A NEW GENERAL METHODOLOGY FOR DERIVING EFFECTIVE HAMILTONIANS FOR ATOMS AND MOLECULES: APPLICATION TO THE TRANSFERABILITY OF ATOMIC POTENTIALS IN THE HYDROCARBON SERIES
- Author
- NICOLAS G; DURAND P
UNIV. PAUL SABATIER, LAB. PHYS. QUANT.,TOULOUSE 31077,FRA - Source
- J. CHEM. PHYS.; ISSN 0021-9606; USA; DA. 1980; VOL. 72; NO 1; PP. 453-463; BIBL. 26 REF.
- Document type
- Article
- Language
- English
- Keyword (fr)
- ATOME MOLECULE STRUCTURE ELECTRONIQUE HAMILTONIEN EFFECTIF PSEUDOPOTENTIEL TRANSFERABILITE ETUDE THEORIQUE HYDROCARBURE ALIPHATIQUE SATURE HYDROCARBURE ALIPHATIQUE ETHYLENIQUE HYDROCARBURE BENZENIQUE NIVEAU ENERGIE ELECTRONIQUE METHANE ETHANE PROPANE BUTANE ISOBUTANE BUTADIENE-1,3 ETHYLENE HEXATRIENE-1,3,5 BENZENE COMPOSE ORGANIQUE PHYSIQUE ATOMIQUE PHYSIQUE MOLECULAIRE
- Keyword (en)
- ATOMS MOLECULES ELECTRONIC STRUCTURE EFFECTIVE HAMILTONIAN PSEUDOPOTENTIAL TRANSFERABILITY THEORETICAL STUDY ELECTRON ENERGY LEVEL METHANE ETHANE PROPANE BUTANE ISOBUTANE 1,3-BUTADIENE ETHYLENE BENZENE ORGANIC COMPOUNDS ATOMIC PHYSICS MOLECULAR PHYSICS
- Keyword (es)
- FISICA ATOMICA FISICA MOLECULAR
- Classification
- Discipline
- Atomic and molecular physics
- Origin
- Inist-CNRS
- Database
- PASCAL
- INIST identifier
- PASCAL8040224478
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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