Instantaneous normal modes, resonances, and decay channels in the vibrational relaxation of the amide i mode of N -methylacetamide-D in liquid deuterated water

Journal of Chemical Physics

Volumn 132, Issue 22, 2010, Pages

  Bastida, Adolfo ^a   Soler, Miguel Angel ^a   Zúiga, Joś ^a   Requena, Alberto ^a   Kalstein, Adrián ^b   Fernández Alberti, Sebastián ^b  

^a UNIVERSITY OF MURCIA   (Spain)

^b UNIVERSIDAD NACIONAL DE QUILMES   (Argentina)

Author keywords

[No Author keywords available]

Indexed keywords

AMIDE I MODE; BENDING MODES; BIEXPONENTIAL FUNCTIONS; DECAY CHANNELS; DEUTERATED WATER; ENERGY FLUXES; INSTANTANEOUS NORMAL MODES; INTERMOLECULAR VIBRATIONS; INTERNAL MOTION; INTRAMOLECULAR VIBRATIONAL REDISTRIBUTION PROCESS; KINETIC MECHANISM; LIBRATIONAL MOTIONS; MD SIMULATION; N-METHYLACETAMIDE; NONEQUILIBRIUM MOLECULAR DYNAMICS; NORMAL MODES; NOVEL ALGORITHM; TIME EVOLUTIONS; VIBRATIONAL MODES; VIBRATIONAL QUANTA; VIBRATIONAL RELAXATION;

ALGORITHMS; AMIDES; DEUTERIUM; MOLECULAR DYNAMICS; RATE CONSTANTS; RELAXATION PROCESSES; RESONANCE; SOLVENTS;

VIBRATION ANALYSIS;

EID: 77953585601     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3435212     Document Type: Article

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