Sparse maps - A systematic infrastructure for reduced-scaling electronic structure methods. II. Linear scaling domain based pair natural orbital coupled cluster theory

Journal of Chemical Physics

Volumn 144, Issue 2, 2016, Pages

  Riplinger, Christoph ^a   Pinski, Peter ^a   Becker, Ute ^a   Valeev, Edward F ^b   Neese, Frank ^a  

^a MAX PLANCK INSTITUTE FOR CHEMICAL ENERGY CONVERSION   (Germany)

^b VIRGINIA POLYTECHNIC INSTITUTE AND STATE UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMS; CLUSTER ANALYSIS; COMPUTATION THEORY; ELECTRONIC STRUCTURE; HARTREE APPROXIMATION; INTEGRAL EQUATIONS; LINEAR SYSTEMS; LINEAR TRANSFORMATIONS; MATHEMATICAL TRANSFORMATIONS;

ABSOLUTE CORRELATIONS; CLOSED SHELL SYSTEM; COUPLED-CLUSTER THEORY; HARTREE-FOCK CALCULATIONS; INTEGRAL TRANSFORMATIONS; NON-LINEAR SCALING; PERTURBATIVE TRIPLE EXCITATIONS; THREE DIMENSIONAL SYSTEMS;

NUMERICAL METHODS;

EID: 84954426173     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4939030     Document Type: Article

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