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A MOLECULAR ORBITAL STUDY OF THE HYDRATION OF IONS: THE ROLE OF NONADDITIVE EFFECTS IN THE HYDRATION SHELLS AROUND MG2+ AND CA2+

Author
ORTEGA BLAKE I; NOVARO O; LES A; RYBAK S
UNIV. NACIONAL AUTONOMA MEXICO, INST. FIS./MEXICO 01000 DF/MEX
Source
J. CHEM. PHYS.; ISSN 0021-9606; USA; DA. 1982; VOL. 76; NO 11; PP. 5405-5413; BIBL. 28 REF.
Document type
Article
Language
English
Keyword (fr)
ETUDE THEORIQUE METHODE AB INITIO METHODE SCF MO PSEUDOPOTENTIEL ION POSITIF ION MULTICHARGE CONFIGURATION GEOMETRIQUE ENERGIE INTERACTION COMPOSE MINERAL MOLECULE TRIATOMIQUE INTERACTION INTERMOLECULAIRE SOLVATATION METAL GROUPE IIA ION ATOMIQUE EAU MAGNESIUM ION ATOMIQUE CALCIUM ION ATOMIQUE PHYSIQUE MOLECULAIRE PHYSIQUE ATOMIQUE
Keyword (en)
THEORETICAL STUDY AB INITIO METHOD SCF MO METHOD PSEUDOPOTENTIAL POSITIVE ION MULTICHARGED ION GEOMETRICAL CONFIGURATION INTERACTION ENERGY INORGANIC COMPOUND TRIATOMIC MOLECULE INTERMOLECULAR INTERACTION SOLVATION GROUP IIA METAL ATOMIC IONS WATER MAGNESIUM ATOMIC IONS CALCIUM ATOMIC IONS MOLECULAR PHYSICS ATOMIC PHYSICS
Keyword (es)
FISICA MOLECULAR FISICA ATOMICA
Classification
Pascal
001 Exact sciences and technology / 001B Physics / 001B30 Atomic and molecular physics

Discipline
Atomic and molecular physics
Origin
Inist-CNRS
Database
PASCAL
INIST identifier
PASCAL83X0011343

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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