The computation of Karplus equation coefficients and their components using self-consistent field and second-order polarization propagator methods

2000 ◽  
Vol 98 (23) ◽  
pp. 1981-1990 ◽  
Author(s):  
MARTIN GRAYSON ◽  
STEPHAN P. A. SAUER
Keyword(s):  
Second Order ◽  
Karplus Equation ◽  
Polarization Propagator ◽  
Consistent Field ◽  
Self Consistent ◽  
Self Consistent Field

scholarly journals Second-Order Self-Consistent-Field Density-Matrix Renormalization Group

2017 ◽  
Vol 13 (6) ◽  
pp. 2533-2549 ◽  
Author(s):  
Yingjin Ma ◽  
Stefan Knecht ◽  
Sebastian Keller ◽  
Markus Reiher
Keyword(s):  
Renormalization Group ◽  
Density Matrix ◽  
Second Order ◽  
Density Matrix Renormalization Group ◽  
Field Density ◽  
Density Matrix Renormalization ◽  
Consistent Field ◽  
Self Consistent ◽  
Self Consistent Field

scholarly journals A general second order complete active space self-consistent-field solver for large-scale systems

2017 ◽  
Vol 683 ◽  
pp. 291-299 ◽  
Author(s):  
Qiming Sun ◽  
Jun Yang ◽  
Garnet Kin-Lic Chan
Keyword(s):  
Large Scale ◽  
Second Order ◽  
Large Scale Systems ◽  
Complete Active Space ◽  
Active Space ◽  
Consistent Field ◽  
Self Consistent ◽  
Self Consistent Field
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