Structural investigation of asymmetrical dimer radical cation system (H2O-H2S)+: Proton-transferred or hemi-bonded?

Journal of Physical Chemistry A

Volumn 111, Issue 12, 2007, Pages 2362-2367

  Joshi, Ravi ^a   Ghanty, Tapan K ^a   Naumov, Sergej ^b   Mukherjee, Tulsi ^a  

^a BHABHA ATOMIC RESEARCH CENTRE   (India)

^b LEIBNIZ INSTITUTE OF SURFACE ENGINEERING IOM   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

DENSITY FUNCTIONAL THEORY; FREE RADICALS; HYDROGEN BONDS; MOLECULAR ORBITALS; PROTON TRANSFER;

CATION SYSTEMS; HEMI-BONDED SYSTEM; PROTON ACCEPTORS; SUPERPOSITION ERROR;

DIMERS;

CATION; FREE RADICAL; HYDROGEN SULFIDE; PROTON; WATER;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; CONFORMATION; DIMERIZATION; HYDROGEN BOND; STEREOISOMERISM; VIBRATION;

CATIONS; DIMERIZATION; FREE RADICALS; HYDROGEN BONDING; HYDROGEN SULFIDE; MODELS, MOLECULAR; MOLECULAR CONFORMATION; PROTONS; STEREOISOMERISM; VIBRATION; WATER;

EID: 34147126402     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp067757i     Document Type: Article

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