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Norm-Conserving Pseudopotentials and Basis Sets to Explore Actinide Chemistry in Complex Environments.

Authors :
Lu, Jun-Bo
Cantu, David C.
Xu, Cong-Qiao
Nguyen, Manh-Thuong
Hu, Han-Shi
Glezakou, Vassiliki-Alexandra
Rousseau, Roger
Li, Jun
Source :
Journal of Chemical Theory & Computation; 6/8/2021, Vol. 17 Issue 6, p3360-3371, 12p
Publication Year :
2021

Details

Language :
English
ISSN :
15499618
Volume :
17
Issue :
6
Database :
Supplemental Index
Journal :
Journal of Chemical Theory & Computation
Publication Type :
Academic Journal
Accession number :
150818684
Full Text :
https://doi.org/10.1021/acs.jctc.1c00026