Comparison of the polarizabilities and hyperpolarizabilities obtained from finite basis set and finite difference Hartree-Fock calculations for diatomic molecules: III. The ground states of N2, CO and BF
- Author
- KOBUS, J1 ; MONCRIEFF, D2 ; WILSON, S3
[1] Instytut Fizyki, Uniwersytet Mikolaja Kopemika, ul. Grudziadzka 5/7, 87-100 Toruri, Poland
[2] School of Computational Science and Information Technology, Florida State University, Tallahassee, FL 32306, United States
[3] Department of Chemical Physics, Faculty of Mathematics and Physics, Comenius University, 842 15 Bratislava, Slovakia - Source
Journal of physics. B. Atomic, molecular and optical physics (Print). 2007, Vol 40, Num 5, pp 877-896, 20 p ; ref : 111 ref
- CODEN
- JPAPEH
- ISSN
- 0953-4075
- Scientific domain
- Atomic molecular physics
- Publisher
- Institute of Physics, Bristol
- Publication country
- United Kingdom
- Document type
- Article
- Language
- English
- Keyword (fr)
- Azote molécule Bore fluorure Calcul Hartree Fock Carbone monoxyde Composé minéral Dipôle électrique Etat fondamental Etude comparative Etude théorique Hyperpolarisabilité électrique Modèle Hartree Fock Molécule diatomique Moment dipolaire Méthode différence finie Polarisabilité électrique Théorie Hartree Fock 3315K B F BF CO N2
- Keyword (en)
- Nitrogen molecules Boron fluorides Hartree-Fock calculations Carbon monoxide Inorganic compounds Electric dipoles Ground states Comparative study Theoretical study Electric hyperpolarizability Hartree Fock model Diatomic molecules Dipole moments Finite difference method Electric polarizability Hartree Fock theory
- Keyword (es)
- Estudio comparativo Hiperpolarizabilidad eléctrica Modelo Hartree Fock Polarizabilidad eléctrica Teoría Hartree Fock
- Classification
- Pascal
- 001 Exact sciences and technology / 001B Physics / 001B30 Atomic and molecular physics / 001B30C Molecular properties and interactions with photons / 001B30C15 Properties of molecules and molecular ions / 001B30C15K Electric and magnetic moments (and derivatives), polarizability and magnetic susceptibility
- Discipline
- Atomic and molecular physics
- Origin
- Inist-CNRS
- Database
- PASCAL
- INIST identifier
- 18573843
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
10.1088/0953-4075/40/5/005 
https://dx.doi.org/10.1088/0953-4075/40/5/005
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