Theoretical study of the electronic-vibrational coupling in the Q y states of the photosynthetic reaction center in purple bacteria

Journal of Physical Chemistry B

Volumn 116, Issue 3, 2012, Pages 1164-1171

  Jing, Yuanyuan ^a   Zheng, Renhui ^a   Li, Hui Xue ^a   Shi, Qiang ^a  

^a INSTITUTE OF CHEMISTRY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

BACTERIA; CHROMOPHORES; DYNAMICS; EXCITATION ENERGY; MOLECULAR DYNAMICS; PHOTOSYNTHESIS; QUANTUM CHEMISTRY; REACTION KINETICS; SPECTRAL DENSITY;

BACTERIOCHLOROPHYLLS; ELECTRONIC-VIBRATIONAL COUPLING; ENERGY FLUCTUATION; HUANG-RHYS FACTORS; INHOMOGENEOUS BROADENING; INTRAMOLECULAR VIBRATIONAL MODES; LARGE AMPLITUDE; MD SIMULATION; MOLECULAR DYNAMICS SIMULATIONS; NORMAL MODE ANALYSIS; PARTIAL CHARGES; PHOTOSYNTHETIC REACTION CENTER; PURPLE BACTERIA; QUANTUM CHEMISTRY CALCULATIONS; SPHAEROIDES; STATIC DISORDER; THEORETICAL STUDY; TIME DEPENDENT DENSITY FUNCTIONAL THEORY; TIME-SCALES; TRANSITION ENERGY; ZINDO/S;

DENSITY FUNCTIONAL THEORY;

EID: 84863012831     PISSN: 15206106     EISSN: 15205207     Source Type: Journal    
DOI: 10.1021/jp209575q     Document Type: Article

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