The shapes of protons in hydrogen bonds depend on the bond length

ChemPhysChem

Volumn 6, Issue 9, 2005, Pages 1738-1741

  Benoit, Magali ^a   Marx, Dominik ^b  

^a CEMES CNRS   (France)

^b RUHR UNIVERSITY BOCHUM   (Germany)

Author keywords

Ab initio calculations; Debye Waller factors; Hydrogen bonds; Ice; Phase transitions

Indexed keywords

BOND LENGTH; CALCULATIONS; ICE; PHASE TRANSITIONS; QUANTUM THEORY;

AB INITIO CALCULATIONS; DEBYE WALLER FACTOR; DONOR-ACCEPTOR DISTANCE; HYDROGEN BONDED SYSTEMS; LIMITING CASE; PATH INTEGRAL; QUANTUM MECHANICAL; TUNNELING REGIME;

HYDROGEN BONDS;

EID: 24944583501     PISSN: 14394235     EISSN: None     Source Type: Journal    
DOI: 10.1002/cphc.200400533     Document Type: Article

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