Importance of short-range versus long-range Hartree-Fock exchange for the performance of hybrid density functionals

Journal of Chemical Physics

Volumn 125, Issue 7, 2006, Pages

  Vydrov, Oleg A ^a   Heyd, Jochen ^a   Krukau, Aliaksandr V ^a   Scuseria, Gustavo E ^a  

^a RICE UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL COSTS; HARTREE-FOCK (HF) EXCHANGE; SPIN-DENSITY APPROXIMATION; THERMOCHEMISTRY;

APPROXIMATION THEORY; DECOMPOSITION; MIXING; PROBABILITY DENSITY FUNCTION; REACTION KINETICS; SEPARATION;

CHEMICAL ENGINEERING;

EID: 33747615729     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2244560     Document Type: Article

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