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

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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Bibliographic Details
Main Authors: Evan Walter Clark Spotte-Smith, Samuel M. Blau, Xiaowei Xie, Hetal D. Patel, Mingjian Wen, Brandon Wood, Shyam Dwaraknath, Kristin Aslaug Persson
Format: Article
Language:English
Published: Nature Publishing Group 2021-08-01
Series:Scientific Data
Online Access:https://doi.org/10.1038/s41597-021-00986-9

Internet

https://doi.org/10.1038/s41597-021-00986-9

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