Ultrafast Vibrational Echo Spectroscopy of Liquid Water from First-Principles Simulations

Journal of Physical Chemistry B

Volumn 119, Issue 34, 2015, Pages 11215-11228

  Ojha, Deepak ^a   Chandra, Amalendu ^a  

^a INDIAN INSTITUTE OF TECHNOLOGY KANPUR   (India)

Author keywords

[No Author keywords available]

Indexed keywords

CALCULATIONS; HYDROGEN BONDS; LIQUIDS; MOLECULAR DYNAMICS; PHOTONS; SOLUTIONS;

AB INITIO MOLECULAR DYNAMICS SIMULATION; CLASSICAL MOLECULAR DYNAMICS; FIRST-PRINCIPLES SIMULATIONS; HYDROGEN BONDED LIQUIDS; THEORETICAL CALCULATIONS; THREE-PULSE PHOTON ECHO; TIME CORRELATION FUNCTIONS; TWO-DIMENSIONAL INFRARED (2D IR);

PHOTON CORRELATION SPECTROSCOPY;

WATER;

CHEMISTRY; COMPUTER SIMULATION; INFRARED SPECTROPHOTOMETRY; VIBRATION;

COMPUTER SIMULATION; SPECTROPHOTOMETRY, INFRARED; VIBRATION; WATER;

EID: 84940564060     PISSN: 15206106     EISSN: 15205207     Source Type: Journal    
DOI: 10.1021/acs.jpcb.5b03109     Document Type: Article

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