Goddard, William Andrew (2020) Multiscale simulations of polymer and ionic liquid electrolytes in Li batteries. In: 259th ACS National Meeting & Exposition, 22-26 March 2020, Philadelphia, PA. https://resolver.caltech.edu/CaltechAUTHORS:20200219-153946006
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Abstract
There are strong interests motivated by safety to replace the liq. electrolytes in Li batteries with polymers or ionic liqs. We use multiscale methods combining quantum mechanics (QM) and reactive force fields to examine the atomistic structures of these electrolytes including Li diffusion and the formation of the Solid-Electrolyte Interface (SEI).
| Item Type: | Conference or Workshop Item (Paper) | ||||||
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| Additional Information: | © 2020 American Chemical Society. | ||||||
| Record Number: | CaltechAUTHORS:20200219-153946006 | ||||||
| Persistent URL: | https://resolver.caltech.edu/CaltechAUTHORS:20200219-153946006 | ||||||
| Usage Policy: | No commercial reproduction, distribution, display or performance rights in this work are provided. | ||||||
| ID Code: | 101406 | ||||||
| Collection: | CaltechAUTHORS | ||||||
| Deposited By: | Tony Diaz | ||||||
| Deposited On: | 19 Feb 2020 23:46 | ||||||
| Last Modified: | 19 Feb 2020 23:46 |
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