The vibrational frequencies of CaO 2, ScO 2, and TiO 2: A comparison of theoretical methods

Theoretical Chemistry Accounts

Volumn 99, Issue 2, 1998, Pages 106-112

  Rosi, Marzio ^a,c   Bauschlicher, Charles W ^a   Chertihin, George V ^b   Andrews, Lester ^b  

^a NASA AMES RESEARCH CENTER   (United States)

^b UNIVERSITY OF VIRGINIA   (United States)

^c UNIVERSITY OF PERUGIA   (Italy)

Author keywords

Coupled cluster singles and doubles; Density functional theory; Harmonic frequencies

Indexed keywords

EID: 0032395960     PISSN: 1432881X     EISSN: None     Source Type: Journal    
DOI: 10.1007/s002140050311     Document Type: Article

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