Efficient evaluation of exact exchange for periodic systems...

Efficient evaluation of exact exchange for periodic systems via concentric atomic density fitting

Wang, Xiao, Lewis, Cannada A., Valeev, Edward F.
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Volume:
153
Journal:
The Journal of Chemical Physics
DOI:
10.1063/5.0016856
Date:
September, 2020
File:
PDF, 1.58 MB
2020
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