Electronic excitation and singlet-triplet coupling in uracil tautomers and uracil-water complexes: A quantum chemical investigation

European Physical Journal D

Volumn 20, Issue 3, 2002, Pages 357-367

  Marian, C M ^a   Schneider, F ^a   Kleinschmidt, M ^a   Tatchen, J ^a  

^a HEINRICH HEINE UNIVERSITY   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

AROMATIC COMPOUNDS; EXCITED STATES; HYDROGEN BONDS; MOLECULES; QUANTUM CHEMISTRY;

CONFIGURATION INTERACTION METHOD; DENSITY FUNCTIONALS; EFFECT OF HYDROGEN; ELECTRONIC EXCITATION; ELECTRONIC SPECTRUM; FUNCTIONAL INTERACTION; QUANTUM CHEMICAL INVESTIGATION; SINGLET-TRIPLET; TAUTOMERIC FORMS; WATER COMPLEXES;

GROUND STATE;

EID: 0036769046     PISSN: 14346060     EISSN: None     Source Type: Journal    
DOI: 10.1140/epjd/e2002-00158-3     Document Type: Article

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