Journal article

Wannier-function software ecosystem for materials simulations

Abstract:: Over the last two decades, following the early developments on maximally localized Wannier functions, an ecosystem of electronic-structure simulation techniques and software packages leveraging the Wannier representation has flourished. This environment includes codes to obtain Wannier functions and interfaces with first-principles simulation software, as well as an increasing number of related post-processing packages. Wannier functions can be obtained for isolated or extended systems (both ...
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Publication status:: Accepted

Peer review status:: Peer reviewed

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APA Style

Marrazzo, A., Beck, S., Margine, E. R., Marzari, N., Mostofi, A. A., Qiao, J., Souza, I., Tsirkin, S. S., Yates, J. R., & Pizzi, G. (2024). Wannier-function software ecosystem for materials simulations. Reviews of Modern Physics.

MLA Style

Marrazzo, A., et al. “Wannier-Function Software Ecosystem for Materials Simulations.” Reviews of Modern Physics, American Physical Society, 2024.

Chicago Style

Marrazzo, A, S Beck, ER Margine, N Marzari, AA Mostofi, J Qiao, I Souza, SS Tsirkin, JR Yates, and G Pizzi. 2024. “Wannier-Function Software Ecosystem for Materials Simulations.” Reviews of Modern Physics.
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+ Marrazzo, A More by this author

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+ Beck, S More by this author

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+ Margine, ER More by this author

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+ Marzari, N More by this author

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+ Mostofi, AA More by this author

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Bibliographic Details

Publisher:: American Physical Society
Journal:: Reviews of Modern Physics More from this journal
Acceptance date:: 2024-07-16
EISSN:: 1539-0756
ISSN:: 0034-6861

Item Description

Language:: English
Keywords:: FFR
Pubs id:: 2015765
Local pid:: pubs:2015765
Deposit date:: 2024-07-16

Terms of use

Notes:: This article has been accepted for publication in Reviews of Modern Physics.

Licence:: Terms and Conditions of Use for Oxford University Research Archive

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