green's Function (NEGF) formalism, quantum-scale device simulation can be performed with the inclusion of electron-phonon scattering. However, the simulation of realistically sized devices under the NEGF…

Mesoscale and Nanoscale Physics · Physics 2015-05-27 Stephen Cauley , Mathieu Luisier , Venkataramanan Balakrishnan , Gerhard Klimeck , Cheng-Kok Koh

We present a Non-Equilibrium Green's Function based model for spin torque transfer (STT) devices which provides quantitative agreement with experimentally measured (1) differential resistances, (2) Magnetoresistance (MR), (3) In-plane…

Mesoscale and Nanoscale Physics · Physics 2016-09-08 Deepanjan Datta , Behtash Behin-Aein , Sayeef Salahuddin , Supriyo Datta

An extended Landau-Lifshitz-Gilbert (LLG) equation is introduced to describe the dynamics of inhomogeneous magnetization in a current-carrying wire. The coefficients of all the terms in this equation are calculated quantum-mechanically for…

Materials Science · Physics 2009-11-13 D. M. Edwards , O. Wessely

We discuss the calculation of the carrier mobility in silicon films within the quantum Non-Equilibrium Green's Functions (NEGF) framework. We introduce a new method for the extraction of the carrier mobility that is free from contact…

Mesoscale and Nanoscale Physics · Physics 2014-02-14 Yann-Michel Niquet , Viet-Hung Nguyen , François Triozon , Ivan Duchemin , Olivier Nier , Denis Rideau

We study quantum entanglement and its relation to transport in a non-equilibrium interacting double dot system connected to electronic baths. The dynamical properties in the non-interacting regime are studied using an exact numerical…

Mesoscale and Nanoscale Physics · Physics 2019-11-26 Anirban Dey , Devendra Singh Bhakuni , Bijay Kumar Agarwalla , Auditya Sharma