Understanding the Temperature Dependence and Finite Size Effects in Ab Initio MD Simulations of the Hydrated Electron.
Autor: | Park, Sanghyun J., Schwartz, Benjamin J. |
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Zdroj: | Journal of Chemical Theory & Computation; 8/9/2022, Vol. 18 Issue 8, p4973-4982, 10p |
Databáze: | Supplemental Index |
Externí odkaz: |