Coupled cluster investigation on the low-lying electronic states of CuCN and CuNC and the ground state barrier to isomerization

Journal of Chemical Physics

Volumn 127, Issue 15, 2007, Pages

  Paul, Ankan ^a   Yamaguchi, Yukio ^a   Schaefer III, Henry F ^a  

^a UNIVERSITY OF GEORGIA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ELECTRONIC STATES; EXCITED STATES; GROUND STATE; ISOMERIZATION; MOLECULAR STRUCTURE; VIBRATIONAL SPECTRA;

HARMONIC VIBRATIONAL FREQUENCIES; INTERSTELLAR SPACE; ISOCYANIDES; METAL CYANIDES;

CYANIDES;

EID: 39349094387     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2784393     Document Type: Article

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