scholarly journals Multiconfigurational Self-Consistent Field Theory with Density Matrix Embedding: The Localized Active Space Self-Consistent Field Method

2019 ◽  
Vol 15 (2) ◽  
pp. 972-986 ◽  
Author(s):  
Matthew R. Hermes ◽  
Laura Gagliardi
Keyword(s):  
Field Theory ◽  
Density Matrix ◽  
Field Method ◽  
Active Space ◽  
Consistent Field ◽  
Matrix Embedding ◽  
Self Consistent ◽  
Self Consistent Field ◽  
Self Consistent Field Theory

Trace resetting density matrix purification in O(N) self-consistent-field theory

2003 ◽  
Vol 118 (19) ◽  
pp. 8611-8620 ◽  
Author(s):  
Anders M. N. Niklasson ◽  
C. J. Tymczak ◽  
Matt Challacombe
Keyword(s):  
Field Theory ◽  
Density Matrix ◽  
Consistent Field ◽  
Self Consistent ◽  
Self Consistent Field ◽  
Self Consistent Field Theory
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