Quantum dynamics of large polyatomic systems using classical separable potentials: The computational implementation

Computers and Chemistry

Volumn 21, Issue 6, 1997, Pages 419-429

  Jungwirth, Pavel ^a   Fredj, Erick ^b   Ždánská, Petra ^a   Gerber, R Benny ^b,c  

^a J HEYROVSKÝ INSTITUTE OF PHYSICAL CHEMISTRY   (Czech Republic)

^b HEBREW UNIVERSITY OF JERUSALEM   (Israel)

^c UNIVERSITY OF CALIFORNIA   (United States)

Author keywords

Mean field; Quantum dynamics; Separability; Spectroscopy; Wavepacket

Indexed keywords

APPROXIMATION THEORY; ATOMS; CALCULATIONS; COMPUTER SIMULATION; DEGREES OF FREEDOM (MECHANICS); EQUATIONS OF MOTION; MOLECULAR DYNAMICS; SPECTROSCOPY;

CLASSICAL SEPARABLE POTENTIAL; POLYATOMIC SYSTEM; QUANTUM DYNAMICS; WAVEPACKET;

QUANTUM THEORY;

EID: 0031364248     PISSN: 00978485     EISSN: None     Source Type: Journal    
DOI: 10.1016/s0097-8485(97)00016-8     Document Type: Article

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