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kw.\*:("THEORIE HARTREE FOCK SANS CONTRAINTE")

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MATRICE DENSITE EN DEUX PARTIES DANS LA METHODE DE HARTREE-FOCK SANS CONTRAINTE AVEC ANNIHILATION DES MULTIPLETS VOISINSLUZANOV AV; KULIBABA NS.1974; TEOR. EKSPER. KHIM., U.S.S.R.; S.S.S.R.; DA. 1974; VOL. 10; NO 2; PP. 147-154; BIBL. 7 REF.Article

ON THE DERIVATION OF THE HARTREE-FOCK EQUATIONS. III. INTRODUCTION OF THE LCAO FORMALISM.MAYER I.1974; ACTA PHYS. ACAD. SCI. HUNGAR.; HONGR.; DA. 1974; VOL. 36; NO 1; PP. 11-17; BIBL. 6 REF.Article

THE ORBITAL SPLITTING PATTERNS FOR THE FIRST AND SECOND-ROW ELEMENTS.MACDONALD JR; GOLDING RM.1976; MOLEC. PHYS.; G.B.; DA. 1976; VOL. 31; NO 4; PP. 1247-1259; BIBL. 25 REF.Article

MULTIPLET SPLITTING AND INTENSITY RATIO IN THE N(1S) PHOTOEMISSION SPECTRUM OF NO.HILLIER IH; KENDRICK J.1975; J. CHEM. SOC., FARADAY TRANS., 2; G.B.; DA. 1975; VOL. 71; NO 9; PP. 1654-1656; BIBL. 12 REF.Article

THE UNRESTRICTED HARTREE-FOCK THEORY OF CHEMICAL REACTIONS. V. THE REACTION OF THREE HYDROGENS IN ISOSCELES TRIANGULAR CONFORMATIONS.YAMAGUCHI K; FUKUTOME H.1975; PROGR. THEOR. PHYS.; JAP.; DA. 1975; VOL. 54; NO 6; PP. 1599-1615Article

SPIN PROJECTION OF SINGLE DETERMINANT WAVEFUNCTIONS.PHILLIPS DH; SCHUG JC.1974; J. CHEM. PHYS.; U.S.A.; DA. 1974; VOL. 61; NO 3; PP. 1031-1039; BIBL. 16 REF.Article

ELECTRON PROPAGATOR CALCULATIONS OF THE PHOTOELECTRON SPECTRUM FOR OPEN SHELL MOLECULES WITH APPLICATIONS TO THE OXYGEN MOLECULE.PURVIS GD; OEHRN Y.1975; J. CHEM. PHYS.; U.S.A.; DA. 1975; VOL. 62; NO 6; PP. 2045-2049; BIBL. 18 REF.Article

M NONOLLER-PLESSET THEORY FOR ATOMIC GROUND STATE ENERGIES.BINKELY JS; POPLE JA.1975; INTERNATION. J. QUANTUM CHEM.; U.S.A.; DA. 1975; VOL. 9; NO 2; PP. 229-236; ABS. FR. ALLEM.; BIBL. 15 REF.Article

PROGRESS IN THE CALCULATION OF FREE ATOM HFS.LINDGREN I.1975; PHYS. SCRIPTA; SUEDE; DA. 1975; VOL. 11; NO 3-4; PP. 111-116; BIBL. 22 REF.Article

INTERACTION SPIN-SPIN A LONGUE DISTANCE A L'APPROXIMATION M-ELECTRONIQUE DU CHAMP AUTOCOHERENTVYSOTSKIJ YU B; LUZANOV AV.1975; ZH. STRUKT. KHIM.; S.S.S.R.; DA. 1975; VOL. 16; NO 2; PP. 195-201; BIBL. 19 REF.Article

AB INITIO UNRESTRICTED HARTREE-FOCK CALCULATIONS. IX. HYPERFINE COUPLING CONSTANTS IN THE ETHYL RADICAL.CLAXTON TA; OVERILL RE.1974; J. CHEM. SOC., FARADAY TRANS., 2; G.B.; DA. 1974; VOL. 70; NO 6; PP. 1005-1009; BIBL. 19 REF.Article

GROUP THEORETICAL STRUCTURE OF A SOLUTION OF THE UNRESTRICTED HARTREE-FOCK EQUATION IN MOLECULAR SYSTEMS WITH A SPATIAL POINT SYMMETRYOZAKI MA.1979; PROGR. THEOR. PHYS.; JPN; DA. 1979; VOL. 62; NO 5; PP. 1183-1196; BIBL. 10 REF.Article

ELECTRONIC STRUCTURES OF ANTIAROMATIC MOLECULES.YAMAGUCHI K.1975; CHEM. PHYS. LETTERS; NETHERL.; DA. 1975; VOL. 35; NO 2; PP. 230-235; BIBL. 14 REF.Article

UNRESTRICTED HARTREE-FOCK CALCULATION OF FORCE CONSTANTS AND VIBRATIONAL FREQUENCIES OF THE HCO RADICAL.BOTSCHWINA P.1974; CHEM. PHYS. LETTERS; NETHERL.; DA. 1974; VOL. 29; NO 1; PP. 98-101; BIBL. 19 REF.Article

UNRESTRICTED HARTREE-FOCK FUNCTIONS FOR THE CARBON AND FLUORINE ATOMSCOOK DB.1981; THEOR. CHIM. ACTA; ISSN 0040-5744; DEU; DA. 1981; VOL. 58; NO 2; PP. 155-162; BIBL. 6 REF.Article

Approximate account of the connected quadruply excited clusters in the coupled-pair many-electron theoryPALDUS, J; CIZEK, J; TAKAHASHI, M et al.Physical review. A, General physics. 1984, Vol 30, Num 5, pp 2193-2209, issn 0556-2791Article

UNRESTRICTED HARTREE-FOCK THEORY AND ITS APPLICATIONS TO MOLECULES AND CHEMICAL REACTIONSFUKUTOME H.1981; INT. J. QUANTUM CHEM.; ISSN 0020-7608; USA; DA. 1981; VOL. 20; NO 5; PP. 955-1065; BIBL. 3 P.Article

CORE HOLE LOCALIZATION IN N2+LOZES RL; GOSCINSKI O; WAHLGREN UI et al.1979; CHEM. PHYS. LETTERS; NLD; DA. 1979; VOL. 63; NO 1; PP. 77-81; BIBL. 24 REF.Article

ON THE USE OF UHF ORBITALS IN IONIZATION ENERGY CALCULATIONSBISKUPIC S.1979; THEOR. CHIM. ACTA; DEU; DA. 1979; VOL. 54; NO 1; PP. 15-21; BIBL. 18 REF.Article

DISTRIBUTION OF ODD-ELECTRONS IN GROUND-STATE MOLECULES.TAKATSUKA K; FUENO T; YAMAGUCHI K et al.1978; THEOR. CHIM. ACTA; DEU; DA. 1978; VOL. 48; NO 3; PP. 175-183; BIBL. 19 REF.Article

THE STRUCTURE OF THE ETHYL RADICAL.PACANSKY J; DUPUIS M.1978; J. CHEM. PHYS.; U.S.A.; DA. 1978; VOL. 68; NO 9; PP. 4276-4278; BIBL. 11 REF.Article

CORRELATION EFFECTS IN SINGLET BIRADICAL SPECIES.YAMAGUCHI K; FUENO T.1977; CHEM. PHYS.; NETHERL.; DA. 1977; VOL. 19; NO 1; PP. 35-42; BIBL. 16 REF.Article

ZUR MO-LCAO-BERECHNUNG DER SPINDICHTEVERTEILUNG IM BENZYLRADIKAL. = CALCUL MO-LCAO DE LA DISTRIBUTION DE DENSITE DE SPIN DANS LE RADICAL BENZYLEGEY E; HENNIG H; STOSSER R et al.1974; Z. PHYS. CHEM., LEIPZIG; DTSCH.; DA. 1974; VOL. 255; NO 2; PP. 395-400; BIBL. 23 REF.Article

VIBRATIONAL EXCITATION FOLLOWING THE S 1S CORE IONIZATION OF CSCANUTO S; REYES LM.1983; CHEMICAL PHYSICS LETTERS; ISSN 0009-2614; NLD; DA. 1983; VOL. 96; NO 5; PP. 591-594; BIBL. 35 REF.Article

CLUSTER ADSORPTION OF ARGON ON ALUMINAZDETSIS AD; KUNZ AB.1982; PHYSICAL REVIEW. B: CONDENSED MATTER; ISSN 0163-1829; USA; DA. 1982; VOL. 26; NO 8; PP. 4756-4758; BIBL. 6 REF.Article

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