Accurate bond dissociation energy of water determined by triple-resonance vibrational spectroscopy and ab initio calculations

Chemical Physics Letters

Volumn 568-569, Issue , 2013, Pages 14-20

  Boyarkin, Oleg V ^a   Koshelev, Maxim A ^a,b   Aseev, Oleg ^a   Maksyutenko, Pavel ^a   Rizzo, Thomas R ^a   Zobov, Nikolay F ^b   Lodi, Lorenzo ^c   Tennyson, Jonathan ^c   Polyansky, Oleg L ^b,c  

^a EPFL   (Switzerland)

^b INSTITUTE OF APPLIED PHYSICS   (Russian Federation)

^c UNIVERSITY COLLEGE LONDON   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO CALCULATIONS; BOND DISSOCIATION ENERGIES; BORN-OPPENHEIMER APPROXIMATION; DISSOCIATION ENERGIES; HIGH ORDER CORRELATION; THEORETICAL ACCURACY; TRIPLE-RESONANCE; WATER ISOTOPOLOGUES;

BOND STRENGTH (CHEMICAL); VIBRATIONAL SPECTROSCOPY;

CALCULATIONS;

EID: 84876419073     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2013.03.007     Document Type: Article

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