A quantum-classical approach to the molecular dynamics of pyrazine with a realistic model Hamiltonian

Journal of Chemical Physics

Volumn 125, Issue 19, 2006, Pages

  Puzari, Panchanan ^a   Sarkar, Biplab ^a   Adhikari, Satrajit ^a  

^a INDIAN INSTITUTE OF TECHNOLOGY GUWAHATI   (India)

Author keywords

[No Author keywords available]

Indexed keywords

DEGREES OF FREEDOM (MECHANICS); HAMILTONIANS; MOLECULAR DYNAMICS; MOLECULAR VIBRATIONS;

POPULATION TRANSFER; PYRAZINE; SEQUENTIAL INCLUSION; TIME-DEPENDENT DISCRETE VARIABLE REPRESENTATION (TDDVR);

AROMATIC COMPOUNDS;

EID: 33845346816     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2393228     Document Type: Article

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