A modified definition of the zeroth-order Hamiltonian in multiconfigurational perturbation theory (CASPT2)

Chemical Physics Letters

Volumn 396, Issue 1-3, 2004, Pages 142-149

  Ghigo, Giovanni ^a   Roos, Björn O ^a   Malmqvist, Per Åke ^a  

^a S 221 00 Lund Sweden ^*  (Sweden)

Author keywords

[No Author keywords available]

Indexed keywords

BENZENE;

ARTICLE; ATOM; CALCULATION; CORRELATION ANALYSIS; DISSOCIATION; ENERGY; ERROR; MOLECULE; THEORY;

EID: 8344289249     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2004.08.032     Document Type: Article

References (20)

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