A benchmark coupled-cluster single, double, and triple excitation (CCSDT) study of the structure and harmonic vibrational frequencies of the ozone molecule
- Author
- WATTS, J. D; STANTON, J. F; BARTLETT, R. J
Univ. Florida, dep. chemistry, quantum theory project, Gainesville FL 32611-2085, United States - Source
Chemical physics letters. 1991, Vol 178, Num 5-6, pp 471-474, 4 p ; ref : 25 ref
- CODEN
- CHPLBC
- ISSN
- 0009-2614
- Scientific domain
- General chemistry, physical chemistry; Atomic molecular physics; Condensed state physics
- Publisher
- Elsevier Science, Amsterdam
- Publication country
- Netherlands
- Document type
- Article
- Language
- English
- Keyword (fr)
- Composé minéral Conformation Etude théorique Fonction polarisation Harmonique Molécule triatomique Méthode amas couplé Méthode calcul Orbitale gaussienne contractée Ozone Transition vibrationnelle Méthode CCSDT
- Keyword (en)
- Inorganic compound Conformation Theoretical study Polarization function Harmonic Triatomic molecule Coupled cluster method Calculating method Contracted gaussian orbital Ozone Vibrational transition
- Keyword (es)
- Compuesto inorgánico Conformación Estudio teórico Función polarización Armónica Molécula triatómica Método conglomerado acoplado Método cálculo Orbital gaussiano contractado Ozono Transición vibracional
- Classification
- Pascal
- 001 Exact sciences and technology / 001B Physics / 001B30 Atomic and molecular physics / 001B30C Molecular properties and interactions with photons / 001B30C20 Molecular spectra
- Discipline
- Atomic and molecular physics
- Origin
- Inist-CNRS
- Database
- PASCAL
- INIST identifier
- 19620873
Sauf mention contraire ci-dessus, le contenu de cette notice bibliographique peut être utilisé dans le cadre d’une licence CC BY 4.0 Inist-CNRS / Unless otherwise stated above, the content of this bibliographic record may be used under a CC BY 4.0 licence by Inist-CNRS / A menos que se haya señalado antes, el contenido de este registro bibliográfico puede ser utilizado al amparo de una licencia CC BY 4.0 Inist-CNRS
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DOI
10.1016/0009-2614(91)87004-U 
https://dx.doi.org/10.1016/0009-2614(91)87004-U
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