Efficient calculation of carrier scattering rates from first principles

It is difficult to compute the transport properties of a broad array of complex materials both accurately and inexpensively. Here, the authors develop a computationally efficient method for calculating carrier scattering rates of semiconductors, with good accuracy but low cost.

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Autores principales:	Alex M. Ganose, Junsoo Park, Alireza Faghaninia, Rachel Woods-Robinson, Kristin A. Persson, Anubhav Jain
Formato:	article
Lenguaje:	EN
Publicado:	Nature Portfolio 2021
Materias:	Science Q
Acceso en línea:	https://doaj.org/article/b3e227b459b84029a89a7b83e5ac85a0
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spelling	oai:doaj.org-article:b3e227b459b84029a89a7b83e5ac85a02021-12-02T15:51:06ZEfficient calculation of carrier scattering rates from first principles10.1038/s41467-021-22440-52041-1723https://doaj.org/article/b3e227b459b84029a89a7b83e5ac85a02021-04-01T00:00:00Zhttps://doi.org/10.1038/s41467-021-22440-5https://doaj.org/toc/2041-1723It is difficult to compute the transport properties of a broad array of complex materials both accurately and inexpensively. Here, the authors develop a computationally efficient method for calculating carrier scattering rates of semiconductors, with good accuracy but low cost.Alex M. GanoseJunsoo ParkAlireza FaghaniniaRachel Woods-RobinsonKristin A. PerssonAnubhav JainNature PortfolioarticleScienceQENNature Communications, Vol 12, Iss 1, Pp 1-9 (2021)
institution	DOAJ
collection	DOAJ
language	EN
topic	Science Q
spellingShingle	Science Q Alex M. Ganose Junsoo Park Alireza Faghaninia Rachel Woods-Robinson Kristin A. Persson Anubhav Jain Efficient calculation of carrier scattering rates from first principles
description	It is difficult to compute the transport properties of a broad array of complex materials both accurately and inexpensively. Here, the authors develop a computationally efficient method for calculating carrier scattering rates of semiconductors, with good accuracy but low cost.
format	article
author	Alex M. Ganose Junsoo Park Alireza Faghaninia Rachel Woods-Robinson Kristin A. Persson Anubhav Jain
author_facet	Alex M. Ganose Junsoo Park Alireza Faghaninia Rachel Woods-Robinson Kristin A. Persson Anubhav Jain
author_sort	Alex M. Ganose
title	Efficient calculation of carrier scattering rates from first principles
title_short	Efficient calculation of carrier scattering rates from first principles
title_full	Efficient calculation of carrier scattering rates from first principles
title_fullStr	Efficient calculation of carrier scattering rates from first principles
title_full_unstemmed	Efficient calculation of carrier scattering rates from first principles
title_sort	efficient calculation of carrier scattering rates from first principles
publisher	Nature Portfolio
publishDate	2021
url	https://doaj.org/article/b3e227b459b84029a89a7b83e5ac85a0
work_keys_str_mv	AT alexmganose efficientcalculationofcarrierscatteringratesfromfirstprinciples AT junsoopark efficientcalculationofcarrierscatteringratesfromfirstprinciples AT alirezafaghaninia efficientcalculationofcarrierscatteringratesfromfirstprinciples AT rachelwoodsrobinson efficientcalculationofcarrierscatteringratesfromfirstprinciples AT kristinapersson efficientcalculationofcarrierscatteringratesfromfirstprinciples AT anubhavjain efficientcalculationofcarrierscatteringratesfromfirstprinciples
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Efficient calculation of carrier scattering rates from first principles

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