Direct evaluation of nonbonding interactions from ab initio calculations
- Author
- DINUR, U; HAGLER, A. T
Biosym Technologies inc., San Diego CA 92121, United States - Source
Journal of the American Chemical Society. 1989, Vol 111, Num 14, pp 5149-5151, 3 p ; ref : dissem
- CODEN
- JACSAT
- ISSN
- 0002-7863
- Scientific domain
- Biochemistry, molecular biology, biophysics; Chemistry; Organic chemistry; Atomic molecular physics
- Publisher
- American Chemical Society, Washington, DC
- Publication country
- United States
- Document type
- Article
- Language
- English
- Keyword (fr)
- Composé organique Etude théorique Interaction interatomique Interaction intermoléculaire Méthode ab initio Méthode calcul
- Keyword (en)
- Organic compounds Theoretical study Interatomic interaction Intermolecular interaction Ab initio method Calculating method
- Keyword (es)
- Compuesto orgánico Estudio teórico Interacción interatómica Interacción intermolecular Método ab initio Método cálculo
- Classification
- Pascal
- 001 Exact sciences and technology / 001B Physics / 001B30 Atomic and molecular physics / 001B30A Electronic structure of atoms, molecules and their ions: theory / 001B30A70 Effects of atomic and molecular interactions on electronic structure / 001B30A70D Environmental and solvent effects
- Discipline
- Atomic and molecular physics
- Origin
- Inist-CNRS
- Database
- PASCAL
- INIST identifier
- 19721299
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
10.1021/ja00196a021 
https://dx.doi.org/10.1021/ja00196a021
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