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kw.\*:("METHODE ELECTRON VALENCE")

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AN APPROXIMATE MOLECULAR ORBITAL METHOD.ZERNER M.1975; J. CHEM. PHYS.; U.S.A.; DA. 1975; VOL. 62; NO 7; PP. 2788-2799; BIBL. 45 REF.Article

ATOMIC AND MOLECULAR CALCULATIONS WITH THE MODEL POTENTIAL METHOD. II.BONIFACIC V; HUZINAGA S.1975; J. CHEM. PHYS.; U.S.A.; DA. 1975; VOL. 62; NO 4; PP. 1507-1508; BIBL. 1 REF.Article

ATOMIC AND MOLECULAR CALCULATIONS WITH THE MODEL POTENTIAL METHOD. III.BONIFACIC V; HUZINAGA S.1975; J. CHEM. PHYS.; U.S.A.; DA. 1975; VOL. 62; NO 4; PP. 1509-1512; BIBL. 4 REF.Article

MATRIX ELEMENTS IN ALL VALENCE ELECTRON MODELS.LINDERBERG J; SEAMANS L.1974; INTERNATION. J. QUANTUM CHEM.; U.S.A.; DA. 1974; VOL. 8; NO 6; PP. 925-940; ABS. FR. ALLEM.; BIBL. 1 P.Article

NON ORTHOGONAL ATOMIC ORBITALS.CUSACHS LC.1975; CHEM. PHYS. LETTERS; NETHERL.; DA. 1975; VOL. 31; NO 1; PP. 154-156; BIBL. 8 REF.Article

CONFORMATIONAL ANALYSIS. CIV. STRUCTURES, ENERGIES, AND ELECTRONIC ABSORPTION SPECTRA OF THE (N) PARACYCLOPHANES.ALLINGER NL; SPRAGUE JT; LILJEFORS T et al.1974; J. AMER. CHEM. SOC.; U.S.A.; DA. 1974; VOL. 96; NO 16; PP. 5100-5104; BIBL. 21 REF.Article

EFFECT OF BASIS ORBITAL ON SELECTED VALENCE ELECTRON CALCULATIONS OF FLUORINE AND HYDROGEN FLUORIDE MOLECULES.SANNIGRAHI AB; NOOR MOHAMMAD S.1975; INDIAN J. CHEM.; INDIA; DA. 1975; VOL. 13; NO 5; PP. 496-497; BIBL. 18 REF.Article

NON-EMPIRICAL VALENCE-ELECTRON MOLECULAR ORBITAL CALCULATIONS. THE NEVE METHOD FOR FIRST-ROW DIATOMIC MOLECULES.PEEL JB.1974; AUSTRAL. J. CHEM.; AUSTRAL.; DA. 1974; VOL. 27; NO 5; PP. 923-931; BIBL. 15 REF.Article

MOLEKULARE POTENTIALFELDER VON POLYMETHINFARBSTOFFEN. = CHAMPS DE POTENTIEL MOLECULAIRES DE COLORANTS POLYMETHINIQUESGRIMM B.1974; Z. CHEM.; DTSCH.; DA. 1974; VOL. 14; NO 7; PP. 277-278; BIBL. 9 REF.Article

APPROXIMATE MOLECULAR ORBITAL THEORY: THE ESE MO FORMALISM. III. PARAMETRIZATION FOR ALL- OR VALENCE-ELECTRON CALCULATIONS USING ACCURATE STF BASES FOR MOLECULES CONTAINING 1ST, 2ND AND 3RD ROW ATOMS. SO2 RESULTS.BURTON PG.1974; CHEM. PHYS.; NETHERL.; DA. 1974; VOL. 6; NO 3; PP. 419-430; BIBL. 40 REF.Article

INNER-SHELL EIGENVALUES FROM VALENCE ORBITAL ONLY CALCULATIONS.HARTMAN A; ZERNER MC.1975; THEOR. CHIM. ACTA; ALLEM.; DA. 1975; VOL. 37; NO 1; PP. 47-65; BIBL. 1 P. 1/2Article

ACCURACY AND LIMITATIONS OF THE PSEUDOPOTENTIAL METHOD.CHANG TC; HABITZ P; PITTEL B et al.1974; THEOR. CHIM. ACTA; ALLEM.; DA. 1974; VOL. 34; NO 4; PP. 263-275; BIBL. 20 REF.Article

NONCLASSICAL TERMS IN THE TRUE EFFECTIVE VALENCE SHELL HAMILTONIAN: A SECOND QUANTIZED FORMALISM.IWATA S; FREED KF.1976; J. CHEM. PHYS.; U.S.A.; DA. 1976; VOL. 65; NO 3; PP. 1071-1088; BIBL. 41 REF.Article

FIRST PRINCIPLES DERIVATION OF THE EFFECTIVE VALENCE SHELL HAMILTONIAN FOR LARGE MOLECULES.WESTHAUS P; BRADFORD EG; HALL D et al.1975; J. CHEM. PHYS.; U.S.A.; DA. 1975; VOL. 62; NO 5; PP. 1607-1622; BIBL. 15 REF.Article

SUR LA DEFINITION D'UN INDICE DE LIAISON (TEV) POUR DES BASES NON ORTHOGONALES. PROPRIETES ET APPLICATIONS.GIAMBIAGI M; GIAMBIAGI M; GIAMBIAGI M; GIAMBIAGI M; GREMPEL DR et al.1975; J. CHIM. PHYS. PHYS.-CHIM. BIOL.; FR.; DA. 1975; VOL. 72; NO 1; PP. 15-22; ABS. ANGL.; BIBL. 29 REF.Article

ALL-VALENCE-ELECTRON CONFIGURATION MIXING CALCULATIONS FOR THE CHARACTERIZATION OF THE 1(PI ,PI *) STATES OF ETHYLENE.BUENKER RJ; PEYERIMHOFF SD.1975; CHEM. PHYS.; NETHERL.; DA. 1975; VOL. 9; NO 1-2; PP. 75-89; BIBL. 43 REF.Article

GENERALIZED PERTURBATION THEORY OF EFFECTIVE VALENCE SHELL HAMILTONIANSSHEPPARD MG; FREED KF; HERMAN MF et al.1979; CHEM. PHYS. LETTERS; NLD; DA. 1979; VOL. 61; NO 3; PP. 577-582; BIBL. 25 REF.Article

A GENERAL PSEUDOPOTENTIAL MODEL FOR MOLECULES WITH MANY VALENCE ELECTRONS.DIXON RN; HUGO JMV.1975; MOLEC. PHYS.; G.B.; DA. 1975; VOL. 29; NO 3; PP. 953-970; BIBL. 39 REF.Article

A CONSISTENT SEMIEMPIRICAL THEORY FOR THE CALCULATION OF GROUND AND EXCITED STATE PROPERTIESDINUR U; HONIG B.1980; J. CHEM. PHYS.; ISSN 0021-9606; USA; DA. 1980; VOL. 72; NO 3; PP. 1817-1829; BIBL. 33 REF.Article

ONE-CENTER TWO ELECTRON REPULSION PARAMETERS ON THE PI AND ALL-VALENCE SEMI-EMPIRICAL THEORIESIWATA S.1978; CHEM. PHYS. LETTERS; NLD; DA. 1978; VOL. 57; NO 2; PP. 247-252; BIBL. 12 REF.Article

VALENCE-ELECTRON THEORY USING THE THOMAS-FERMI-DIRAC MODEL: APPLICATION TO THE K ATOM AND THE K- ION.GOODISMAN J.1976; INTERNATION. J. QUANTUM CHEM.; U.S.A.; DA. 1976; VOL. 10; NO 2; PP. 341-358; ABS. FR. ALLEM.; BIBL. 1 P. 1/2Article

A COMPARISON OF THE SIMULATED AB INITIO MOLECULAR ORBITAL (SAMO) METHOD WITH THE METHOD OF TRANSFERABILITY OF ATOMIC POTENTIALSDUKE BJ; O'LEARY B.1982; J. CHEM. PHYS.; ISSN 0021-9606; USA; DA. 1982; VOL. 77; NO 5; PP. 2693-2694; BIBL. 7 REF.Article

AN MRD-CI STUDY OF THE VERTICAL 1(PI ,PI *) V-N TRANSITION OF ETHYLENE USING AN AO BASIS WITH OPTIMIZED RYDBERG NDPI SPECIES AND TWO SEPARATE CARBON D POLARIZATION FUNCTIONSBUENKER RJ; SHIH SK; PEYERIMHOFF SD et al.1979; CHEM. PHYS.; NLD; DA. 1979; VOL. 36; NO 1; PP. 97-111; BIBL. 36 REF.Article

A NOTE ON THE IMPORTANCE OF D ORBITALS IN THE CALCULATION OF EFFECTIVE INTERACTIONS AND THE EXCITATION SPECTRA OF ATOMS AND MOLECULES.CHERNG S; WESTHAUS P.1977; INTERNATION. J. QUANTUM CHEM.; U.S.A.; DA. 1977; VOL. 12; NO 1; PP. 193-205; ABS. FR. ALLEM.; BIBL. 13 REF.Article

AN N2O4 ISOMER AS A MODEL FOR THE EXAMINATION OF THE ORIGIN OF THE ANTIFERROMAGNETISM OF THE COPPER ACETATE MONOHYDRATE DIMER.HARCOURT RD.1974; AUSTRAL. J. CHEM.; AUSTRAL.; DA. 1974; VOL. 27; NO 10; PP. 2065-2073; BIBL. 18 REF.Article

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