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Bibliographic Details
Main Authors: Waintal, Xavier, Wimmer, Michael, Akhmerov, Anton, Groth, Christoph, Nikolic, Branislav K., Istas, Mathieu, Rosdahl, Tómas Örn, Varjas, Daniel
Format: Preprint
Published: 2024
Subjects:
Online Access:https://arxiv.org/abs/2407.16257
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author Waintal, Xavier
Wimmer, Michael
Akhmerov, Anton
Groth, Christoph
Nikolic, Branislav K.
Istas, Mathieu
Rosdahl, Tómas Örn
Varjas, Daniel
author_facet Waintal, Xavier
Wimmer, Michael
Akhmerov, Anton
Groth, Christoph
Nikolic, Branislav K.
Istas, Mathieu
Rosdahl, Tómas Örn
Varjas, Daniel
contents This review is devoted to the different techniques that have been developed to compute the phase-coherent transport properties of quantum nanoelectronic systems connected to electrodes. Beside a review of the different algorithms proposed in the literature, we provide a comprehensive and pedagogical derivation of the two formalisms on which these techniques are based: the scattering approach and the (nonequilibrium) Green's function approach. We show that the scattering problem can be formulated as a system of linear equations and that different existing algorithms for solving this scattering problem amount to different sequences of Gaussian elimination. We explicitly prove the equivalence of the two formalisms. We discuss the stability and numerical complexity of the existing methods. The review ends with a selection of a few applications where numerical calculations were instrumental in shaping our understanding of the physics.
format Preprint
id arxiv_https___arxiv_org_abs_2407_16257
institution arXiv
publishDate 2024
record_format arxiv
spellingShingle Computational quantum transport: a scattering approach perspective
Waintal, Xavier
Wimmer, Michael
Akhmerov, Anton
Groth, Christoph
Nikolic, Branislav K.
Istas, Mathieu
Rosdahl, Tómas Örn
Varjas, Daniel
Mesoscale and Nanoscale Physics
Computational Physics
This review is devoted to the different techniques that have been developed to compute the phase-coherent transport properties of quantum nanoelectronic systems connected to electrodes. Beside a review of the different algorithms proposed in the literature, we provide a comprehensive and pedagogical derivation of the two formalisms on which these techniques are based: the scattering approach and the (nonequilibrium) Green's function approach. We show that the scattering problem can be formulated as a system of linear equations and that different existing algorithms for solving this scattering problem amount to different sequences of Gaussian elimination. We explicitly prove the equivalence of the two formalisms. We discuss the stability and numerical complexity of the existing methods. The review ends with a selection of a few applications where numerical calculations were instrumental in shaping our understanding of the physics.
title Computational quantum transport: a scattering approach perspective
topic Mesoscale and Nanoscale Physics
Computational Physics
url https://arxiv.org/abs/2407.16257