scholarly journals Correction to “Variational Relativistic Two-Component Complete-Active-Space Self-Consistent Field Method”

2020 ◽  
Vol 16 (5) ◽  
pp. 3445-3445
Author(s):  
Andrew J. Jenkins ◽  
Hongbin Liu ◽  
Joseph M. Kasper ◽  
Michael J. Frisch ◽  
Xiaosong Li
Keyword(s):  
Field Method ◽  
Complete Active Space ◽  
Active Space ◽  
Consistent Field ◽  
Two Component ◽  
Self Consistent ◽  
Self Consistent Field

Variational Relativistic Two-Component Complete-Active-Space Self-Consistent Field Method

2019 ◽  
Vol 15 (5) ◽  
pp. 2974-2982 ◽  
Author(s):  
Andrew J. Jenkins ◽  
Hongbin Liu ◽  
Joseph M. Kasper ◽  
Michael J. Frisch ◽  
Xiaosong Li
Keyword(s):  
Field Method ◽  
Complete Active Space ◽  
Active Space ◽  
Consistent Field ◽  
Two Component ◽  
Self Consistent ◽  
Self Consistent Field

Analytical gradients of the state-average complete active space self-consistent field method with density fitting

2015 ◽  
Vol 143 (4) ◽  
pp. 044110 ◽  
Author(s):  
Mickaël G. Delcey ◽  
Thomas Bondo Pedersen ◽  
Francesco Aquilante ◽  
Roland Lindh
Keyword(s):  
Field Method ◽  
The State ◽  
Complete Active Space ◽  
Active Space ◽  
Consistent Field ◽  
Density Fitting ◽  
Self Consistent ◽  
Self Consistent Field ◽  
Analytical Gradients ◽  
State Average
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