Fluorescence of PRODAN in water: A computational QM/MM MD study

Chemical Physics Letters

Volumn 597, Issue , 2014, Pages 57-62

  Pederzoli, Marek ^a   Sobek, Lukáš ^a   Brabec, Jiří ^a   Kowalski, Karol ^b   Cwiklik, Lukasz ^a   Pittner, Jiří ^a  

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

^b PACIFIC NORTHWEST NATIONAL LABORATORY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EMISSION SPECTROSCOPY; EXCITED STATES; MOLECULAR DYNAMICS; POLARIZATION; QUANTUM THEORY;

COMPUTATIONAL SCHEMES; EXPLICIT WATER MOLECULES; FLUORESCENT PROPERTY; MOLECULAR DYNAMICS SIMULATIONS; MOLECULAR MECHANICALS; SOLVATOCHROMIC SHIFTS; SOLVENT ENVIRONMENTS; TIME DEPENDENT DENSITY FUNCTIONAL THEORY;

FLUORESCENCE;

EID: 84896292201     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2014.02.031     Document Type: Article

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