Ab initio calculation of potential energy surfaces for the three lowest triplet states (1 3A″,1 3A′,2 3A″) of PH(X,A)-He

Journal of Chemical Physics

Volumn 106, Issue 18, 1997, Pages 7637-7641

  Kolczewski, Ch ^a   Fink, K ^a   Staemmler, V ^a   Neitsch, L ^a  

^a RUHR UNIVERSITY BOCHUM   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

EXCITED STATES; GROUND STATE; MOLECULAR PHYSICS; POTENTIAL ENERGY; POTENTIAL ENERGY SURFACES; QUANTUM CHEMISTRY; QUANTUM THEORY; RATE CONSTANTS; VAN DER WAALS FORCES;

AB INITIO CALCULATIONS; ANGULAR ANISOTROPY; COMPLETE ACTIVE SPACE; CORRELATION EFFECT; EXCITED TRIPLET STATE; EXPERIMENTAL VALUES; INTERACTION POTENTIALS; LEGENDRE EXPANSION;

CALCULATIONS;

EID: 0011713647     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.473797     Document Type: Article

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