HistCite - papers citing Rudy Pariser

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#	Date / Author / Journal	LCS	GCS	LCR	CR
3501	1053 JOY HW, SILVERST.HJ VALENCE STATES OF CARBON IN PI-ELECTRON SYSTEMS .2. EXCITED STATES AND IONS MOLECULAR PHYSICS. 1967; 13 (2): 149-&	5	8	7	13
3502	1054 KWIATKOW.JS, WASILEWS.J ELECTRONIC SPECTRA OF PURINE AND SOME AMINOPURINES MOLECULAR PHYSICS. 1967; 13 (3): 229-&	3	6	9	28
3503	1055 WRATTEN RJ, ALI MA UV SPECTRA OF DIBENZ-1,4-DIOXIN AND 1,4-BENZDIOXIN AND ESR SPECTRA OF THEIR MONOPOSITIVE IONS . A SEMI-EMPIRICAL INVESTIGATION OF MON-PLANAR PI-ELECTRON SYSTEMS MOLECULAR PHYSICS. 1967; 13 (3): 233-&	3	20	8	22
3504	1056 WIERSMA DA, KOMMANDE.J DIPHENYL-AMINO RADICAL DIMER MOLECULAR PHYSICS. 1967; 13 (3): 241-&	1	56	2	20
3505	1057 CUNLIFFE AV, HARRIS RK NUCLEAR MAGNETIC RESONANCE STUDIES OF 1,3-BUTADIENES .6. A THEORETICAL TREATMENT OF COUPLING BY PI ELECTRONS MOLECULAR PHYSICS. 1967; 13 (3): 269-&	1	26	7	36
3506	1058 VANDERWA.JH, BERGHUIS AM, DEGROOT MS VIBRONIC INTERACTION IN LOWER ELECTRONIC STATES OF BENZENE .I. REVIEW OF STATIC PROBLEM AND SOLUTION OF PSEUDO-CYLINDRICAL VIBRONIC EQUATIONS MOLECULAR PHYSICS. 1967; 13 (4): 301-&	7	135	12	40
3507	1059 RAY NK, NARASIMH.PT STUDY OF SPIN DENSITY DISTRIBUTIONS IN RADICAL IONS OF TWO NON- ALTERNANT HYDROCARBONS BY UNRESTRICTED HARTREE-FOCK METHOD - EFFECT OF INTRODUCING VARIATION OF BETA AND INCLUSION OF NON-NEIGHBOUR RESONANCE INTEGRALS ON SPIN DENSITY VALUES MOLECULAR PHYSICS. 1967; 13 (5): 449-&	1	7	9	18
3508	1060 DAVIES DW ALL VALENCY ELECTRON MOLECULAR ORBITAL CALCULATIONS .1. DIPOLE MOMENTS SPIN DENSITIES AND 19F SHIELDING CONSTANTS IN SOME FLUOROBENZENES AND FLUORONITROBENZENES MOLECULAR PHYSICS. 1967; 13 (5): 465-&	5	42	12	66
3509	1061 COOK DB, HOLLIS PC, MCWEENY R APPROXIMATE AB INITIO CALCULATIONS ON POLYATOMIC MOLECULES MOLECULAR PHYSICS. 1967; 13 (6): 553-&	22	103	2	25
3510	1213 SCHWEIG A QUADRUPOLE MOMENTS AND QUADRUPOLE POLARIZABILITIES OF CONJUGATED SYSTEMS MOLECULAR PHYSICS. 1968; 14 (6): 533-&	1	34	4	24
#	Date / Author / Journal	LCS	GCS	LCR	CR
3511	1214 CHANDRA AK A CORRELATION OF INFRA-RED BAND INTENSITIES WITH CHEMICAL REACTIVITY MOLECULAR PHYSICS. 1968; 14 (6): 577-&	0	2	3	17
3512	1215 KIMURA K THEORETICAL STUDY OF TRIPLET-TRIPLET ABSORPTION SPECTRA OF MONO AND P- DI-SUBSTITUTED BENZENES WITH ELECTRON-DONATING SUBSTITUENTS MOLECULAR PHYSICS. 1968; 15 (2): 109-&	6	13	7	24
3513	1216 BROWN JK, BURNHAM DR ELECTRON SPIN RESONANCE SPECTRA AND ELECTRONIC STRUCTURE OF ALKOXYBENZENE RADICAL ANIONS MOLECULAR PHYSICS. 1968; 15 (2): 173-&	1	12	12	38
3514	1217 TRIC C A SELF-CONSISTENT CALCULATION OF BENZENE VIBRATIONS MOLECULAR PHYSICS. 1968; 15 (2): 205-&	2	5	3	12
3515	1218 EDWARDS TG, GRINTER R A STUDY OF TRANSFERABILITY OF ONE AND 2-CENTRE PARAMETER VALUES IN APPLICATION OF PARISER-PARR-POPLE TYPE METHODS TO CONJUGATED CARBONYL COMPOUNDS .I. IONIZATION POTENTIALS MOLECULAR PHYSICS. 1968; 15 (4): 349-&	5	11	21	42
3516	1219 EDWARDS TG, GRINTER R A STUDY OF TRANSFERABILITY OF ONE AND 2-CENTRE PARAMETER VALUES IN APPLICATION OF PARISER-PARR-POPLE TYPE METHODS TO CONJUGATED CARBONYL COMPOUNDS .2. ELECTRONIC SPECTRA MOLECULAR PHYSICS. 1968; 15 (4): 357-&	3	19	18	55
3517	1220 EDWARDS TG, GRINTER R A STUDY OF TRANSFERABILITY OF ONE AND 2-CENTRE PARAMETER VALUES IN APPLICATION OF PARISER-PARR-POPLE TYPE METHODS TO CONJUGATED CARBONYL COMPOUNDS .3. ELECTRON SPIN RESONANCE SPECTRA MOLECULAR PHYSICS. 1968; 15 (4): 367-&	0	6	10	40
3518	1401 TANAKA M, TANAKA J THEORY OF EXCITON STATES OF MOLECULAR CRYSTALS MOLECULAR PHYSICS. 1969; 16 (1): 1-&	6	23	4	19
3519	1402 TINLAND B A CNDO CI STUDY OF ELECTRONIC STRUCTURE OF TRANS-ACROLEIN MOLECULAR PHYSICS. 1969; 16 (4): 413-&	7	18	13	27
3520	1403 SUKIGARA M, NELSON RC BAND STRUCTURE AND TRANSPORT OF CHARGE CARRIERS IN METAL-FREE PHTHALOCYANINE MOLECULAR PHYSICS. 1969; 17 (4): 387-&	3	10	6	33
#	Date / Author / Journal	LCS	GCS	LCR	CR
3521	1404 HUSH NS, DYKE JM, WILLIAMS ML, WOOLSEY IS PREDICTED BOND LENGTHS AND PI-ELECTRON DISTRIBUTION IN FULLY CONJUGATED CORROLE RING MOLECULAR PHYSICS. 1969; 17 (5): 559-&	1	11	3	5
3522	1586 BAIRD NC A MODIFIED SCF-MO METHOD FOR PI ELECTRONS . NEGLECT OF NON-BONDED DIFFERENTIAL OVERLAP MOLECULAR PHYSICS. 1970; 18 (1): 39-&	7	18	12	24
3523	1587 VEEMAN WS, WAALS JHV SPIN-ORBIT COUPLING IN AROMATIC MOLECULES MOLECULAR PHYSICS. 1970; 18 (1): 63-&	6	75	4	43
3524	1588 LUGT WTA, OOSTERHO.LJ VALENCE BOND THEORY AND NEGLECT OF DIFFERENTIAL OVERLAP MOLECULAR PHYSICS. 1970; 18 (2): 177-&	0	0	10	25
3525	1589 BRUIJN SD, COLPA JP VIBRATIONAL FORCE CONSTANTS OF BENZENE . MO-ANALYSIS MOLECULAR PHYSICS. 1970; 18 (2): 213-&	0	1	3	14
3526	1590 DEVAQUET A SELF-CONSISTENT FIELD INTERMOLECULAR ORBITAL THEORY OF INTERACTION BETWEEN CONJUGATED SYSTEMS MOLECULAR PHYSICS. 1970; 18 (2): 233-&	1	46	4	18
3527	1591 HART WJV, OOSTERHO.LJ ESR AND ELECTRONIC ABSORPTION SPECTRA OF CHICHIBABINS BIRADICAL MOLECULAR PHYSICS. 1970; 18 (2): 281-&	0	0	3	17
3528	1592 CALDOW GL SELF-CONSISTENT HUCKEL THEORY MOLECULAR PHYSICS. 1970; 18 (3): 383-&	2	9	9	25
3529	1593 SCHUG JC OPTIMUM PARAMETRIZATION IN SCF PI-ELECTRON THEORY MOLECULAR PHYSICS. 1970; 19 (1): 121-&	5	11	13	26
3530	1594 HUDSON A, LEWIS JWE HYPERFINE COUPLING CONSTANTS OF SOME FLUORINATED FREE RADICALS MOLECULAR PHYSICS. 1970; 19 (2): 241-&	2	36	5	55
#	Date / Author / Journal	LCS	GCS	LCR	CR
3531	1595 TANAKA M, TANAKA J EXCITON STATES AND HYPOCHROMISM OF POLYPEPTIDES MOLECULAR PHYSICS. 1970; 19 (6): 889-&	0	6	3	33
3532	1785 BROWN A, KEMP CM, MASON SF PI-SCF AND INDO CALCULATIONS AND ABSORPTION, POLARIZED EXCITATION AND CIRCULAR DICHROISM SPECTRA OF [4]-HELICENES MOLECULAR PHYSICS. 1971; 20 (5): 787-&	1	12	9	38
3533	1786 JOHNSTON LJ, PEACOCK TE ELECTRONIC STRUCTURE AND PROPERTIES OF POLYENES MOLECULAR PHYSICS. 1971; 20 (5): 849-&	3	15	9	20
3534	1787 VANBROEK.JA, SOMMERDI.JL, DEBOER E ESR STUDY OF TRIPLET DIANIONS OF 1,3,5-TRIPHENYLBENZENE AND 2,4,6- TRIPHENYL-SYM-TRIAZINE MOLECULAR PHYSICS. 1971; 20 (6): 993-&	0	13	7	25
3535	1788 KLEIN DJ, SOOS ZG SITE REPRESENTATION FOR CHARGE TRANSFER EXCITATIONS IN MOLECULAR CRYSTALS MOLECULAR PHYSICS. 1971; 20 (6): 1013-&	11	45	4	41
3536	1989 YOSHIMI H, KUWATA K ELECTRON-SPIN RESONANCE OF MONOMER AND DIMER CATIONS OF 1,4-DIMETHYL ELECTRON SPIN-RESONANCE OF MONOMER AND DIMER CATIONS OF 1,4- DIMETHYLNAPHTHALENES 1,5-DIMETHYLNAPHTHALENES AND 1,8- DIMETHYLNAPHTHALENES MOLECULAR PHYSICS. 1972; 23 (2): 297-&	0	26	6	26
3537	1990 MIZUNO M, SAEKI S APPLICATION OF LOWDINS ORTHOGONAL ORBITALS TO PI-ELECTRON CALCULATIONS MOLECULAR PHYSICS. 1972; 24 (1): 219-&	2	3	7	13
3538	1991 SANNIGRA.AB, MOHAMMAD SN SIMPLIFIED SCF CALCULATIONS ON DIATOMIC ALKALI-METAL MOLECULES MOLECULAR PHYSICS. 1972; 24 (4): 905-&	4	7	4	24
3539	1992 TANIMOTO O, TOYODA K CALCULATION OF LOWER EXCITED ELECTRONIC LEVELS OF BENZENE WITH GREENS FUNCTION METHOD MOLECULAR PHYSICS. 1972; 24 (6): 1257-1264	2	14	6	18
3540	1993 NANDA DN, NARASIMH.PT UNRESTRICTED HARTREE-FOCK SPIN DENSITY CALCULATIONS ON SULFUR- CONTAINING RADICALS - ROLE OF D-ORBITALS IN PI-ELECTRON TREATMENT MOLECULAR PHYSICS. 1972; 24 (6): 1341-1352	4	11	17	51
#	Date / Author / Journal	LCS	GCS	LCR	CR
3541	1994 SEAMANS L, LINDERBE.J MAGNETO-OPTICAL ACTIVITY - GAUGE-INVARIANT CALCULATIONS IN RANDOM-PHASE APPROXIMATION MOLECULAR PHYSICS. 1972; 24 (6): 1393-1405	21	48	1	16
3542	2171 COOPER IL, LINDERBE.J MOLECULAR APPLICATIONS OF A METHOD OF SCREENED EXCHANGE MOLECULAR PHYSICS. 1973; 25 (2): 265-279	3	23	10	35
3543	2172 SANNIGRA.AB, MOHAMMAD SN SPLIT-SHELL MOLECULAR-ORBITAL CALCULATIONS ON DIATOMIC ALKALI-METAL MOLECULES MOLECULAR PHYSICS. 1973; 25 (4): 985-987	2	10	7	10
3544	2173 PRIESTLE.EB, ROBINSON GW APPARENT ABSENCE OF TRIPLET-TRIPLET ABSORPTION IN PURE ORGANIC MOLECULAR-CRYSTALS MOLECULAR PHYSICS. 1973; 26 (1): 159-167	2	6	12	45
3545	2174 RATNER M, SABIN JR, BALL EE SCF CALCULATION OF EFFECTIVE PARAMETERS FOR HUBBARD MODEL OF TCNQ CHARGE-TRANSFER SALTS MOLECULAR PHYSICS. 1973; 26 (5): 1177-1184	5	23	8	57
3546	2175 DOUGLAS IN, GRINTER R, THOMSON AJ MAGNETIC CIRCULAR-DICHROISM SPECTRUM OF B-12U[-A-11G TRANSITION OF BENZENE IN VAPOR-PHASE MOLECULAR PHYSICS. 1973; 26 (5): 1257-1266	5	25	2	22
3547	2326 CHANDRA AK, SUDHINDR.BS INTERMOLECULAR INTERACTIONS IN FORMATION OF AROMATIC HYDROCARBON DIMERS MOLECULAR PHYSICS. 1974; 28 (3): 695-706	1	26	2	23
3548	2327 MORRIS JM INTERMOLECULAR FORCES BETWEEN LARGE MOLECULES - STRUCTURE OF ANTHRACENE STABLE DIMERS MOLECULAR PHYSICS. 1974; 28 (5): 1167-1176	0	15	1	26
3549	2455 MATSUMOTO S, NAGAKURA S, HAYASHI H TRIPLET-STATES OF COMPLEXES WITH TETRACHLOROPHTHALIC ANHYDRIDE AND PHTHALIC ANHYDRIDE AS ELECTRON-ACCEPTORS MOLECULAR PHYSICS. 1975; 29 (1): 167-176	0	7	4	12
3550	2456 HA TK AB-INITIO SCF CI STUDY OF ELECTRONIC-SPECTRUM OF S-TETRAZINE MOLECULAR PHYSICS. 1975; 29 (6): 1829-1846	1	19	12	46
#	Date / Author / Journal	LCS	GCS	LCR	CR
3551	2457 COULSON CA, GOMES JANF, MALLION RB RING MAGNETIC-SUSCEPTIBILITIES IN CONJUGATED HYDROCARBONS MOLECULAR PHYSICS. 1975; 30 (3): 713-732	2	42	4	87
3552	2458 EGE G, VOGLER H SEMIEMPIRICAL CALCULATIONS OF MAGNETIC-PROPERTIES OF CONDENSED HYDROCARBONS MOLECULAR PHYSICS. 1975; 30 (5): 1511-1519	3	12	10	46
3553	2459 DEKKERS HPJM, WESTRA SWT MAGNETIC CIRCULAR-DICHROISM OF AZULENE MOLECULAR PHYSICS. 1975; 30 (6): 1795-1811	7	17	8	25
3554	2571 MOOIJ JJ, DEBOER E MAGNETIC-RESONANCE STUDY OF MONOANIONS OF CYCLOOCTATETRAENE AND 1,3,5,7-TETRAMETHYL CYCLOOCTATETRAENE, PRODUCED IN SINGLE-CRYSTALS OF K2C8H8 . DIGLYME, RB2C8H8 . DIGLYME AND K2(CH3)4C8H4 . DIGLYME2 MOLECULAR PHYSICS. 1976; 32 (1): 113-129	0	5	4	29
3555	2672 SPANGETLARSEN J, GLEITER R, HAIDER R, THULSTRUP EW ELECTRONIC-STRUCTURE OF CYCLAZINES .1. PHOTOELECTRON-SPECTRUM AND POLARIZED ELECTRONIC ABSORPTION-SPECTRUM OF CYCLOPENTA[H]CYCL[4.2.2]AZINE MOLECULAR PHYSICS. 1977; 34 (4): 1049-1061	5	10	10	37
3556	2803 VOS HW, MACLEAN C, VELTHORST NH SEMIEMPIRICAL CALCULATIONS OF CHEMICAL-SHIFTS IN PARTIALLY PARATROPIC ANIONS MOLECULAR PHYSICS. 1978; 35 (2): 329-347	1	7	11	51
3557	2804 TAKEKIYO S ABINITIO CALCULATIONS OF PI-ELECTRONIC STRUCTURES OF PYRIDINE BY VALENCE-BOND METHOD MOLECULAR PHYSICS. 1978; 35 (6): 1705-1711	1	4	8	24
3558	2917 KOOTER JA, VANDERWAALS JH, KNOP JV CALCULATION OF THE SPIN-DENSITY AND SPIN-SPIN DIPOLAR INTERACTION IN THE TRIPLET-STATE OF METAL PORPHINS MOLECULAR PHYSICS. 1979; 37 (4): 1015-1036	1	18	12	38
3559	2918 THULSTRUP EW, SPANGETLARSEN J, GLEITER R ELECTRONIC-STRUCTURE OF PARA-TERPHENYL, 3,6-DIPHENYL-PYRIDAZINE AND 3,6-DIPHENYL-S-TETRAZINE - PHOTOELECTRON AND POLARIZED ABSORPTION- SPECTRA MOLECULAR PHYSICS. 1979; 37 (5): 1381-1395	4	22	8	53
3560	3021 YIANOULIS P, NELSON RC COULOMB EFFECT ON THE ENERGY-LEVELS IN MOLECULAR-CRYSTALS MOLECULAR PHYSICS. 1980; 39 (1): 261-269	1	7	8	21
#	Date / Author / Journal	LCS	GCS	LCR	CR
3561	3022 WU AJA GENERALIZED DIATOMICS-IN-MOLECULES THEORY .2. ZERO DIFFERENTIAL-OVERLAP APPROACH MOLECULAR PHYSICS. 1980; 39 (5): 1287-1289	0	8	2	8
3562	3101 VOGLER H CALCULATION OF THE ZERO-FIELD SPLITTING PARAMETERS-D OF BENZENOID HYDROCARBONS AND THEIR DEPENDENCE UPON THE MOLECULAR-STRUCTURE MOLECULAR PHYSICS. 1981; 43 (1): 83-96	2	9	18	43
3563	3176 YIANOULIS P, NELSON RC ELECTRON-AFFINITY OF ADSORBED DYE MONOLAYERS MOLECULAR PHYSICS. 1982; 45 (2): 451-461	0	4	10	28
3564	3177 VOGLER H [2.2]PARACYCLOPHANE - THEORETICAL-STUDY OF ITS LOWER EXCITED-STATES AND OF THE ZERO-FIELD SPLITTING PARAMETERS D MOLECULAR PHYSICS. 1982; 47 (5): 1179-1193	0	6	13	61
3565	3341 CHANDRA AK, BHANUPRAKASH K, BHASU VCJ, SRIKANTHAN D CHARGE-RESONANCE ENERGIES IN DIMER CATIONS OF AROMATICS MOLECULAR PHYSICS. 1984; 52 (3): 733-741	0	17	4	17
3566	3590 KOBAYASHI H, KAIZU Y, KIMURA H, MATSUZAWA H THE LOWEST METAL-TO-BIPYRIDINE CHARGE-TRANSFER EXCITED-STATE OF [CR(2,2'-BIPYRIDINE)(CO)4] MOLECULAR PHYSICS. 1988 AUG 20; 64 (6): 1009-1030	0	13	4	65
3567	3614 POSHUSTA RD, SCHMALZ TG, KLEIN DJ HEISENBERG-MODEL CLUSTER-EXPANSION FOR HALF-FILLED HUBBARD AND PPP MODELS MOLECULAR PHYSICS. 1989 FEB 10; 66 (2): 317-332	3	23	12	50
3568	3777 RAMASESHA S, ALBERT IDL, SINHA B OPTICAL AND MAGNETIC-PROPERTIES OF THE EXACT PPP STATES OF BIPHENYL MOLECULAR PHYSICS. 1991 FEB 20; 72 (3): 537-547	8	18	9	41
3569	4124 SCHUTT J, SCHULTE J, BOHM MC, SOOS ZG RESOLUTION OF THE SIGN PROBLEM IN QUANTUM MONTE-CARLO SIMULATIONS OF ANNULENES MOLECULAR PHYSICS. 1995 APR 20; 84 (6): 1127-1137	9	17	6	32
3570	4137 SCHUTT J, BOHM MC GREENS-FUNCTION QUANTUM MONTE-CARLO METHOD IN THE PRESENCE OF TOPOLOGICAL SIGN PROBLEMS - PI-ELECTRONIC SYSTEMS MOLECULAR PHYSICS. 1995 AUG 20; 85 (6): 1217-1226	8	14	6	39
#	Date / Author / Journal	LCS	GCS	LCR	CR
3571	4197 Chakrabarti A, Anusooya Y, Ramasesha S Properties of the correlated electronic states of pyrene and hydrogenated pyrene MOLECULAR PHYSICS. 1996 NOV; 89 (4): 1019-1032	0	1	11	44
3572	4272 Schutt J, Bohm MC Convergence behaviour of Green's function quantum Monte Carlo simulations of pi electron systems MOLECULAR PHYSICS. 1997 DEC 20; 92 (6): 997-1005	1	1	6	32
3573	4287 Schulte J, Bohm MC, Ramirez R The isotope effect in electronic expectation values: an all-quantum study of C6H6 and C6D6 MOLECULAR PHYSICS. 1998 APR 10; 93 (5): 801-807	0	11	5	32
3574	4290 Linderberg J Dissociative recombination: an electronic correlation problem MOLECULAR PHYSICS. 1998 MAY; 94 (1): 99-104	0	1	6	60
3575	4475 Bytautas L, Ruedenberg K Electron pairs, localized orbitals and electron correlation MOLECULAR PHYSICS. 2002 MAR; 100 (6): 757-781	0	19	3	133
3576	4588 Staicu A, Rouille G, Sukhorukov O, Henning T, Huisken F Cavity ring-down laser absorption spectroscopy of jet-cooled anthracene MOLECULAR PHYSICS. 2004 AUG-SEP; 102 (16-17): 1777-1783	0	18	8	30
3577	4654 Meissner L On perturbative corrections to excitation energies from configuration interaction singles MOLECULAR PHYSICS. 2006 JUL 10; 104 (13-14): 2073-2083	0	4	3	29
3578	4738 Klimenko TA, Ivanov VV, Adamowicz L Dipole polarizabilities and hyperpolarizabilities of the small conjugated systems in the -electron coupled cluster theory MOLECULAR PHYSICS. 2009; 107 (17): 1729-1737	0	1	5	30
3579	4739 Hawke LGD, Kalosakas G, Simserides C Empirical LCAO parameters for molecular orbitals in planar organic molecules MOLECULAR PHYSICS. 2009; 107 (17): 1755-1771	0	1	13	181
3580	4782 Ohrn Y, Linderberg J Propagators and their implications MOLECULAR PHYSICS. 2010; 108 (21-23): 2899-2904	0	0	7	39
#	Date / Author / Journal	LCS	GCS	LCR	CR
3581	4152 Komatsuzaki T, Ohmine I Proton transfer in liquid water .2. A semiempirical method to describe chemical reactions MOLECULAR SIMULATION. 1996; 16 (4-6): 321-344	0	7	4	32
3582	4673 Bernardi RC, Gomes DEB, Ito AS, Ota AT, Pascutti PG, et al. Density functional and molecular dynamics simulations of local anesthetics in 0.9% NaCl solution MOLECULAR SIMULATION. 2007; 33 (14): 1135-1141	0	0	0	22
3583	2176 SAVIN FA, BAZHULIN.NP, MOROZOV YV PI-ELECTRONIC STRUCTURE OF VARIOUS IONIC SPECIES OF 3-OXYPYRIDINE AND SOME OF ITS DERIVATIVES MOLEKULYARNAYA BIOLOGIYA. 1973; 7 (5): 674-682	3	19	4	28
3584	1405 LESKA J PI-ELECTRON STRUCTURE OF TRANS-1,2-DI-(PYRIDYL)-ETHYLENES .3. APPLICATION OF SCF-MO-CI METHOD MONATSHEFTE FUR CHEMIE. 1969; 100 (2): 545-&	0	2	4	14
3585	1406 SCHUSTER P OVERLAP IN SEMIEMPIRICAL LCAO-MO-SCF METHODS FOR ALL VALENCE ELECTRONS MONATSHEFTE FUR CHEMIE. 1969; 100 (3): 1015-+	1	4	3	22
3586	1407 PASPALEE.E, KOJUCHAR.A A STUDY OF BASICITIES OF ALPHA,OMEGA-DIPHENYL POLYENE KETONES MONATSHEFTE FUR CHEMIE. 1969; 100 (4): 1213-&	0	12	1	19
3587	1596 LESKA J, LOOS D, ZAHRADNI.P THEORETICAL STUDY OF GEOMETRICAL ISOMERS OF TETRAVINYL-ETHYLENE - (SCF- MO-CI-CALCULATIONS) MONATSHEFTE FUR CHEMIE. 1970; 101 (4): 1025-&	0	0	7	24
3588	1597 GRUNDLER W AN OMEGA HMO TREATMENT OF OMICRON AND PI ELECTRON SYSTEMS MONATSHEFTE FUR CHEMIE. 1970; 101 (5): 1362-+	3	8	2	27
3589	1598 BONTSCHE.D, RATSCHIN E ELECTRONIC STRUCTURE (SCF-CI) AND PHYSICAL PROPERTIES OF TRANS- AZOBENZENE AND ITS AMINO DERIVATIVES IN GROUND AND EXCITED STATE MONATSHEFTE FUR CHEMIE. 1970; 101 (5): 1454-&	1	13	7	18
3590	1995 BONTSCHE.D, RATSCHIN E THEORETICAL (SCF-CI-MO)-INVESTIGATION OF PHENYLAZONAPHTALENES AND AZONAPHTALENES IN GROUND AND EXCITED-STATE MONATSHEFTE FUR CHEMIE. 1972; 103 (4): 1000-&	1	5	5	13
#	Date / Author / Journal	LCS	GCS	LCR	CR
3591	2919 MIENTUS W, HABERDITZL W, BARTEL HG CONCERNING THE FORMALISM OF THE LCPO-MO-METHOD MONATSHEFTE FUR CHEMIE. 1979; 110 (2): 351-363	0	1	7	37
3592	3023 MIENTUS W, BARTEL HG, HABERDITZL W, SPITZER HJ THE CALCULATION OF ONE-ELECTRON INTEGRALS IN THE SCF-X-ALPHA-SW-METHOD .1. THE NORMALIZATION MONATSHEFTE FUR CHEMIE. 1980; 111 (3): 597-606	0	1	3	30
3593	3102 KOITZ G, FABIAN W, SCHMIDT HW, JUNEK H SYNTHESES WITH NITRILES .61. SYNTHESIS AND FLUORESCENCE OF CYANO- SUBSTITUTED 2-AMINOPYRIDINES MONATSHEFTE FUR CHEMIE. 1981; 112 (8-9): 973-985	2	10	3	17
3594	3103 FABIAN W THEORETICAL INVESTIGATIONS ON THE ABSORPTION AND FLUORESCENCE OF CYANO- SUBSTITUTED 2-AMINOPYRIDINES MONATSHEFTE FUR CHEMIE. 1981; 112 (11): 1271-1277	3	5	3	13
3595	3178 NAMBOODIRI KPK, VISWANATHAN S, GANESAN R, BHASU VCJ CRESOLS - AN INVESTIGATION INTO THEIR ELECTRONIC-STRUCTURE AND SPECTRA MONATSHEFTE FUR CHEMIE. 1982; 113 (8-9): 949-963	0	2	10	37
3596	3342 FABIAN W ON THE INTERPRETATION OF THE ABSORPTION CHARACTERISTICS OF ISOMERIC DIAMINO-METHOXY-PYRIDINECARBONITRILES MONATSHEFTE FUR CHEMIE. 1984; 115 (12): 1421-1427	2	3	6	11
3597	3582 IDRISS KA, SELEIM MM, ELSHAHAWY AS, SALEH MS, SEDAIRA H EFFECT OF THE VARYING PI-ACCEPTING PROPERTIES OF SOME ORTHO-SUBSTITUTED BENZOIC-ACIDS ON THE STABILITY OF MIXED-LIGAND COMPLEXES ALSO CONTAINING QUINIZARIN AND THORIUM(IV) MONATSHEFTE FUR CHEMIE. 1988 JUN-JUL; 119 (6-7): 683-691	0	2	4	31
3598	3607 PINDUR U, PFEUFFER L NEW STRUCTURAL ASPECTS OF 3-VINYL-1H-INDOLES FOR PREDICTING THE OUTCOME OF DIELS-ALDER REACTIONS MONATSHEFTE FUR CHEMIE. 1989 JAN; 120 (1): 27-34	0	15	4	39
3599	3642 GUSTAV K, COLDITZ R, STEEN D THEORETICAL INVESTIGATIONS ON MOLECULAR-STRUCTURE AND SPECTROSCOPY OF BENZOPYRYLIUM COMPOUNDS - COMPLETELY-OPTIMIZED S0 AND S1 MOLECULAR GEOMETRIES OF THE 2-PHENYL BENZOPYRYLIUM ION AND INFLUENCE OF SUBSTITUTION ON ITS ELECTRONIC SPECTRAL BEHAVIOR IN ABSORPTION AND FLUORESCENCE MONATSHEFTE FUR CHEMIE. 1989 AUG-SEP; 120 (8-9): 715-719	1	5	6	14
3600	4179 Etzlstorfer C, Falk H, Muller N, Tran TNH Structural aspects and electronic absorption of the hydroxyphenanthroperylene quinones fringelit D, hypericin, and stentorin MONATSHEFTE FUR CHEMIE. 1996 JUN-JUL; 127 (6-7): 659-668	1	13	2	57

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3501

1053 JOY HW, SILVERST.HJ

VALENCE STATES OF CARBON IN PI-ELECTRON SYSTEMS .2. EXCITED STATES AND IONS

MOLECULAR PHYSICS. 1967; 13 (2): 149-&

3502

1054 KWIATKOW.JS, WASILEWS.J

ELECTRONIC SPECTRA OF PURINE AND SOME AMINOPURINES

MOLECULAR PHYSICS. 1967; 13 (3): 229-&

3503

1055 WRATTEN RJ, ALI MA

UV SPECTRA OF DIBENZ-1,4-DIOXIN AND 1,4-BENZDIOXIN AND ESR SPECTRA OF THEIR MONOPOSITIVE IONS . A SEMI-EMPIRICAL INVESTIGATION OF MON-PLANAR PI-ELECTRON SYSTEMS

MOLECULAR PHYSICS. 1967; 13 (3): 233-&

3504

1056 WIERSMA DA, KOMMANDE.J

DIPHENYL-AMINO RADICAL DIMER

MOLECULAR PHYSICS. 1967; 13 (3): 241-&

3505

1057 CUNLIFFE AV, HARRIS RK

NUCLEAR MAGNETIC RESONANCE STUDIES OF 1,3-BUTADIENES .6. A THEORETICAL TREATMENT OF COUPLING BY PI ELECTRONS

MOLECULAR PHYSICS. 1967; 13 (3): 269-&

3506

1058 VANDERWA.JH, BERGHUIS AM, DEGROOT MS

VIBRONIC INTERACTION IN LOWER ELECTRONIC STATES OF BENZENE .I. REVIEW OF STATIC PROBLEM AND SOLUTION OF PSEUDO-CYLINDRICAL VIBRONIC EQUATIONS

MOLECULAR PHYSICS. 1967; 13 (4): 301-&

135

3507

1059 RAY NK, NARASIMH.PT

STUDY OF SPIN DENSITY DISTRIBUTIONS IN RADICAL IONS OF TWO NON- ALTERNANT HYDROCARBONS BY UNRESTRICTED HARTREE-FOCK METHOD - EFFECT OF INTRODUCING VARIATION OF BETA AND INCLUSION OF NON-NEIGHBOUR RESONANCE INTEGRALS ON SPIN DENSITY VALUES

MOLECULAR PHYSICS. 1967; 13 (5): 449-&

3508

1060 DAVIES DW

ALL VALENCY ELECTRON MOLECULAR ORBITAL CALCULATIONS .1. DIPOLE MOMENTS SPIN DENSITIES AND 19F SHIELDING CONSTANTS IN SOME FLUOROBENZENES AND FLUORONITROBENZENES

MOLECULAR PHYSICS. 1967; 13 (5): 465-&

3509

1061 COOK DB, HOLLIS PC, MCWEENY R

APPROXIMATE AB INITIO CALCULATIONS ON POLYATOMIC MOLECULES

MOLECULAR PHYSICS. 1967; 13 (6): 553-&

103

3510

1213 SCHWEIG A

QUADRUPOLE MOMENTS AND QUADRUPOLE POLARIZABILITIES OF CONJUGATED SYSTEMS

MOLECULAR PHYSICS. 1968; 14 (6): 533-&

Date / Author / Journal

3511

A CORRELATION OF INFRA-RED BAND INTENSITIES WITH CHEMICAL REACTIVITY

MOLECULAR PHYSICS. 1968; 14 (6): 577-&

3512

1215 KIMURA K

THEORETICAL STUDY OF TRIPLET-TRIPLET ABSORPTION SPECTRA OF MONO AND P- DI-SUBSTITUTED BENZENES WITH ELECTRON-DONATING SUBSTITUENTS

MOLECULAR PHYSICS. 1968; 15 (2): 109-&

3513

1216 BROWN JK, BURNHAM DR

ELECTRON SPIN RESONANCE SPECTRA AND ELECTRONIC STRUCTURE OF ALKOXYBENZENE RADICAL ANIONS

MOLECULAR PHYSICS. 1968; 15 (2): 173-&

3514

1217 TRIC C

A SELF-CONSISTENT CALCULATION OF BENZENE VIBRATIONS

MOLECULAR PHYSICS. 1968; 15 (2): 205-&

3515

1218 EDWARDS TG, GRINTER R

A STUDY OF TRANSFERABILITY OF ONE AND 2-CENTRE PARAMETER VALUES IN APPLICATION OF PARISER-PARR-POPLE TYPE METHODS TO CONJUGATED CARBONYL COMPOUNDS .I. IONIZATION POTENTIALS

MOLECULAR PHYSICS. 1968; 15 (4): 349-&

3516

1219 EDWARDS TG, GRINTER R

A STUDY OF TRANSFERABILITY OF ONE AND 2-CENTRE PARAMETER VALUES IN APPLICATION OF PARISER-PARR-POPLE TYPE METHODS TO CONJUGATED CARBONYL COMPOUNDS .2. ELECTRONIC SPECTRA

MOLECULAR PHYSICS. 1968; 15 (4): 357-&

3517

1220 EDWARDS TG, GRINTER R

A STUDY OF TRANSFERABILITY OF ONE AND 2-CENTRE PARAMETER VALUES IN APPLICATION OF PARISER-PARR-POPLE TYPE METHODS TO CONJUGATED CARBONYL COMPOUNDS .3. ELECTRON SPIN RESONANCE SPECTRA

MOLECULAR PHYSICS. 1968; 15 (4): 367-&

3518

1401 TANAKA M, TANAKA J

THEORY OF EXCITON STATES OF MOLECULAR CRYSTALS

MOLECULAR PHYSICS. 1969; 16 (1): 1-&

3519

1402 TINLAND B

A CNDO CI STUDY OF ELECTRONIC STRUCTURE OF TRANS-ACROLEIN

MOLECULAR PHYSICS. 1969; 16 (4): 413-&

3520

1403 SUKIGARA M, NELSON RC

BAND STRUCTURE AND TRANSPORT OF CHARGE CARRIERS IN METAL-FREE PHTHALOCYANINE

MOLECULAR PHYSICS. 1969; 17 (4): 387-&

Date / Author / Journal

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3521

1404 HUSH NS, DYKE JM, WILLIAMS ML, WOOLSEY IS

PREDICTED BOND LENGTHS AND PI-ELECTRON DISTRIBUTION IN FULLY CONJUGATED CORROLE RING

MOLECULAR PHYSICS. 1969; 17 (5): 559-&

3522

1586 BAIRD NC

A MODIFIED SCF-MO METHOD FOR PI ELECTRONS . NEGLECT OF NON-BONDED DIFFERENTIAL OVERLAP

MOLECULAR PHYSICS. 1970; 18 (1): 39-&

3523

1587 VEEMAN WS, WAALS JHV

SPIN-ORBIT COUPLING IN AROMATIC MOLECULES

MOLECULAR PHYSICS. 1970; 18 (1): 63-&

3524

1588 LUGT WTA, OOSTERHO.LJ

VALENCE BOND THEORY AND NEGLECT OF DIFFERENTIAL OVERLAP

MOLECULAR PHYSICS. 1970; 18 (2): 177-&

3525

1589 BRUIJN SD, COLPA JP

VIBRATIONAL FORCE CONSTANTS OF BENZENE . MO-ANALYSIS

MOLECULAR PHYSICS. 1970; 18 (2): 213-&

3526

1590 DEVAQUET A

SELF-CONSISTENT FIELD INTERMOLECULAR ORBITAL THEORY OF INTERACTION BETWEEN CONJUGATED SYSTEMS

MOLECULAR PHYSICS. 1970; 18 (2): 233-&

3527

1591 HART WJV, OOSTERHO.LJ

ESR AND ELECTRONIC ABSORPTION SPECTRA OF CHICHIBABINS BIRADICAL

MOLECULAR PHYSICS. 1970; 18 (2): 281-&

3528

1592 CALDOW GL

SELF-CONSISTENT HUCKEL THEORY

MOLECULAR PHYSICS. 1970; 18 (3): 383-&

3529

1593 SCHUG JC

OPTIMUM PARAMETRIZATION IN SCF PI-ELECTRON THEORY

MOLECULAR PHYSICS. 1970; 19 (1): 121-&

3530

1594 HUDSON A, LEWIS JWE

HYPERFINE COUPLING CONSTANTS OF SOME FLUORINATED FREE RADICALS

MOLECULAR PHYSICS. 1970; 19 (2): 241-&

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3531

1595 TANAKA M, TANAKA J

EXCITON STATES AND HYPOCHROMISM OF POLYPEPTIDES

MOLECULAR PHYSICS. 1970; 19 (6): 889-&

3532

1785 BROWN A, KEMP CM, MASON SF

PI-SCF AND INDO CALCULATIONS AND ABSORPTION, POLARIZED EXCITATION AND CIRCULAR DICHROISM SPECTRA OF [4]-HELICENES

MOLECULAR PHYSICS. 1971; 20 (5): 787-&

3533

1786 JOHNSTON LJ, PEACOCK TE

ELECTRONIC STRUCTURE AND PROPERTIES OF POLYENES

MOLECULAR PHYSICS. 1971; 20 (5): 849-&

3534

1787 VANBROEK.JA, SOMMERDI.JL, DEBOER E

ESR STUDY OF TRIPLET DIANIONS OF 1,3,5-TRIPHENYLBENZENE AND 2,4,6- TRIPHENYL-SYM-TRIAZINE

MOLECULAR PHYSICS. 1971; 20 (6): 993-&

3535

1788 KLEIN DJ, SOOS ZG

SITE REPRESENTATION FOR CHARGE TRANSFER EXCITATIONS IN MOLECULAR CRYSTALS

MOLECULAR PHYSICS. 1971; 20 (6): 1013-&

3536

1989 YOSHIMI H, KUWATA K

ELECTRON-SPIN RESONANCE OF MONOMER AND DIMER CATIONS OF 1,4-DIMETHYL ELECTRON SPIN-RESONANCE OF MONOMER AND DIMER CATIONS OF 1,4- DIMETHYLNAPHTHALENES 1,5-DIMETHYLNAPHTHALENES AND 1,8- DIMETHYLNAPHTHALENES

MOLECULAR PHYSICS. 1972; 23 (2): 297-&

3537

1990 MIZUNO M, SAEKI S

APPLICATION OF LOWDINS ORTHOGONAL ORBITALS TO PI-ELECTRON CALCULATIONS

MOLECULAR PHYSICS. 1972; 24 (1): 219-&

3538

1991 SANNIGRA.AB, MOHAMMAD SN

SIMPLIFIED SCF CALCULATIONS ON DIATOMIC ALKALI-METAL MOLECULES

MOLECULAR PHYSICS. 1972; 24 (4): 905-&

3539

1992 TANIMOTO O, TOYODA K

CALCULATION OF LOWER EXCITED ELECTRONIC LEVELS OF BENZENE WITH GREENS FUNCTION METHOD

MOLECULAR PHYSICS. 1972; 24 (6): 1257-1264

3540

1993 NANDA DN, NARASIMH.PT

UNRESTRICTED HARTREE-FOCK SPIN DENSITY CALCULATIONS ON SULFUR- CONTAINING RADICALS - ROLE OF D-ORBITALS IN PI-ELECTRON TREATMENT

MOLECULAR PHYSICS. 1972; 24 (6): 1341-1352

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3541

1994 SEAMANS L, LINDERBE.J

MAGNETO-OPTICAL ACTIVITY - GAUGE-INVARIANT CALCULATIONS IN RANDOM-PHASE APPROXIMATION

MOLECULAR PHYSICS. 1972; 24 (6): 1393-1405

3542

2171 COOPER IL, LINDERBE.J

MOLECULAR APPLICATIONS OF A METHOD OF SCREENED EXCHANGE

MOLECULAR PHYSICS. 1973; 25 (2): 265-279

3543

2172 SANNIGRA.AB, MOHAMMAD SN

SPLIT-SHELL MOLECULAR-ORBITAL CALCULATIONS ON DIATOMIC ALKALI-METAL MOLECULES

MOLECULAR PHYSICS. 1973; 25 (4): 985-987

3544

2173 PRIESTLE.EB, ROBINSON GW

APPARENT ABSENCE OF TRIPLET-TRIPLET ABSORPTION IN PURE ORGANIC MOLECULAR-CRYSTALS

MOLECULAR PHYSICS. 1973; 26 (1): 159-167

3545

2174 RATNER M, SABIN JR, BALL EE

SCF CALCULATION OF EFFECTIVE PARAMETERS FOR HUBBARD MODEL OF TCNQ CHARGE-TRANSFER SALTS

MOLECULAR PHYSICS. 1973; 26 (5): 1177-1184

3546

2175 DOUGLAS IN, GRINTER R, THOMSON AJ

MAGNETIC CIRCULAR-DICHROISM SPECTRUM OF B-12U[-A-11G TRANSITION OF BENZENE IN VAPOR-PHASE

MOLECULAR PHYSICS. 1973; 26 (5): 1257-1266

3547

2326 CHANDRA AK, SUDHINDR.BS

INTERMOLECULAR INTERACTIONS IN FORMATION OF AROMATIC HYDROCARBON DIMERS

MOLECULAR PHYSICS. 1974; 28 (3): 695-706

3548

2327 MORRIS JM

INTERMOLECULAR FORCES BETWEEN LARGE MOLECULES - STRUCTURE OF ANTHRACENE STABLE DIMERS

MOLECULAR PHYSICS. 1974; 28 (5): 1167-1176

3549

2455 MATSUMOTO S, NAGAKURA S, HAYASHI H

TRIPLET-STATES OF COMPLEXES WITH TETRACHLOROPHTHALIC ANHYDRIDE AND PHTHALIC ANHYDRIDE AS ELECTRON-ACCEPTORS

MOLECULAR PHYSICS. 1975; 29 (1): 167-176

3550

2456 HA TK

AB-INITIO SCF CI STUDY OF ELECTRONIC-SPECTRUM OF S-TETRAZINE

MOLECULAR PHYSICS. 1975; 29 (6): 1829-1846

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3551

2457 COULSON CA, GOMES JANF, MALLION RB

RING MAGNETIC-SUSCEPTIBILITIES IN CONJUGATED HYDROCARBONS

MOLECULAR PHYSICS. 1975; 30 (3): 713-732

3552

2458 EGE G, VOGLER H

SEMIEMPIRICAL CALCULATIONS OF MAGNETIC-PROPERTIES OF CONDENSED HYDROCARBONS

MOLECULAR PHYSICS. 1975; 30 (5): 1511-1519

3553

2459 DEKKERS HPJM, WESTRA SWT

MAGNETIC CIRCULAR-DICHROISM OF AZULENE

MOLECULAR PHYSICS. 1975; 30 (6): 1795-1811

3554

2571 MOOIJ JJ, DEBOER E

MAGNETIC-RESONANCE STUDY OF MONOANIONS OF CYCLOOCTATETRAENE AND 1,3,5,7-TETRAMETHYL CYCLOOCTATETRAENE, PRODUCED IN SINGLE-CRYSTALS OF K2C8H8 . DIGLYME, RB2C8H8 . DIGLYME AND K2(CH3)4C8H4 . DIGLYME2

MOLECULAR PHYSICS. 1976; 32 (1): 113-129

3555

2672 SPANGETLARSEN J, GLEITER R, HAIDER R, THULSTRUP EW

ELECTRONIC-STRUCTURE OF CYCLAZINES .1. PHOTOELECTRON-SPECTRUM AND POLARIZED ELECTRONIC ABSORPTION-SPECTRUM OF CYCLOPENTA[H]CYCL[4.2.2]AZINE

MOLECULAR PHYSICS. 1977; 34 (4): 1049-1061

3556

2803 VOS HW, MACLEAN C, VELTHORST NH

SEMIEMPIRICAL CALCULATIONS OF CHEMICAL-SHIFTS IN PARTIALLY PARATROPIC ANIONS

MOLECULAR PHYSICS. 1978; 35 (2): 329-347

3557

2804 TAKEKIYO S

ABINITIO CALCULATIONS OF PI-ELECTRONIC STRUCTURES OF PYRIDINE BY VALENCE-BOND METHOD

MOLECULAR PHYSICS. 1978; 35 (6): 1705-1711

3558

2917 KOOTER JA, VANDERWAALS JH, KNOP JV

CALCULATION OF THE SPIN-DENSITY AND SPIN-SPIN DIPOLAR INTERACTION IN THE TRIPLET-STATE OF METAL PORPHINS

MOLECULAR PHYSICS. 1979; 37 (4): 1015-1036

3559

2918 THULSTRUP EW, SPANGETLARSEN J, GLEITER R

ELECTRONIC-STRUCTURE OF PARA-TERPHENYL, 3,6-DIPHENYL-PYRIDAZINE AND 3,6-DIPHENYL-S-TETRAZINE - PHOTOELECTRON AND POLARIZED ABSORPTION- SPECTRA

MOLECULAR PHYSICS. 1979; 37 (5): 1381-1395

3560

3021 YIANOULIS P, NELSON RC

COULOMB EFFECT ON THE ENERGY-LEVELS IN MOLECULAR-CRYSTALS

MOLECULAR PHYSICS. 1980; 39 (1): 261-269

Date / Author / Journal

3561

GENERALIZED DIATOMICS-IN-MOLECULES THEORY .2. ZERO DIFFERENTIAL-OVERLAP APPROACH

MOLECULAR PHYSICS. 1980; 39 (5): 1287-1289

3562

3101 VOGLER H

CALCULATION OF THE ZERO-FIELD SPLITTING PARAMETERS-D OF BENZENOID HYDROCARBONS AND THEIR DEPENDENCE UPON THE MOLECULAR-STRUCTURE

MOLECULAR PHYSICS. 1981; 43 (1): 83-96

3563

3176 YIANOULIS P, NELSON RC

ELECTRON-AFFINITY OF ADSORBED DYE MONOLAYERS

MOLECULAR PHYSICS. 1982; 45 (2): 451-461

3564

3177 VOGLER H

[2.2]PARACYCLOPHANE - THEORETICAL-STUDY OF ITS LOWER EXCITED-STATES AND OF THE ZERO-FIELD SPLITTING PARAMETERS D

MOLECULAR PHYSICS. 1982; 47 (5): 1179-1193

3565

3341 CHANDRA AK, BHANUPRAKASH K, BHASU VCJ, SRIKANTHAN D

CHARGE-RESONANCE ENERGIES IN DIMER CATIONS OF AROMATICS

MOLECULAR PHYSICS. 1984; 52 (3): 733-741

3566

3590 KOBAYASHI H, KAIZU Y, KIMURA H, MATSUZAWA H

THE LOWEST METAL-TO-BIPYRIDINE CHARGE-TRANSFER EXCITED-STATE OF [CR(2,2'-BIPYRIDINE)(CO)4]

MOLECULAR PHYSICS. 1988 AUG 20; 64 (6): 1009-1030

3567

3614 POSHUSTA RD, SCHMALZ TG, KLEIN DJ

HEISENBERG-MODEL CLUSTER-EXPANSION FOR HALF-FILLED HUBBARD AND PPP MODELS

MOLECULAR PHYSICS. 1989 FEB 10; 66 (2): 317-332

3568

3777 RAMASESHA S, ALBERT IDL, SINHA B

OPTICAL AND MAGNETIC-PROPERTIES OF THE EXACT PPP STATES OF BIPHENYL

MOLECULAR PHYSICS. 1991 FEB 20; 72 (3): 537-547

3569

4124 SCHUTT J, SCHULTE J, BOHM MC, SOOS ZG

RESOLUTION OF THE SIGN PROBLEM IN QUANTUM MONTE-CARLO SIMULATIONS OF ANNULENES

MOLECULAR PHYSICS. 1995 APR 20; 84 (6): 1127-1137

3570

4137 SCHUTT J, BOHM MC

GREENS-FUNCTION QUANTUM MONTE-CARLO METHOD IN THE PRESENCE OF TOPOLOGICAL SIGN PROBLEMS - PI-ELECTRONIC SYSTEMS

MOLECULAR PHYSICS. 1995 AUG 20; 85 (6): 1217-1226

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4197 Chakrabarti A, Anusooya Y, Ramasesha S

Properties of the correlated electronic states of pyrene and hydrogenated pyrene

MOLECULAR PHYSICS. 1996 NOV; 89 (4): 1019-1032

3572

4272 Schutt J, Bohm MC

Convergence behaviour of Green's function quantum Monte Carlo simulations of pi electron systems

MOLECULAR PHYSICS. 1997 DEC 20; 92 (6): 997-1005

3573

4287 Schulte J, Bohm MC, Ramirez R

The isotope effect in electronic expectation values: an all-quantum study of C6H6 and C6D6

MOLECULAR PHYSICS. 1998 APR 10; 93 (5): 801-807

3574

4290 Linderberg J

Dissociative recombination: an electronic correlation problem

MOLECULAR PHYSICS. 1998 MAY; 94 (1): 99-104

3575

4475 Bytautas L, Ruedenberg K

Electron pairs, localized orbitals and electron correlation

MOLECULAR PHYSICS. 2002 MAR; 100 (6): 757-781

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4588 Staicu A, Rouille G, Sukhorukov O, Henning T, Huisken F

Cavity ring-down laser absorption spectroscopy of jet-cooled anthracene

MOLECULAR PHYSICS. 2004 AUG-SEP; 102 (16-17): 1777-1783

3577

4654 Meissner L

On perturbative corrections to excitation energies from configuration interaction singles

MOLECULAR PHYSICS. 2006 JUL 10; 104 (13-14): 2073-2083

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4738 Klimenko TA, Ivanov VV, Adamowicz L

Dipole polarizabilities and hyperpolarizabilities of the small conjugated systems in the -electron coupled cluster theory

MOLECULAR PHYSICS. 2009; 107 (17): 1729-1737

3579

4739 Hawke LGD, Kalosakas G, Simserides C

Empirical LCAO parameters for molecular orbitals in planar organic molecules

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4782 Ohrn Y, Linderberg J

Propagators and their implications

MOLECULAR PHYSICS. 2010; 108 (21-23): 2899-2904

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4152 Komatsuzaki T, Ohmine I

Proton transfer in liquid water .2. A semiempirical method to describe chemical reactions

MOLECULAR SIMULATION. 1996; 16 (4-6): 321-344

3582

4673 Bernardi RC, Gomes DEB, Ito AS, Ota AT, Pascutti PG, et al.

Density functional and molecular dynamics simulations of local anesthetics in 0.9% NaCl solution

MOLECULAR SIMULATION. 2007; 33 (14): 1135-1141

3583

2176 SAVIN FA, BAZHULIN.NP, MOROZOV YV

PI-ELECTRONIC STRUCTURE OF VARIOUS IONIC SPECIES OF 3-OXYPYRIDINE AND SOME OF ITS DERIVATIVES

MOLEKULYARNAYA BIOLOGIYA. 1973; 7 (5): 674-682

3584

1405 LESKA J

PI-ELECTRON STRUCTURE OF TRANS-1,2-DI-(PYRIDYL)-ETHYLENES .3. APPLICATION OF SCF-MO-CI METHOD

MONATSHEFTE FUR CHEMIE. 1969; 100 (2): 545-&

3585

1406 SCHUSTER P

OVERLAP IN SEMIEMPIRICAL LCAO-MO-SCF METHODS FOR ALL VALENCE ELECTRONS

MONATSHEFTE FUR CHEMIE. 1969; 100 (3): 1015-+

3586

1407 PASPALEE.E, KOJUCHAR.A

A STUDY OF BASICITIES OF ALPHA,OMEGA-DIPHENYL POLYENE KETONES

MONATSHEFTE FUR CHEMIE. 1969; 100 (4): 1213-&

3587

1596 LESKA J, LOOS D, ZAHRADNI.P

THEORETICAL STUDY OF GEOMETRICAL ISOMERS OF TETRAVINYL-ETHYLENE - (SCF- MO-CI-CALCULATIONS)

MONATSHEFTE FUR CHEMIE. 1970; 101 (4): 1025-&

3588

1597 GRUNDLER W

AN OMEGA HMO TREATMENT OF OMICRON AND PI ELECTRON SYSTEMS

MONATSHEFTE FUR CHEMIE. 1970; 101 (5): 1362-+

3589

1598 BONTSCHE.D, RATSCHIN E

ELECTRONIC STRUCTURE (SCF-CI) AND PHYSICAL PROPERTIES OF TRANS- AZOBENZENE AND ITS AMINO DERIVATIVES IN GROUND AND EXCITED STATE

MONATSHEFTE FUR CHEMIE. 1970; 101 (5): 1454-&

3590

1995 BONTSCHE.D, RATSCHIN E

THEORETICAL (SCF-CI-MO)-INVESTIGATION OF PHENYLAZONAPHTALENES AND AZONAPHTALENES IN GROUND AND EXCITED-STATE

MONATSHEFTE FUR CHEMIE. 1972; 103 (4): 1000-&

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3591

2919 MIENTUS W, HABERDITZL W, BARTEL HG

CONCERNING THE FORMALISM OF THE LCPO-MO-METHOD

MONATSHEFTE FUR CHEMIE. 1979; 110 (2): 351-363

3592

3023 MIENTUS W, BARTEL HG, HABERDITZL W, SPITZER HJ

THE CALCULATION OF ONE-ELECTRON INTEGRALS IN THE SCF-X-ALPHA-SW-METHOD .1. THE NORMALIZATION

MONATSHEFTE FUR CHEMIE. 1980; 111 (3): 597-606

3593

3102 KOITZ G, FABIAN W, SCHMIDT HW, JUNEK H

SYNTHESES WITH NITRILES .61. SYNTHESIS AND FLUORESCENCE OF CYANO- SUBSTITUTED 2-AMINOPYRIDINES

MONATSHEFTE FUR CHEMIE. 1981; 112 (8-9): 973-985

3594

3103 FABIAN W

THEORETICAL INVESTIGATIONS ON THE ABSORPTION AND FLUORESCENCE OF CYANO- SUBSTITUTED 2-AMINOPYRIDINES

MONATSHEFTE FUR CHEMIE. 1981; 112 (11): 1271-1277

3595

3178 NAMBOODIRI KPK, VISWANATHAN S, GANESAN R, BHASU VCJ

CRESOLS - AN INVESTIGATION INTO THEIR ELECTRONIC-STRUCTURE AND SPECTRA

MONATSHEFTE FUR CHEMIE. 1982; 113 (8-9): 949-963

3596

3342 FABIAN W

ON THE INTERPRETATION OF THE ABSORPTION CHARACTERISTICS OF ISOMERIC DIAMINO-METHOXY-PYRIDINECARBONITRILES

MONATSHEFTE FUR CHEMIE. 1984; 115 (12): 1421-1427

3597

3582 IDRISS KA, SELEIM MM, ELSHAHAWY AS, SALEH MS, SEDAIRA H

EFFECT OF THE VARYING PI-ACCEPTING PROPERTIES OF SOME ORTHO-SUBSTITUTED BENZOIC-ACIDS ON THE STABILITY OF MIXED-LIGAND COMPLEXES ALSO CONTAINING QUINIZARIN AND THORIUM(IV)

MONATSHEFTE FUR CHEMIE. 1988 JUN-JUL; 119 (6-7): 683-691

3598

3607 PINDUR U, PFEUFFER L

NEW STRUCTURAL ASPECTS OF 3-VINYL-1H-INDOLES FOR PREDICTING THE OUTCOME OF DIELS-ALDER REACTIONS

MONATSHEFTE FUR CHEMIE. 1989 JAN; 120 (1): 27-34

3599

3642 GUSTAV K, COLDITZ R, STEEN D

THEORETICAL INVESTIGATIONS ON MOLECULAR-STRUCTURE AND SPECTROSCOPY OF BENZOPYRYLIUM COMPOUNDS - COMPLETELY-OPTIMIZED S0 AND S1 MOLECULAR GEOMETRIES OF THE 2-PHENYL BENZOPYRYLIUM ION AND INFLUENCE OF SUBSTITUTION ON ITS ELECTRONIC SPECTRAL BEHAVIOR IN ABSORPTION AND FLUORESCENCE

MONATSHEFTE FUR CHEMIE. 1989 AUG-SEP; 120 (8-9): 715-719

3600

4179 Etzlstorfer C, Falk H, Muller N, Tran TNH

Structural aspects and electronic absorption of the hydroxyphenanthroperylene quinones fringelit D, hypericin, and stentorin

MONATSHEFTE FUR CHEMIE. 1996 JUN-JUL; 127 (6-7): 659-668

papers citing Rudy Pariser Publications by Rudy Pariser and the papers citing R Pariser	Historiographs	Glossary HistCite Guide About Grand Totals: LCS 29242, GCS 189873, CR 195260 Collection span: 1948 - 2011
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