Electronic structure of the water dimer cation

Journal of Physical Chemistry A

Volumn 112, Issue 27, 2008, Pages 6159-6170

  Pieniazek, Piotr A ^a   Vandevondele, Joost ^b   Jungwirth, Pavel ^c   Krylov, Anna I ^a   Bradford, Stephen E ^a  

^a UNIVERSITY OF SOUTHERN CALIFORNIA   (United States)

^b UNIVERSITY OF ZURICH   (Switzerland)

^c INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY   (Czech Republic)

Author keywords

[No Author keywords available]

Indexed keywords

) ELECTRONIC STATE; AB INITIO CALCULATIONS; CHARGE-TRANSFER BANDS; DIMER STATES; ELECTRONIC SPECTRUM; EQUATION-OF-MOTION COUPLED-CLUSTER; FEMTOSECOND SPECTROSCOPY; MOLECULAR ORBITAL; REACTION COORDINATE; SELF-INTERACTION CORRECTION; SPECTROSCOPIC SIGNATURES; TIME-RESOLVED; WATER DIMERS;

CHLORINE COMPOUNDS; DENSITY FUNCTIONAL THEORY; ELECTRONIC STRUCTURE; EQUATIONS OF MOTION; EQUATIONS OF STATE; IONIZATION OF LIQUIDS; MOLECULAR ORBITALS; MONOMERS; POSITIVE IONS; PROBABILITY DENSITY FUNCTION; PROTONS;

PROTON TRANSFER;

CATION; PROTON; WATER;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; DIMERIZATION; ELECTRON; SPECTROPHOTOMETRY;

CATIONS; DIMERIZATION; ELECTRONS; MODELS, MOLECULAR; PROTONS; SPECTROPHOTOMETRY; WATER;

EID: 49149107206     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp802140c     Document Type: Article

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