Multiple coherent states for first-principles semiclassical initial value representation molecular dynamics

Journal of Chemical Physics

Volumn 130, Issue 23, 2009, Pages

  Ceotto, Michele ^a   Atahan, Sule ^b   Tantardini, Gian Franco ^a,c   Aspuru Guzik, Alán ^b  

^a UNIVERSITY OF MILAN   (Italy)

^b HARVARD UNIVERSITY   (United States)

^c CNR   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

CARBON DIOXIDE; POWER SPECTRUM;

ANHARMONICITIES; CLASSICAL TRAJECTORIES; FERMI RESONANCES; FIRST PRINCIPLES; FIRST PRINCIPLES MOLECULAR DYNAMICS; INITIAL VALUE REPRESENTATION; SEMI-CLASSICAL APPROXIMATION; SEMICLASSICAL SIMULATION;

MOLECULAR DYNAMICS;

EID: 67649094316     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3155062     Document Type: Article

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