Employing Pseudopotentials to Tackle Excited-State Electron Spill-Out in Frozen Density Embedding Calculations
出版年份 2022 全文链接
标题
Employing Pseudopotentials to Tackle Excited-State Electron Spill-Out in Frozen Density Embedding Calculations
作者
关键词
-
出版物
Journal of Chemical Theory and Computation
Volume -, Issue -, Pages -
出版商
American Chemical Society (ACS)
发表日期
2022-02-03
DOI
10.1021/acs.jctc.1c00732
参考文献
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