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3 research outputs found
Contributions of pauli repulsions to the energetics and physical properties computed in QM/MM methods
Author
Becke
Ben-Nun
+34Â more
Borgoo
Cembran
Cortona
Cui
Cui
Day
DiLabio
DiLabio
Fujimoto
Gao
Goedecker
Gordon
Hu
Hu
Hu
Hu
Jensen
Jorgensen
Kitaura
Lee
Mennucci
Parks
Pu
Riccardi
Sebastiani
Svensson
Warshel
Wesolowski
Wolinski
Yang
Yang
Zhang
Zhang
Zhang
Publication venue
Publication date
01/01/2013
Field of study
No full text
Crossref
HKU Scholars Hub
Contributions of pauli repulsions to the energetics and physical properties computed in QM/MM methods
Author
Becke
Ben-Nun
+34Â more
Borgoo
Cembran
Cortona
Cui
Cui
Day
DiLabio
DiLabio
Fujimoto
Gao
Goedecker
Gordon
Hu
Hu
Hu
Hu
Jensen
Jorgensen
Kitaura
Lee
Mennucci
Parks
Pu
Riccardi
Sebastiani
Svensson
Warshel
Wesolowski
Wolinski
Yang
Yang
Zhang
Zhang
Zhang
Publication venue
'Wiley'
Publication date
Field of study
No full text
Crossref