Theoretical study of first-row transition metal oxide cations

Journal of Chemical Physics

Volumn 114, Issue 18, 2001, Pages 7935-7940

  Nakao, Yoshihide ^a   Hirao, Kimihiko ^a   Taketsugu, Tetsuya ^b  

^a UNIVERSITY OF TOKYO   (Japan)

^b OCHANOMIZU UNIVERSITY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

CHEMICAL BONDS; DISSOCIATION; ELECTRON TRANSITIONS; GROUND STATE; OXIDES; PERTURBATION TECHNIQUES; POSITIVE IONS; PROBABILITY DENSITY FUNCTION; TRANSITION METALS;

DISSOCIATION ENERGIES; METAL OXIDES;

ELECTRONIC STRUCTURE;

EID: 0035826562     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1362323     Document Type: Article

References (71)