Molecular dynamics and trajectory calculations : the application of an LCAO-LDA scheme for simulatins of cluster-cluster collisions
- Author
- SEIFERT, G; SCHMIDT, R
Inst. Festkörperforschung, Forschungszent. Jülich, W-5170 Jülich, Germany - Conference title
- Applications of density functional theory in chemistry and physics. International conference
- Conference name
- Applications of density functional theory in chemistry and physics. International conference (4 ; Ascona 1991-09-24)
- Author (monograph)
- WEBER, Jacques (Editor)
Univ. Genève, dep. chimie physique, 1211 Genève, Switzerland - Source
New journal of chemistry (1987). 1992, Vol 16, Num 12, pp 1145-1147 ; ref : 17 ref
- CODEN
- NJCHE5
- ISSN
- 1144-0546
- Scientific domain
- Biochemistry, molecular biology, biophysics; Chemistry
- Publisher
- CNRS, Paris
/
Royal Society of Chemistry, Cambridge
- Publication country
- France
- Document type
- Conference Paper
- Language
- English
- Keyword (fr)
- Agrégat moléculaire Application Dynamique moléculaire Etude théorique Fonction onde Méthode LCAO Sodium Molécule Trajectoire
- Keyword (en)
- Molecular cluster Application Molecular dynamics Theoretical study Wave function LCAO method Sodium Molecules Trajectory
- Keyword (es)
- Agregado molecular Aplicación Dinámica molecular Estudio teórico Función onda Método LCAO Sodio Molécula Trayectoria
- Classification
- Pascal
- 001 Exact sciences and technology / 001B Physics / 001B30 Atomic and molecular physics / 001B30A Electronic structure of atoms, molecules and their ions: theory / 001B30A15 Calculations and mathematical techniques in atomic and molecular physics (excluding electron correlation calculations) / 001B30A15A Ab initio calculations
- Discipline
- Atomic and molecular physics
- Origin
- Inist-CNRS
- Database
- PASCAL
- INIST identifier
- 4710489
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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