Up versus down alignment and hydration structures of solutes at the airwater interface revealed by heterodyne-detected electronic sum frequency generation with classical molecular dynamics simulation

Journal of Chemical Physics

Volumn 135, Issue 19, 2011, Pages

  Yamaguchi, Shoichi ^a   Watanabe, Hidekazu ^a,b   Mondal, Sudip Kumar ^a,c   Kundu, Achintya ^a   Tahara, Tahei ^a  

^a RIKEN   (Japan)

^b INSTITUTE FOR MOLECULAR SCIENCE   (Japan)

^c Burdwan Raj College   (India)

Author keywords

[No Author keywords available]

Indexed keywords

AIR WATER INTERFACES; CLASSICAL MOLECULAR DYNAMICS; HYDRATION STRUCTURE; MD SIMULATION; SOLUTE MOLECULES; SUM FREQUENCY GENERATION; SUM-FREQUENCY GENERATION SPECTROSCOPY;

ALIGNMENT; DYNAMICS; FUNCTIONAL GROUPS; HETERODYNING; HYDRATION; MOLECULAR DYNAMICS;

MOLECULAR ORIENTATION;

4 NITROANILINE; 4-NITROANILINE; ANILINE DERIVATIVE; WATER;

AIR; ALGORITHM; ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; ELECTRON; MOLECULAR DYNAMICS; SPECTROSCOPY;

AIR; ALGORITHMS; ANILINE COMPOUNDS; ELECTRONS; MOLECULAR DYNAMICS SIMULATION; MOLECULAR STRUCTURE; SPECTRUM ANALYSIS; WATER;

EID: 81855184958     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3662136     Document Type: Article

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