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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Nature Portfolio
2021
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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) |
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Science Q |
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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 |
work_keys_str_mv |
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1718383672765186048 |