Wave packet calculations for the Cl + H2 reaction

International Journal of Quantum Chemistry

Volumn 96, Issue 6, 2004, Pages 562-567

  Skouteris, Dimitris ^a   Laganà, Antonio ^a   Capecchi, Gabriella ^b   Werner, Hans Joachim ^b  

^a UNIVERSITY OF PERUGIA   (Italy)

^b UNIVERSITY OF STUTTGART   (Germany)

Author keywords

Calculation; Reaction; Surface grid; Wave packet

Indexed keywords

CALCULATIONS; CHLORINE; CONVERGENCE OF NUMERICAL METHODS; HYDROGEN; POTENTIAL ENERGY; QUANTUM THEORY; SURFACES;

JACOBI COORDINATES; POTENTIAL ENERGY SURFACE; TIME DEPENDENT QUANTUM MECHANICAL CALCULATIONS; TOTAL ANGULAR MOMENTUM QUANTUM NUMBER; WAVE PACKET CALCULATIONS;

CHEMICAL REACTIONS;

EID: 1342347525     PISSN: 00207608     EISSN: None     Source Type: Journal    
DOI: 10.1002/qua.10757     Document Type: Article

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