Variational approach to electronic structure calculations on second-order reduced density matrices and the N-representability problem

真秀中田, Maho Nakata, 光浩福田, Mituhiro Fukuda, 克樹藤澤, Katsuki Fujisawa

Published Jan 1, 2013• 0 citations

Related papers

Electronic structure calculations using N-representability conditions on second-order reduced density matrices

光浩福田, Mituhiro Fukuda

Mar 1, 20100 citations

Variational calculation of second-order reduced density matrices by strong N -representability conditions and an accurate semidefinite programming solver

Katsuki Fujisawa

Jan 1, 20080 citations

Generalized density-functional theory: Conquering theN-representability problem with exact functionals for the electron pair density and the second-order reduced density matrix

Paul W. Ayers, Mel Levy

Journal of Chemical SciencesSep 1, 200593 citations

Variational calculations of fermion second-order reduced density matrices by semidefinite programming algorithm

真秀中田, Maho Nakata, 博中辻 +8 more

Jan 1, 20010 citations

Solving large-scale semidefinite programs for the variational calculation of second-order reduced density matrices in fermionic system

福田, 光浩, Mituhiro Fukuda

Feb 1, 20100 citations

Electronic structure calculations based on the two-body reduced density matrix, semidefinite programming, and three-index representability conditions

Bastiaan J. Braams, Mituhiro Fukuda, Maho Nakata +4 more

Bulletin of the American Physical SocietyMar 23, 20050 citations