Direct evidence for mode-specific vibrational energy relaxation from quantum time-dependent perturbation theory. I. Five-coordinate ferrous iron porphyrin model

Journal of Chemical Physics

Volumn 130, Issue 2, 2009, Pages

  Zhang, Yong ^a   Fujisaki, Hiroshi ^a,b   Straub, John E ^a  

^a Boston University   (United States)

^b RIKEN   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

ENERGY TRANSFER; IRON; LIGANDS; MOLECULAR VIBRATIONS; PERTURBATION TECHNIQUES; PHOTOLYSIS; PORPHYRINS; PROGRAMMING THEORY;

CONFORMATIONAL CHANGES; DENSITY-FUNCTIONAL (DF); ENERGY RELAXATIONS; FREQUENCY MODES; MARKOVIAN; NORMAL MODES; PERTURBATION THEORY (PT); PLANE VIBRATION; PROTEIN BACKBONE; SYSTEM MODES; TIME CONSTANTS; TIME SCALING;

DENSITY FUNCTIONAL THEORY;

HEME; IRON; METALLOPORPHYRIN;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; QUANTUM THEORY; TIME; VIBRATION;

IRON; METALLOPORPHYRINS; MODELS, MOLECULAR; QUANTUM THEORY; TIME FACTORS; VIBRATION;

EID: 58449094029     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3055277     Document Type: Article

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