FNO : another challenging molecule for correlation methods
- Author
- DIBBLE, T. S; FRANCISCO, J. S
Wayne State univ., dep. chemistry, Detroit MI 48202, United States - Source
The Journal of chemical physics. 1993, Vol 99, Num 1, pp 397-402 ; ref : 29 ref
- CODEN
- JCPSA6
- ISSN
- 0021-9606
- Scientific domain
- Atomic molecular physics; Condensed state physics; Polymers, paint and wood industries
- Publisher
- American Institute of Physics, Woodbury, NY
- Publication country
- United States
- Document type
- Article
- Language
- English
- Keyword (fr)
- Angle liaison Composé minéral Conformation Corrélation électronique Energie totale Etude théorique Interaction configuration Longueur liaison Molécule triatomique Moment dipolaire Méthode SD CI Méthode ab initio Méthode amas couplé Nitrosyle Fluorure Partition Moller Plesset
- Keyword (en)
- Bond angle Inorganic compound Conformation Electron correlation Total energy Theoretical study Configuration interaction Bond length Triatomic molecule Dipole moment SD CI method Ab initio method Coupled cluster method Nitrosyl Fluorides Moller Plesset partition
- Keyword (es)
- Angulo enlace Compuesto inorgánico Conformación Correlación electrónica Energía total Estudio teórico Interacción configuración Longitud enlace Molécula triatómica Momento dipolar Método SD CI Método ab initio Método conglomerado acoplado Nitrosilo Fluoruro Partición Moller Plesset
- Classification
- Pascal
- 001 Exact sciences and technology / 001B Physics / 001B30 Atomic and molecular physics / 001B30A Electronic structure of atoms, molecules and their ions: theory / 001B30A25 Electron correlation calculations for atoms and molecules
- Discipline
- Atomic and molecular physics
- Origin
- Inist-CNRS
- Database
- PASCAL
- INIST identifier
- 4792549
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
10.1063/1.465763 
https://dx.doi.org/10.1063/1.465763
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