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ETUDE THEORIQUE DES DEPLACEMENTS CHIMIQUES DU CARBONE 13 DE MOLECULES AZOTEES ET OXYGENEES.RAJZMANN M; FRANCOIS P; GUIMON C et al.1975; J. CHIM. PHYS. PHYS.-CHIM. BIOL.; FR.; DA. 1975; VOL. 72; NO 1; PP. 101-104; ABS. ANGL.; BIBL. 18 REF.Article

CALCULATION OF EXCITED SINGLET AND TRIPLET STATE POLARIZABILITIES USING THE CNDO/S CI METHOD. AN APPLICATION TO NAPHTHALENE.MEYER H; SCHULTE KW; SCHWEIG A et al.1975; CHEM. PHYS. LETTERS; NETHERL.; DA. 1975; VOL. 31; NO 1; PP. 187-191; BIBL. 31 REF.Article

THEORETICAL STUDY OF THE ELECTRONIC SPECTRA OF THE TOLUIC ACIDS BY CNDO/S METHOD.SIEIRO C; FERNANDEZ ALONSO JI.1974; AN. QUIM.; ESP.; DA. 1974; VOL. 70; NO 6; PP. 484-488; ABS. ESP.; BIBL. 13 REF.Article

VIBRONIC CALCULATIONS IN BENZENE BY CNDO/S.ZIEGLER L; ALBRECHT AC.1974; J. CHEM. PHYS.; U.S.A.; DA. 1974; VOL. 60; NO 9; PP. 3558-3561; BIBL. 10 REF.Article

CALCULATED SINGLET-TRIPLET TRANSITIONS IN PYRIDINE.JAFFE HH; MASMANIDIS CA; CHANG HM et al.1974; J. CHEM. PHYS.; U.S.A.; DA. 1974; VOL. 60; NO 4; PP. 1696; BIBL. 3 REF.Article

TRIPLET-TRIPLET ABSORPTION OF BENZENE AND SOME METHYLATED DERIVATIVESLECLERCQ J; LECLERCQ JM.1973; CHEM. PHYS. LETTERS; NETHERL.; DA. 1973; VOL. 18; NO 3; PP. 411-413; BIBL. 15 REF.Serial Issue

Semiempirical quantum chemical calculation on the chlorophyll-water system and determination of excitonic characteristics of a model chloroplastNATH DATTA, S; PRIYADARSHY, S.Chemical physics letters. 1990, Vol 173, Num 4, pp 360-366, issn 0009-2614Article

INVARIANCE DE LA METHODE CNDO/S RELATIVEMENT AU CHOIX DES FONCTIONS DE BASEGINEJTITE VL; BALYAVICHUS MLZ.1979; TEOR. EKSPER. KHIM.; UKR; DA. 1979; VOL. 15; NO 2; PP. 191-192; BIBL. 9 REF.Article

CALCULATION OF SOME 13C NUCLEAR SCREENING CONSTANTS.EBRAHEEM KAK; WEBB GA.1977; ORG. MAGNET. RESON.; G.B.; DA. 1977; VOL. 9; NO 5; PP. 241-247; BIBL. 35 REF.Article

STRUCTURE ELECTRONIQUE EN SERIE BENZOTHIAZOLIQUE: SPECTRES PHOTOELECTRONIQUES ET CALCULS C.N.D.O.SALMONA G; FAURE R; VINCENT EJ et al.1975; C.R. ACAD. SCI., C; FR.; DA. 1975; VOL. 280; NO 10; PP. 605-607; ABS. ANGL.; BIBL. 14 REF.Article

STRUCTURE ELECTRONIQUE, SPECTRE ULTRAVIOLET ET SOLVATOCHROMIE DU TETRACYANO-1,1,3,3 AZA-2 PROPENURE DE TETRAMETHYLAMMONIUM.LEIBOVICI C.1974; J. MOLEC. STRUCT.; NETHERL.; DA. 1974; VOL. 20; NO 3; PP. 429-435; ABS. ANGL.; BIBL. 9 REF.Article

LOWER ELECTRONIC STATES OF NITRIC ACID AND ESTERSHARRIS LE.1973; NATURE PHYS. SCI.; G.B.; DA. 1973; VOL. 243; NO 128; PP. 102-103; BIBL. 8 REF.Serial Issue

NATURAL ORBITALS OF S-CIS-BUTADIENE AND THEIR RELATION TO PHOTOCHEMICAL CYCLIZATIONDINUR U; HONIG B.1979; CHEM. PHYS. LETTERS; NLD; DA. 1979; VOL. 64; NO 3; PP. 588-592; BIBL. 11 REF.Article

CALCULATION OF SOME NITROGEN NUCLEAR SCREENING CONSTANTS.EBRAHEEM KAK; WEBB GA.1977; ORG. MAGNET. RESON.; G.B.; DA. 1977; VOL. 9; NO 5; PP. 248-252; BIBL. 37 REF.Article

CNDO/CI STUDY OF ELECTRONIC SPECTRA OF CYCLOPROPANE, METHYLEN-, DIMETHYLEN- AND TRIMETHYLENCYCLOPROPANE.SIEIRO C; PONCE C.1976; AN. QUIM.; ESP.; DA. 1976; VOL. 72; NO 3; PP. 201-205; ABS. ESP.; BIBL. 17 REF.Article

A NUMERICAL COMPARISON OF THE RANDOM-PHASE APPROXIMATIONS OF EXCITED STATES OF DNA BASES USING THE CNDO/S METHOD.ITO H; I'HAYA YJ.1976; CHEM. PHYS. LETTERS; NETHERL.; DA. 1976; VOL. 38; NO 2; PP. 271-274; BIBL. 20 REF.Article

EXPERIMENTAL AND THEORETICAL STUDIES ON THE EXCITED STATE POLARIZABILITIES OF BENZENE, NAPHTHALENE, AND ANTHRACENE.MATHIES R; ALBRECHT AC.1974; J. CHEM. PHYS.; U.S.A.; DA. 1974; VOL. 60; NO 6; PP. 2500-2508; BIBL. 39 REF.Article

SPLITTING OF THE DEGENERATE ACETYLENIC PI MOS; A PROBE FOR RING STRAIN.SCHMIDT H; SCHWEIG A.1974; TETRAHEDRON LETTERS; G.B.; DA. 1974; NO 16; PP. 1471-1474; BIBL. 13 REF.Article

USE OF THE CNDO METHOD IN SPECTROSCOPY. XI. PHOTOELECTRON SPECTRA.ELLIS RL; JAFFE HH; MASMANIDIS CA et al.1974; J. AMER. CHEM. SOC.; U.S.A.; DA. 1974; VOL. 96; NO 8; PP. 2623-2625; BIBL. 15 REF.Article

STRUKTUR UND SPIN-MULTIPLIZITAET EINES (4) ANNULEN-SYSTEMS. = STRUCTURE ET MULTIPLICITE DE SPIN D'UN SYSTEME (4) ANNULENELAUER G; MULLER C; SCHULTE KW et al.1974; ANGEW. CHEM.; DTSCH.; DA. 1974; VOL. 86; NO 16; PP. 597-598; BIBL. 11 REF.Article

HIGHER-LYING SINGLET STATES OF POLY-N-VINYL-CARBAZOLE: A CNDO/S STUDYBIGELOW RW.1979; J. CHEM. PHYS.; USA; DA. 1979; VOL. 71; NO 2; PP. 1037-1038; BIBL. 14 REF.Article

VIBRONIC COUPLING AND IR INTENSITIESMARCONI G; ORLANDI G; MALPEZZI L et al.1979; CHEM. PHYS. LETTERS; NLD; DA. 1979; VOL. 61; NO 3; PP. 545-547; BIBL. 11 REF.Article

MAGNETIC ROTATIONAL STRENGTHS OF HIGHER STATES IN BENZENE: EVIDENCE FOR THE EXISTENCE OF AN OUT-OF-PLANE TRANSITION.ROSENFIELD JS.1976; CHEM. PHYS. LETTERS; NETHERL.; DA. 1976; VOL. 39; NO 2; PP. 391-394; BIBL. 9 REF.Article

DIRECT QUANTUM CHEMICAL CALCULATION OF ROTARY STRENGTHS OF METHYLPYRROLIDONES. MODEL COMPOUNDS CONTAINING A PEPTIDE GROUP.VOLOSOV AP; ZUBKOV VA; BIRSHTEIN TM et al.1975; TETRAHEDRON; G.B.; DA. 1975; VOL. 31; NO 10; PP. 1259-1262; BIBL. 19 REF.Article

ON THE NATURE OF THE "FREE ELECTRON PAIR" ON PHOSPHORUS IN AROMATIC PHOSPHORUS COMPOUNDS: THE PHOTOELECTRON SPECTRUM OF 2-PHOSPHANAPHTHALENE.SCHAFER W; SCHWEIG A; VERMEER H et al.1975; J. ELECTRON SPECTROSC. RELAT. PHENOMENA; NETHERL.; DA. 1975; VOL. 6; NO 2; PP. 91-98; BIBL. 22 REF.Article

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