[HTML][HTML] Numerically “exact” approach to open quantum dynamics: The hierarchical equations of motion (HEOM)

Y Tanimura - The Journal of chemical physics, 2020 - pubs.aip.org
An open quantum system refers to a system that is further coupled to a bath system
consisting of surrounding radiation fields, atoms, molecules, or proteins. The bath system is …

Numerical simulations of time-resolved quantum electronics

B Gaury, J Weston, M Santin, M Houzet, C Groth… - Physics Reports, 2014 - Elsevier
Numerical simulation has become a major tool in quantum electronics both for fundamental
and applied purposes. While for a long time those simulations focused on stationary …

Nonlinear spectroscopy of core and valence excitations using short x-ray pulses: Simulation challenges

Y Zhang, W Hua, K Bennett, S Mukamel - Density-Functional Methods for …, 2016 - Springer
Measuring the nonlinear response of electrons and nuclei to attosecond broadband X-ray
radiation has become possible by newly developed free electron lasers and high harmonic …

A many-body approach to transport in quantum systems: from the transient regime to the stationary state

M Ridley, NW Talarico, D Karlsson… - Journal of Physics A …, 2022 - iopscience.iop.org
We review one of the most versatile theoretical approaches to the study of time-dependent
correlated quantum transport in nano-systems: the non-equilibrium Green's function (NEGF) …

Nonequilibrium open quantum systems with multiple bosonic and fermionic environments: A hierarchical equations of motion approach

J Bätge, Y Ke, C Kaspar, M Thoss - Physical Review B, 2021 - APS
We present a hierarchical equations of motion approach, which allows a numerically exact
simulation of nonequilibrium transport in general open quantum systems involving multiple …

Efficient auxiliary-mode approach for time-dependent nanoelectronics

BS Popescu, A Croy - New Journal of Physics, 2016 - iopscience.iop.org
A new scheme for numerically solving the equations arising in the time-dependent non-
equilibrium Green's function formalism is developed. It is based on an auxiliary-mode …

Extending the hierarchical quantum master equation approach to low temperatures and realistic band structures

A Erpenbeck, C Hertlein, C Schinabeck… - The Journal of chemical …, 2018 - pubs.aip.org
The hierarchical quantum master equation (HQME) approach is an accurate method to
describe quantum transport in interacting nanosystems. It generalizes perturbative master …

First-principles time-dependent quantum transport theory

Y Zhang, S Chen, GH Chen - Physical Review B—Condensed Matter and …, 2013 - APS
A practical first-principles scheme for time-dependent transport through realistic systems at
finite temperature is established by the combination of time-dependent density functional …

Time-dependent Landauer-Büttiker formula: Application to transient dynamics in graphene nanoribbons

R Tuovinen, E Perfetto, G Stefanucci, R Van Leeuwen - Physical Review B, 2014 - APS
In this work, we develop a time-dependent extension of the Landauer-Büttiker approach to
study transient dynamics in time-dependent quantum transport through molecular junctions …

Simple and accurate method for time-dependent transport along nanoscale junctions

L Chen, T Hansen, I Franco - The Journal of Physical Chemistry C, 2014 - ACS Publications
A simple method that accurately captures the dynamics of metal–molecule–metal junctions
under the influence of time-dependent driving forces is presented. In the method, the …