Pascal and Francis Bibliographic Databases

Help

Search results

Your search

kw.\*:("VALENCE BOND METHOD")

Document Type [dt]

A-Z Z-A Frequency ↓ Frequency ↑
Export in CSV

Publication Year[py]

A-Z Z-A Frequency ↓ Frequency ↑
Export in CSV

Discipline (document) [di]

A-Z Z-A Frequency ↓ Frequency ↑
Export in CSV

Language

A-Z Z-A Frequency ↓ Frequency ↑
Export in CSV

Author Country

A-Z Z-A Frequency ↓ Frequency ↑
Export in CSV

Results 1 to 25 of 372

  • Page / 15
Export

Selection :

  • and

CHOIX D'UNE BASE TRONQUEE OPTIMALE DANS LE CADRE DE LA METHODE DE MESOMERIEHO NAM TRAN; DE REYFF C.1980; J. CHIM. PHYS. PHYSICOCHIM. BIOL.; ISSN 0021-7689; FRA; DA. 1980; VOL. 77; NO 11-12; PP. 979-985; ABS. ENG; BIBL. 10 REF.Article

APPLICATIONS OF THE CAUCHY INEQUALITIES IN SIMPLE MOLECULAR ORBITAL THEORY.GUTMAN I; TRINAJSTIC N.1977; J. CHEM. SOC., FARADAY TRANS., 2; G.B.; DA. 1977; VOL. 73; NO 3; PP. 435-437; BIBL. 6 REF.Article

MULTIPLICITE DE L'ETAT FONDAMENTAL DE GROSSES MOLECULES ORGANIQUES ALTERNANTES A LIAISONS CONJUGUEES. (PEUT-IL EXISTER DES FERROMAGNETIQUES ORGANIQUES.)OVCHINNIKOV AA.1977; DOKL. AKAD NAUK S.S.S.R.; S.S.S.R.; DA. 1977; VOL. 236; NO 4; PP. 928-931; BIBL. 6 REF.Article

Models of impurities in valence-bond spin chains and laddersKOLEZHUK, A. K.Journal of physics. Condensed matter (Print). 1998, Vol 10, Num 30, pp 6795-6802, issn 0953-8984Article

Valence bond theory for chemical reactions: a historical and natural choiceMULDER, J. J. C.Studies in physical and theoretical chemistry. 1990, Vol 64, pp 355-364, issn 0167-6881Article

Valence-bond theory and the evaluation of electronic energy matrix elements between nonorthogonal Slater determinantsLEASURE, S. C; BALINT-KURTI, G. G.Physical review. A, General physics. 1985, Vol 31, Num 4, pp 2107-2113, issn 0556-2791Article

Critical exponents for alternation in Heisenberg antiferromagnetic chainsRAMASESHA, S; SOOS, Z. G.Solid state communications. 1983, Vol 46, Num 7, pp 509-511, issn 0038-1098Article

THE VALENCE-BOND SELF-CONSISTENT FIELD METHOD (VB-SCF): THEORY AND TEST CALCULATIONSVAN LENTHE JH; BALINT KURTI GG.1983; JOURNAL OF CHEMICAL PHYSICS; ISSN 0021-9606; USA; DA. 1983; VOL. 78; NO 9; PP. 5699-5713; BIBL. 54 REF.Article

PRACTICAL VALENCE-BOND CALCULATIONSGALLUP GA; VANCE RL; COLLINS JR et al.1982; ADVANCES IN QUANTUM CHEMISTRY; ISSN 0065-3276; USA; DA. 1982; VOL. 16; PP. 229-272; BIBL. 3 P.Article

SEMI-EMPIRICAL VALENCE BOND POTENTIAL ENERGY SURFACES FOR HOMONUCLEAR ALKALI TRIMERSVARANDAS AJC; MORAIS VMF.1982; MOLECULAR PHYSICS; ISSN 0026-8976; GBR; DA. 1982; VOL. 47; NO 5; PP. 1241-1251; BIBL. 35 REF.Article

THE VALENCE BOND DESCRIPTION OF XYLYLENESHIBERTY PC; KARAFILOGLOU P.1982; THEOR. CHIM. ACTA; ISSN 0040-5744; DEU; DA. 1982; VOL. 61; NO 2; PP. 171-177; BIBL. 18 REF.Article

TRIPLET-TO-SINGLET CYCLOPROPYLIDENE-ALLENE REARRANGEMENT. A MOLECULAR EXAMPLE OF SPIN ANGULAR MOMENTUM COUPLING IN ORTHOGONAL PI SYSTEMSYING NAN CHIU.1982; JOURNAL OF THE AMERICAN CHEMICAL SOCIETY; ISSN 0002-7863; USA; DA. 1982; VOL. 104; NO 25; PP. 6937-6942; BIBL. 30 REF.Article

THE KINETIC ENERGY CHANGE ON COVALENT BOND FORMATIONMARCH NH; PARR RG; MUCCI JF et al.1981; PROC. NATL. ACAD. SCI. U.S.A., PHYS. SCI.; ISSN 0273-1142; USA; DA. 1981; VOL. 78; NO 10; PP. 5942-5945; BIBL. 4 REF.Article

VALENCE-BOND STUDIES OF ALKALINE EARTH OXIDES: BEO AND MGOMACLAGAN RGAR.1981; CHEM. PHYS. LETT.; ISSN 0009-2614; NLD; DA. 1981; VOL. 82; NO 3; PP. 501-504; BIBL. 15 REF.Article

ANALYSIS OF MOLECULAR ORBITAL WAVE FUNCTIONS IN TERMS OF VALENCE BOND FUNCTIONS FOR MOLECULAR FRAGMENTS. I: THEORYHIBERTY PC.1981; INT. J. QUANTUM CHEM.; ISSN 0020-7608; USA; DA. 1981; VOL. 19; NO 2; PP. 259-269; ABS. FRE/GER; BIBL. 15 REF.Article

CONVERGENCE OF THE VALENCE-BOND CALCULATION FOR METHANE.RAIMONDI M; CAMPION W; KARPLUS M et al.1977; MOLEC. PHYS.; G.B.; DA. 1977; VOL. 34; NO 5; PP. 1483-1492; BIBL. 14 REF.Article

POTENTIAL ENERGY BARRIERS FOR HALOGEN SIX-CENTER REACTIONS: SEMIEMPIRICAL VALENCE-BOND PREDICTIONS.THOMPSON DL; SUZUKAWA HH JR.1977; J. AMER. CHEM. SOC.; U.S.A.; DA. 1977; VOL. 99; NO 11; PP. 3614-3616; BIBL. 38 REF.Article

THE GROUND AND LOW-LYING EXCITED POTENTIAL CURVES OF SO. A PSEUDOPOTENTIAL MULTI-STRUCTURE VALENCE-BOND CALCULATION.DIXON RN; TASKER PW; BALINT KURTI GG et al.1977; MOLEC. PHYS.; G.B.; DA. 1977; VOL. 34; NO 5; PP. 1455-1477; BIBL. 27 REF.Article

Theoretical prediction of bond-valence networks. II. Comparison of the graph-matrix and resonance-bond approachesRUTHERFORD, J. S.Acta crystallographica. Section B, Structural science. 1998, Vol 54, Num 3, pp 204-210, issn 0108-7681Article

ROTATION AROUND THE DOUBLE BOND IN ETHYLENE: A FOUR ELECTRON PROBLEMMULDER JJC.1980; NOUV. J. CHEM.; FRA; DA. 1980; VOL. 4; NO 5; PP. 283-285; BIBL. 9 REF.Article

AB INITIO VALENCE BOND CALCULATION OF INTERMOLECULAR FORCES USING A NON-ORTHOGONAL BASIS SET: HEHE AND HELI SYSTEMSCREMASCHI P; MOROSI G; RAIMONDI M et al.1979; MOLEC. PHYS.; GBR; DA. 1979; VOL. 38; NO 5; PP. 1555-1565; BIBL. 23 REF.Article

SEMI-EMPIRICAL POTENTIAL SURFACES FOR SOME MIXED ALKALI TRIMERS.MUKHERJEE DC; NOOR MAHAMMAD S; SANNIGRAHI AB et al.1978; J. INDIAN CHEM. SOC.; IND; DA. 1978; VOL. 55; NO 4; PP. 378-381; BIBL. 14 REF.Article

VALENCE-BOND STUDIES OF AH2 MOLECULES. IV. A COMPARISON OF MINIMAL BASIS SET CALCULATIONS ON H2O AND H2SDOONAN IJ; MACLAGAN RGAR.1978; THEOR. CHIM. ACTA; DEU; DA. 1978; VOL. 50; NO 1; PP. 87-91; BIBL. 12 REF.Article

DISCONTINUOUS APPROXIMATE MOLECULAR ELECTRONIC WAVE-FUNCTIONS.STUEBING EW; WEARE JH; PARR RG et al.1977; INTERNATION. J. QUANTUM CHEM.; U.S.A.; DA. 1977; VOL. 11; NO 1; PP. 81-102; ABS. FR. ALLEM.; BIBL. 28 REF.Article

APPARENT OCTET RULE VIOLATIONS, FRACTIONALITY, AND THE INTERPRETATION OF LOCALIZED MOLECULAR ORBITAL STRUCTURES. POLARIZATION AND HYBRIDIZATION FUNCTIONS IN CHEMICAL BONDING.HALGREN TA; BROWN LD; KLEIER DA et al.1977; J. AMER. CHEM. SOC.; U.S.A.; DA. 1977; VOL. 99; NO 21; PP. 6793-6806; BIBL. 1 P. 1/2Article

  • Page / 15