THE PROPERTIES OF THE METAL COMPLEX HYDRIDES. AB INITIO CALCULATION OF GEOMETRIC STRUCTURE, ELECTRONIC CHARGE DISTRIBUTION AND BINDING ENERGY OF LIBH4, NABH4, LIALH4, AN NAALH4
- Author
- BONACCORSI R; SCROCCO E; TOMASI J
C.N.R., LAB. CHIM. QUANTIST. ENERGET. MOLECOLURE,PISA 56100,ITA - Source
- THEOR. CHIM. ACTA; DEU; DA. 1979; VOL. 52; NO 2; PP. 113-127; BIBL. 23 REF.
- Document type
- Article
- Language
- English
- Keyword (fr)
- METAL ALCALIN COMPOSE ALUMINIUM COMPOSE HYDRURE HYDROBORATE CONFORMATION DISTRIBUTION CHARGE ELECTRONIQUE LIAISON CHIMIQUE ENERGIE LIAISON MOLECULE PETITE ETUDE THEORIQUE METHODE AB INITIO METHODE SCF LCAO MO ORBITALE GAUSSIENNE DIMENSION BASE SURFACE POTENTIEL REACTIVITE POTENTIEL ELECTRIQUE LITHIUM TETRAHYDROBORATE SODIUM TETRAHYDROBORATE LITHIUM TETRAHYDROALUMINATE SODIUM TETRAHYDROALUMINATE PHYSIQUE ATOMIQUE PHYSIQUE MOLECULAIRE
- Keyword (en)
- ALKALI METAL COMPOUND ALUMINIUM COMPOUND HYDRIDES HYDROBORATES CONFORMATION ELECTRON CHARGE DISTRIBUTION CHEMICAL BOND BINDING ENERGY SMALL MOLECULE THEORETICAL STUDY AB INITIO METHOD SCF LCAO MO METHOD GAUSSIAN ORBITAL BASIS SET SIZE POTENTIAL SURFACE REACTIVITY ELECTRIC POTENTIAL ATOMIC PHYSICS MOLECULAR PHYSICS
- Keyword (es)
- FISICA ATOMICA FISICA MOLECULAR
- Classification
- Discipline
- Atomic and molecular physics
- Origin
- Inist-CNRS
- Database
- PASCAL
- INIST identifier
- PASCAL8040089914
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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