Quantum chemical calculations of lithium-ion battery electrolyte and interphase species

Measurement(s) molecule • solid electrolyte interphase Technology Type(s) density functional theory • computational modeling technique Factor Type(s) bond type • charge • spin multiplicity Machine-accessible metadata file describing the reported data: https://doi.org/10.6084/m9.figshare.14915256...

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Autores principales: Evan Walter Clark Spotte-Smith, Samuel M. Blau, Xiaowei Xie, Hetal D. Patel, Mingjian Wen, Brandon Wood, Shyam Dwaraknath, Kristin Aslaug Persson
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Lenguaje:EN
Publicado: Nature Portfolio 2021
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Acceso en línea:https://doaj.org/article/0136d1d9e8fe43d9a7f0f4665c6b38c1
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spelling oai:doaj.org-article:0136d1d9e8fe43d9a7f0f4665c6b38c12021-12-02T16:35:19ZQuantum chemical calculations of lithium-ion battery electrolyte and interphase species10.1038/s41597-021-00986-92052-4463https://doaj.org/article/0136d1d9e8fe43d9a7f0f4665c6b38c12021-08-01T00:00:00Zhttps://doi.org/10.1038/s41597-021-00986-9https://doaj.org/toc/2052-4463Measurement(s) molecule • solid electrolyte interphase Technology Type(s) density functional theory • computational modeling technique Factor Type(s) bond type • charge • spin multiplicity Machine-accessible metadata file describing the reported data: https://doi.org/10.6084/m9.figshare.14915256Evan Walter Clark Spotte-SmithSamuel M. BlauXiaowei XieHetal D. PatelMingjian WenBrandon WoodShyam DwaraknathKristin Aslaug PerssonNature PortfolioarticleScienceQENScientific Data, Vol 8, Iss 1, Pp 1-15 (2021)
institution DOAJ
collection DOAJ
language EN
topic Science
Q
spellingShingle Science
Q
Evan Walter Clark Spotte-Smith
Samuel M. Blau
Xiaowei Xie
Hetal D. Patel
Mingjian Wen
Brandon Wood
Shyam Dwaraknath
Kristin Aslaug Persson
Quantum chemical calculations of lithium-ion battery electrolyte and interphase species
description Measurement(s) molecule • solid electrolyte interphase Technology Type(s) density functional theory • computational modeling technique Factor Type(s) bond type • charge • spin multiplicity Machine-accessible metadata file describing the reported data: https://doi.org/10.6084/m9.figshare.14915256
format article
author Evan Walter Clark Spotte-Smith
Samuel M. Blau
Xiaowei Xie
Hetal D. Patel
Mingjian Wen
Brandon Wood
Shyam Dwaraknath
Kristin Aslaug Persson
author_facet Evan Walter Clark Spotte-Smith
Samuel M. Blau
Xiaowei Xie
Hetal D. Patel
Mingjian Wen
Brandon Wood
Shyam Dwaraknath
Kristin Aslaug Persson
author_sort Evan Walter Clark Spotte-Smith
title Quantum chemical calculations of lithium-ion battery electrolyte and interphase species
title_short Quantum chemical calculations of lithium-ion battery electrolyte and interphase species
title_full Quantum chemical calculations of lithium-ion battery electrolyte and interphase species
title_fullStr Quantum chemical calculations of lithium-ion battery electrolyte and interphase species
title_full_unstemmed Quantum chemical calculations of lithium-ion battery electrolyte and interphase species
title_sort quantum chemical calculations of lithium-ion battery electrolyte and interphase species
publisher Nature Portfolio
publishDate 2021
url https://doaj.org/article/0136d1d9e8fe43d9a7f0f4665c6b38c1
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