Identification and treatment of internal rotation in normal mode vibrational analysis

Journal of Chemical Physics

Volumn 108, Issue 6, 1998, Pages 2314-2325

  Ayala, Philippe Y ^a   Schlegel, H Bernhard ^a  

^a WAYNE STATE UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

APPROXIMATION THEORY; CHEMICAL BONDS; EIGENVALUES AND EIGENFUNCTIONS; MOLECULAR VIBRATIONS; NUMERICAL ANALYSIS; STATISTICAL MECHANICS;

INTERNAL ROTATION MODES; THERMODYNAMIC FUNCTIONS;

CONFORMATIONS;

EID: 0032495626     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.475616     Document Type: Article

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