HistCite - papers citing Rudy Pariser

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#	Date / Author / Journal	LCS	GCS	LCR	CR
701	2608 BAUMANN W DIPOLE-MOMENTS AND POLARIZABILITIES OF AZULENE IN ITS GROUND-STATE AND 1ST AND 2ND EXCITED SINGLET-STATE CHEMICAL PHYSICS. 1977; 20 (1): 17-24	2	18	10	30
702	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
703	2691 DEWAR MJS, THIEL W SEMIEMPIRICAL MODEL FOR 2-CENTER REPULSION INTEGRALS IN NDDO APPROXIMATION THEORETICA CHIMICA ACTA. 1977; 46 (2): 89-104	4	151	10	28
704	2705 DINYA Z, BENKO P, KISS AI, PALLOS L, BERENYI E, et al. QUANTUM CHEMICAL INVESTIGATIONS ON PYRIDO-AS-TRIAZINE AND QUINOLINO-AS- TRIAZINES .1. PYRIDO-AS-TRIAZINE UNSUBSTITUTED SYSTEMS ACTA CHIMICA ACADEMIAE SCIENTARIUM HUNGARICAE. 1978; 96 (1): 61-74	0	3	10	30
705	2755 CHATTERJEE S, DASGUPTA NK PI-ELECTRON STRUCTURE AND RESONANCE STABILIZATION IN DINAPHTHOAZULENE - THEORETICAL-STUDY INDIAN JOURNAL OF CHEMISTRY SECTION B-ORGANIC CHEMISTRY INCLUDING MEDICINAL CHEMISTRY. 1978; 16 (2): 137-138	0	0	10	22
706	2765 GILLISPIE GD, LIM EC VIBRATIONAL ANALYSIS OF S2-]S1 FLUORESCENCE OF AZULENE IN A NAPHTHALENE MIXED-CRYSTAL AT 4.2 K JOURNAL OF CHEMICAL PHYSICS. 1978; 68 (10): 4578-4586	6	58	10	30
707	2785 KAITO A, HATANO M EXPERIMENTAL AND THEORETICAL STUDIES ON MAGNETIC CIRCULAR-DICHROISM OF AZANAPHTHALENES - USE OF CNDO-S-CL APPROXIMATION JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. 1978; 100 (13): 4037-4044	2	15	10	45
708	2815 KNOP JV, TRINAJSTIC N, MILUN M, PEJAKOVIC S CONFORMATIONAL-ANALYSIS AND ELECTRONIC-STRUCTURE OF THIENYL-PYRIDINES REVUE ROUMAINE DE CHIMIE. 1978; 23 (1): 103-110	0	3	10	48
709	2822 WEISSENFELS M, PUNKT J PHOTOABSORPTION AND COMPOSITION OF HETEROCYCLIC 1,2-ENEDIOLS TETRAHEDRON. 1978; 34 (3): 311-316	0	10	10	53
710	2828 KLESSINGER M MOLECULAR-ORBITAL CALCULATIONS BASED ON LINEAR COMBINATIONS OF FRAGMENT ORBITALS .1. BASIC THEORY AND INTERPRETATION OF PE SPECTRA OF PI- SYSTEMS THEORETICA CHIMICA ACTA. 1978; 49 (1): 77-92	3	27	10	75
#	Date / Author / Journal	LCS	GCS	LCR	CR
711	2858 OHNO K STUDY OF EXCITED-STATE MOLECULAR VIBRATIONS OF AROMATIC-HYDROCARBONS CHEMICAL PHYSICS LETTERS. 1979; 64 (3): 560-566	4	24	10	63
712	2862 YAMAGUCHI H, HIGASHI M MAGNETIC CIRCULAR-DICHROISM SPECTRA OF TRIPHENYLENE AND CORONENE CHEMICAL PHYSICS LETTERS. 1979; 68 (1): 77-80	2	9	10	19
713	2878 HILAL R CLOSED-SHELL SCF-CI MO TREATMENT OF ALL-REACTIVE ELECTRONS IN COMPLEX HETEROORGANIC MOLECULES INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY. 1979; 15 (1): 37-47	1	3	10	35
714	2889 VRIES HD, WIERSMA DA FLUORESCENCE TRANSIENT AND OPTICAL FREE INDUCTION DECAY SPECTROSCOPY OF PENTACENE IN MIXED-CRYSTALS AT 2-K - DETERMINATION OF INTERSYSTEM CROSSING AND INTERNAL-CONVERSION RATES JOURNAL OF CHEMICAL PHYSICS. 1979; 70 (12): 5807-5822	0	2	10	81
715	2900 HAQUE MA, SANNIGRAHI AB, NIYOGI BG ELECTRONIC-SPECTRUM OF BORAZINE JOURNAL OF PHYSICAL CHEMISTRY. 1979; 83 (10): 1348-1349	0	1	10	21
716	2959 SIMKIN BY, GLUKHOVTSEV MN, MINKIN VI HARTREE-FOCK INSTABILITY IN CONNECTION WITH THE STRUCTURE AND GEOMETRY OF SOME CONJUGATED MOLECULES CHEMICAL PHYSICS LETTERS. 1980; 71 (2): 284-289	0	15	10	46
717	2965 YAMAGUCHI H, NINOMIYA K, OGATA M THE POSITION DEPENDENCE OF THE SCF SCREENED POTENTIAL IN SEVERAL NON- BENZENOID HYDROCARBONS CONTAINING A 4-MEMBERED RING CROATICA CHEMICA ACTA. 1980; 53 (4): 675-685	0	0	10	32
718	2970 GUPTA D, JAISWAL RMP PI-STAR-PI-SYSTEMS IN THE QUARTZ ULTRAVIOLET ELECTRONIC ABSORPTION- SPECTRA OF SOME DISUBSTITUTED AND TRISUBSTITUTED ACETOPHENONES INDIAN JOURNAL OF PURE & APPLIED PHYSICS. 1980; 18 (5): 332-336	1	2	10	34
719	3013 DOHNERT D, KOUTECKY J OCCUPATION NUMBERS OF NATURAL ORBITALS AS A CRITERION FOR BIRADICAL CHARACTER - DIFFERENT KINDS OF BIRADICALS JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. 1980; 102 (6): 1789-1796	7	130	10	86
720	3014 ZIMMERMAN HE, FACTOR RE PHOTOCHEMISTRY .121. THE BICYCLE REARRANGEMENT - RELATIONSHIP TO THE DI-PI-METHANE REARRANGEMENT AND CONTROL BY BIFUNNEL DISTORTION - MECHANISTIC AND EXPLORATORY ORGANIC-PHOTOCHEMISTRY JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. 1980; 102 (10): 3538-3548	0	35	10	91
#	Date / Author / Journal	LCS	GCS	LCR	CR
721	3053 IGARASHI N, TAJIRI A, HATANO M THE MAGNETIC CIRCULAR-DICHROISM OF THE CONJUGATED O-HETEROCYCLES AND S- HETEROCYCLE BULLETIN OF THE CHEMICAL SOCIETY OF JAPAN. 1981; 54 (5): 1511-1516	3	23	10	32
722	3058 FREUND HJ, BIGELOW RW SHAKE-UP PHENOMENA IN D+-AR-A-STRUCTURES - A CNDO-S EQUIVALENT CORE STUDY ON N,N-DIMETHYL-PARA-NITROANILINE IN THE VAPOR AND CONDENSED PHASES CHEMICAL PHYSICS. 1981; 55 (3): 407-427	9	45	10	77
723	3062 PHILIS J, PANTOS E, ANDRITSOPOULOS G, BOLOVINOS A, IOANNIDOU A DETECTION OF THE PI-PI-STAR E2G STATE IN SYM-TETRAFLUOROBENZENE CHEMICAL PHYSICS LETTERS. 1981; 77 (3): 623-626	0	4	10	35
724	3097 YAMAGUCHI H, UCHIDA A, YONEDA F, BAUMANN H MAGNETIC CIRCULAR-DICHROISM SPECTRA AND ELECTRONIC-SPECTRA OF BENZODIAZOLES JOURNAL OF THE CHEMICAL SOCIETY-FARADAY TRANSACTIONS II. 1981; 77: 947-954	1	10	10	41
725	3133 ANGLIKER H, ROMMEL E, WIRZ J ELECTRONIC-SPECTRA OF HEXACENE IN SOLUTION (GROUND-STATE, TRIPLET- STATE, DICATION AND DIANION) CHEMICAL PHYSICS LETTERS. 1982; 87 (2): 208-212	4	13	10	35
726	3136 GUPTA D, JAISWAL RMP EVALUATION OF SOME MOLECULAR-PROPERTIES OF DISUBSTITUTED AND TRI- SUBSTITUTED ACETOPHENONES BY A (PPP-CI) METHOD INDIAN JOURNAL OF PURE & APPLIED PHYSICS. 1982; 20 (12): 945-948	0	0	10	28
727	3153 BIGELOW RW, FREUND HJ THE CORE-HOLE EXCITATION SPECTRUM OF BENZENE - A SYMMETRY-ADAPTED CNDO/S EQUIVALENT-CORE STUDY INCLUDING SPIN-SYMMETRY BREAKING CONFIGURATIONS JOURNAL OF CHEMICAL PHYSICS. 1982; 77 (11): 5552-5561	3	19	10	61
728	3176 YIANOULIS P, NELSON RC ELECTRON-AFFINITY OF ADSORBED DYE MONOLAYERS MOLECULAR PHYSICS. 1982; 45 (2): 451-461	0	4	10	28
729	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
730	3204 GOODMAN L, RAVA RP 2-PHOTON SPECTROSCOPY OF PERTURBED BENZENES ADVANCES IN CHEMICAL PHYSICS. 1983; 54: 177-230	7	44	10	83
#	Date / Author / Journal	LCS	GCS	LCR	CR
731	3216 BIGELOW RW BREAKDOWN IN THE KOOPMANS THEOREM INTERPRETATION OF THE OUTER VALENCE- LEVEL PHOTOEMISSION SPECTRA OF SELECTED ORGANIC-MOLECULES CHEMICAL PHYSICS. 1983; 80 (1-2): 45-62	8	30	10	82
732	3263 MAYNAU D, DURAND P, DAUDEY JP, MALRIEU JP DIRECT DETERMINATION OF EFFECTIVE-HAMILTONIANS BY WAVE-OPERATOR METHODS .2. APPLICATION TO EFFECTIVE-SPIN INTERACTIONS IN PI-ELECTRON SYSTEMS PHYSICAL REVIEW A. 1983; 28 (6): 3193-3206	8	49	10	56
733	3276 JUNG C, RISTAU O, JUNG C AN INDO-CI METHOD IN PI-APPROXIMATION FOR THE CALCULATION OF TRANSITION-METAL COMPLEXES WITH ORGANIC-LIGANDS - APPLICATION TO IRON(II)-TRISDIIMINE COMPLEXES THEORETICA CHIMICA ACTA. 1983; 63 (2): 143-159	0	11	10	38
734	3307 EDWARDS WD, OHRN NY, WEINER BL, ZERNER MC SEMIEMPIRICAL ANTISYMMETRIZED GEMINAL POWER CALCULATION FOR MOLECULAR- SPECTRA INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY. 1984; : 507-517	0	0	10	36
735	3309 DEBRUIJN S ANALYSIS OF THE INADEQUACIES OF SOME SEMI-EMPIRICAL MO METHODS AS THEORIES OF STRUCTURE AND REACTIVITY INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY. 1984; 25 (2): 367-390	7	25	10	45
736	3360 ABUEITTAH RH, ALSUGEIR FA STUDIES ON THE ELECTRONIC ABSORPTION-SPECTRA OF 2,2'-BITHIENYL AND SOME OF ITS DERIVATIVES - A MOLECULAR-ORBITAL TREATMENT BULLETIN OF THE CHEMICAL SOCIETY OF JAPAN. 1985; 58 (7): 2126-2132	1	25	10	36
737	3373 ORLANDI G, ZERBETTO F VIBRONIC COUPLING BETWEEN THE LOWEST ELECTRONIC STATES OF BIPHENYL CHEMICAL PHYSICS LETTERS. 1985; 120 (2): 140-146	10	24	10	46
738	3393 MALRIEU JP, DURAND P, DAUDEY JP INTERMEDIATE HAMILTONIANS AS A NEW CLASS OF EFFECTIVE-HAMILTONIANS JOURNAL OF PHYSICS A-MATHEMATICAL AND GENERAL. 1985; 18 (5): 809-826	1	263	10	33
739	3395 HEMLEY RJ, DINUR U, VAIDA V, KARPLUS M THEORETICAL-STUDY OF THE GROUND AND EXCITED SINGLET-STATES OF STYRENE JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. 1985; 107 (4): 836-844	2	42	10	66
740	3401 RAZUMOVA TK, STAROBOGATOV IO 2-PHOTON ABSORPTION OF TETRACENE SOLUTION OPTIKA I SPEKTROSKOPIYA. 1985; 58 (2): 241-243	1	3	10	14
#	Date / Author / Journal	LCS	GCS	LCR	CR
741	3403 RAMASESHA S, SOOS ZG STATIC SPIN CORRELATIONS IN ALTERNANT QUANTUM CELL MODELS PHYSICAL REVIEW B. 1985; 32 (8): 5368-5374	2	15	10	54
742	3463 TAKAHASHI M, PALDUS J TIME-DEPENDENT COUPLED CLUSTER APPROACH - EXCITATION-ENERGY CALCULATION USING AN ORTHOGONALLY SPIN-ADAPTED FORMALISM JOURNAL OF CHEMICAL PHYSICS. 1986 AUG 1; 85 (3): 1486-1501	5	96	10	63
743	3505 WANG XC, FREED KF ELECTRONIC-STRUCTURE AND BOND LENGTH DEPENDENCE OF THE EFFECTIVE VALENCE SHELL HAMILTONIAN OF S-2 AS STUDIED BY QUASI-DEGENERATE MANY- BODY PERTURBATION-THEORY JOURNAL OF CHEMICAL PHYSICS. 1987 MAR 1; 86 (5): 2899-2908	0	31	10	34
744	3514 ORLANDI G, ZERBETTO F QUANTUM-MECHANICAL CALCULATION OF VIBRONIC EFFECTS ON THE S2-S0 TRANSITION OF AZULENE CHEMICAL PHYSICS. 1987 APR 15; 113 (2): 167-173	2	18	10	29
745	3538 ZERBETTO F, ZGIERSKI MZ, ORLANDI G, MARCONI G VIBRONIC COUPLING IN POLYENES AND THEIR DERIVATIVES - INTERPRETATION OF THE ABSORPTION AND EMISSION-SPECTRA OF A DERIVATIVE OF DODECAHEXAENE JOURNAL OF CHEMICAL PHYSICS. 1987 SEP 1; 87 (5): 2505-2512	7	43	10	30
746	3551 LARSSON S, BROO A, KALLEBRING B, VOLOSOV A LONG-DISTANCE ELECTRON-TRANSFER INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY. 1988; : 1-22	2	7	10	126
747	3564 JONES RD, CALLIS PR 2-PHOTON SPECTRA OF INDUCTIVELY PERTURBED NAPHTHALENES CHEMICAL PHYSICS LETTERS. 1988 FEB 19; 144 (2): 158-164	2	13	10	25
748	3612 DIRK CW, KUZYK MG MISSING-STATE ANALYSIS - A METHOD FOR DETERMINING THE ORIGIN OF MOLECULAR NONLINEAR OPTICAL-PROPERTIES PHYSICAL REVIEW A. 1989 FEB 1; 39 (3): 1219-1226	3	42	10	28
749	3644 FORNER W, LADIK J, HOFMANN D, SEEL M, GODZIK A, et al. SOLITON DYNAMICS IN ALTERNATING TRANS-POLYACETYLENE AND IN STACKED SYSTEMS THEOCHEM-JOURNAL OF MOLECULAR STRUCTURE. 1989 AUG; 57 (3-4): 231-260	0	0	10	108
750	3649 SPRINGBORG M, KIESS H, HEDEGARD P MODEL-CALCULATIONS OF PI-ELECTRON SPECTRA OF CONJUGATED POLYMERS SYNTHETIC METALS. 1989 SEP; 31 (3): 281-310	0	9	10	52
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751	3677 FREIERMUTH B, GERBER S, RIESEN A, WIRZ J, ZEHNDER M MOLECULAR AND ELECTRONIC-STRUCTURE OF PYRACYLENE JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. 1990 JAN 17; 112 (2): 738-744	0	44	10	69
752	3706 NEGRI F, ORLANDI G, LANGKILDE FW, WILBRANDT R A QUANTUM CHEMICAL-ANALYSIS OF THE TIME-RESOLVED RESONANCE RAMAN- SPECTRUM OF 2,5-DIMETHYL-2,4-HEXADIENE IN THE T1 STATE JOURNAL OF CHEMICAL PHYSICS. 1990 APR 15; 92 (8): 4907-4919	3	19	10	65
753	3755 BICH VT, BINI R, SALVI PR, MARCONI G 2-PHOTON SPECTROSCOPY OF ANTIAROMATIC MOLECULES - THE CASE OF BIPHENYLENE CHEMICAL PHYSICS LETTERS. 1990 DEC 21; 175 (5): 413-418	4	13	10	34
754	3769 KANIS DR, RATNER MA, MARKS TJ, ZERNER MC NONLINEAR OPTICAL CHARACTERISTICS OF NOVEL INORGANIC CHROMOPHORES USING THE ZINDO FORMALISM CHEMISTRY OF MATERIALS. 1991 JAN-FEB; 3 (1): 19-22	5	71	10	55
755	3784 BAKER JD, ZERNER MC A CHARGE-ITERATIVE HAMILTONIAN FOR MOLECULAR ELECTRONIC-SPECTRA JOURNAL OF PHYSICAL CHEMISTRY. 1991 MAR 21; 95 (6): 2307-2311	2	13	10	36
756	3788 MCWILLIAMS PCM, HAYDEN GW, SOOS ZG THEORY OF EVEN-PARITY STATES AND 2-PHOTON SPECTRA OF CONJUGATED POLYMERS PHYSICAL REVIEW B. 1991 APR 15; 43 (12): 9777-9791	25	101	10	95
757	3791 BLAISE P, BREYSSE P, HENRIROUSSEAU O, MALRIEU JP, MAYNAU D THE TRANSFERABILITY OF EFFECTIVE EXCHANGE INTEGRALS IN THE NONEMPIRICAL EFFECTIVE VALENCE BOND HAMILTONIAN - A MINIMAL BASIS STUDY OF HN SYSTEMS THEOCHEM-JOURNAL OF MOLECULAR STRUCTURE. 1991 MAY 6; 75: 219-247	0	0	10	27
758	3792 LEJEUNE V, BERTHIER G, DESPRES A, MIGIRDICYAN E CHANGE IN THE DISTRIBUTION OF UNPAIRED ELECTRONS INDUCED BY THE TRIPLET TRIPLET EXCITATION OF META-XYLYLENE BIRADICALS JOURNAL OF PHYSICAL CHEMISTRY. 1991 MAY 16; 95 (10): 3895-3897	0	6	10	28
759	3794 ANTONOVA T, NESHEV N, PROINOV EI, NALEWAJSKI RF RIGID AND RELAXED DIAGONAL ORBITAL HARDNESSES OF THE VALENCE SHELL OF TRANSITION-METAL IONS FROM X-ALPHA CALCULATIONS ACTA PHYSICA POLONICA A. 1991 JUN; 79 (6): 805-815	1	4	10	33
760	3797 SMITH AE, LINDNER HJ PI-SCF-MOLECULAR MECHANICS PIMM - FORMULATION, PARAMETERS, APPLICATIONS JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN. 1991 JUN; 5 (3): 235-262	0	46	10	116
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761	3813 KARNA SP, LASKOWSKI Z, TALAPATRA GB, PRASAD PN COMPARATIVE-STUDY OF THE NONLINEAR OPTICAL-PROPERTIES OF EXTENDED PI- ELECTRON STRUCTURES OBTAINED BY ABINITIO AND INDO METHODS - HEXAPENTAENE, HEXADIYNE, AND DIVINYLACETYLENE JOURNAL OF PHYSICAL CHEMISTRY. 1991 AUG 22; 95 (17): 6508-6511	0	21	10	41
762	3814 PEREZ J, DUPUIS M HYDROGEN-BONDS AND (HYPER)POLARIZABILITIES IN MOLECULAR-CRYSTALS - AN ABINITIO SCF STUDY OF UREA JOURNAL OF PHYSICAL CHEMISTRY. 1991 AUG 22; 95 (17): 6525-6529	0	35	10	46
763	3847 KOTZIAN M, ROSCH N, ZERNER MC INTERMEDIATE NEGLECT OF DIFFERENTIAL-OVERLAP SPECTROSCOPIC STUDIES ON LANTHANIDE COMPLEXES .1. SPECTROSCOPIC PARAMETRIZATION AND APPLICATION TO DIATOMIC LANTHANIDE OXIDES LNO (LN = LA, CE, GD, AND LU) THEORETICA CHIMICA ACTA. 1992 JAN; 81 (4-5): 201-222	7	69	10	76
764	3850 FORESMAN JB, HEADGORDON M, POPLE JA, FRISCH MJ TOWARD A SYSTEMATIC MOLECULAR-ORBITAL THEORY FOR EXCITED-STATES JOURNAL OF PHYSICAL CHEMISTRY. 1992 JAN 9; 96 (1): 135-149	26	1611	10	117
765	3886 SOOS ZG, ETEMAD S, GALVAO DS, RAMASESHA S FLUORESCENCE AND TOPOLOGICAL GAP OF CONJUGATED PHENYLENE POLYMERS CHEMICAL PHYSICS LETTERS. 1992 JUL 3; 194 (4-6): 341-346	12	80	10	42
766	3896 RAMASESHA S, ALBERT IDL A COMPARATIVE THEORETICAL-STUDY OF HIGHER HARMONIC-GENERATION AND ELECTROOPTIC EFFECTS IN POLYENE SYSTEMS CHEMICAL PHYSICS LETTERS. 1992 AUG 14; 196 (3-4): 287-293	2	4	10	39
767	3931 MAN KF, TRAJMAR S, MCCONKEY JW, RATLIFF JM, KHAKOO M EXCITATION OF ANTHRACENE (C14H10) BY ELECTRON-IMPACT JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS. 1992 DEC 14; 25 (23): 5245-5256	1	3	10	37
768	4031 SELCO JI, BROOKS T, CHANG M, TRIEU MT, MCDONALD JK, et al. SOLUTION PHOTOCHEMISTRY OF AZULENE JOURNAL OF ORGANIC CHEMISTRY. 1994 JAN 28; 59 (2): 429-433	0	9	10	43
769	4087 REIMERS JR, HUSH NS THE INFLUENCE OF SPIN-FORBIDDEN MONOMER EXCITATIONS ON SPIN-ALLOWED ELECTRON-TRANSFER AND ELECTRON-LOCALIZED STATES OF MIXED-VALENCE AND SINGLE-VALENCE DIMERIC SYSTEMS INORGANICA CHIMICA ACTA. 1994 NOV; 226 (1-2): 33-42	0	21	10	50
770	4148 Roos BO, Andersson K, Fulscher MP, Malmqvist PA, SerranoAndres L, et al. Multiconfigurational perturbation theory: Applications in electronic spectroscopy ADVANCES IN CHEMICAL PHYSICS, VOL XCIII. 1996; 93: 219-331	4	407	10	217
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771	4340 Damjanovic A, Ritz T, Schulten K Energy transfer between carotenoids and bacteriochlorophylls in light- harvesting complex II of purple bacteria PHYSICAL REVIEW E. 1999 MAR; 59 (3): 3293-3311	7	106	10	68
772	4366 Tretiak S, Zhang WM, Chernyak V, Mukamel S Excitonic couplings and electronic coherence in bridged naphthalene dimers PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA. 1999 NOV 9; 96 (23): 13003-13008	1	34	10	72
773	4372 Ramasesha S, Pati SK, Shuai Z, Bredas JL The density matrix renormalization group method: Application to the low-lying electronic states in conjugated polymers ADVANCES IN QUANTUM CHEMISTRY, VOL 38. 2000; 38: 121-215	8	18	10	235
774	4404 Bohm MC, Saal C Quantum statistical analysis of superconductivity, fractional quantum Hall effect, and aromaticity INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY. 2000 AUG 15; 79 (3): 125-162	1	10	10	121
775	4408 Bito Y, Shida N, Toru T Ab initio MRSD-CI calculations of the ground and the two lowest-lying excited states of pyrene CHEMICAL PHYSICS LETTERS. 2000 SEP 29; 328 (3): 310-315	0	18	10	34
776	4409 Damjanovic A, Ritz T, Schulten K Excitation transfer in the peridinin-chlorophyll-protein of Amphidinium carterae BIOPHYSICAL JOURNAL. 2000 OCT; 79 (4): 1695-1705	2	61	10	44
777	4571 Koyama Y, Rondonuwu FS, Fujii R, Watanabe Y Light-harvesting function of carotenoids in photo-synthesis: The roles of the newly found 1(1)B(u)(-) state BIOPOLYMERS. 2004 MAY-JUN; 74 (1-2): 2-18	8	44	10	37
778	4591 Forner W Theoretical study of bipolaron dynamics in polyparaphenylene: I. Derivation of the formalism and density functional (DFT) calculations on neutral and charged model systems JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM. 2004 AUG 31; 682 (1-3): 115-136	1	2	10	43
779	4611 Yanagi K, Gardiner AT, Cogdell RJ, Hashimoto H Electroabsorption spectroscopy of beta-carotene homologs: Anomalous enhancement of Delta mu PHYSICAL REVIEW B. 2005 MAY; 71 (19): Art. No. 195118	0	6	10	79
780	4623 Xiang JF, Rondonuwu FS, Kakitani Y, Fujii R, Watanabe Y, et al. Mechanisms of electron injection from retinoic acid and carotenoic acids to TiO2 nanoparticles and charge recombination via the T-1 state as determined by subpicosecond to microsecond time-resolved absorption spectroscopy: Dependence on the conjugation length JOURNAL OF PHYSICAL CHEMISTRY B. 2005 SEP 15; 109 (36): 17066-17077	0	15	10	40
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781	4680 Yamakita Y, Kimura J, Ohno K Molecular vibrations of [n]oligoacenes (n=2-5 and 10) and phonon dispersion relations of polyacene JOURNAL OF CHEMICAL PHYSICS. 2007 FEB 14; 126 (6): Art. No. 064904	0	7	10	130
782	4696 Hachmann J, Dorando JJ, Aviles M, Chan GKL The radical character of the acenes: A density matrix renormalization group study JOURNAL OF CHEMICAL PHYSICS. 2007 OCT 7; 127 (13): Art. No. 134309	1	86	10	81
783	4752 Baba M, Saitoh M, Taguma K, Shinohara K, Yoshida K, et al. Structure and excited-state dynamics of anthracene: Ultrahigh- resolution spectroscopy and theoretical calculation JOURNAL OF CHEMICAL PHYSICS. 2009 APR 7; 130 (13): Art. No. 134315	0	4	10	39
784	4792 Kukushkin AK, Jalkanen KJ Role of quantum chemical calculations in molecular biophysics with a historical perspective THEORETICAL CHEMISTRY ACCOUNTS. 2010 MAR; 125 (3-6): 121-144	0	0	10	245
785	4850 Avci D Second and third-order nonlinear optical properties and molecular parameters of azo chromophores: Semiempirical analysis SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY. 2011 NOV; 82 (1): 37-43	0	0	10	76
786	131 OOSHIKA Y A SEMI-EMPIRICAL THEORY OF THE CONJUGATED SYSTEMS .1. GENERAL FORMULATION JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN. 1957; 12 (11): 1238-1245	24	106	9	25
787	136 MCWEENY R, PEACOCK TE THE ELECTRONIC STRUCTURE AND SPECTRA OF SOME NITROGEN HETEROBENZENES PROCEEDINGS OF THE PHYSICAL SOCIETY OF LONDON SECTION A. 1957; 70 (1): 41-50	47	106	9	27
788	194 BROWN RD, HEFFERNAN ML THE VARIABLE ELECTRONEGATIVITY METHOD .5. PYRIDINE, THE PYRIDINIUM CATION, AND THE EVALUATION OF CORE-ATTRACTION INTEGRALS AUSTRALIAN JOURNAL OF CHEMISTRY. 1959; 12 (4): 554-568	27	82	9	22
789	195 MATAGA N, NISHIMOTO K, MATAGA S REMARKS ON THE MOLECULAR CALCULATION OF NAPHTHALENE AND ANTHRACENE BULLETIN OF THE CHEMICAL SOCIETY OF JAPAN. 1959; 32 (4): 395-399	10	16	9	22
790	236 ANNO T SEMIEMPIRICAL CALCULATION ON THE ELECTRONIC STRUCTURE OF THE NITROGEN- CONTAINING HETEROCYCLIC MOLECULES .4. ELECTRONIC STRUCTURE OF PYRIDINE JOURNAL OF CHEMICAL PHYSICS. 1960; 32 (3): 867-871	13	20	9	34
#	Date / Author / Journal	LCS	GCS	LCR	CR
791	294 BABA H ELECTRONIC SPECTRA OF SUBSTITUTED AROMATIC HYDROCARBONS .1. PHENOL AND ANILINE BULLETIN OF THE CHEMICAL SOCIETY OF JAPAN. 1961; 34 (1): 76-82	21	61	9	28
792	307 MCEWEN KL ELECTRONIC STRUCTURES AND SPECTRA OF SOME NITROGEN-OXYGEN COMPOUNDS JOURNAL OF CHEMICAL PHYSICS. 1961; 34 (2): 547-&	19	132	9	31
793	385 BENJEMIA H, LEFEBVRE R SUR LE CALCUL DES DENSITES DE SPIN DES RADICAUX AROMATIQUES JOURNAL DE CHIMIE PHYSIQUE ET DE PHYSICO-CHIMIE BIOLOGIQUE. 1962; 59 (7-8): 754-758	1	2	9	21
794	391 KEARNS DR DETERMINATION OF ASSIGNMENT OF TRIPLET STATES IN CATACONDENSED AROMATIC HYDROCARBONS JOURNAL OF CHEMICAL PHYSICS. 1962; 36 (6): 1608-&	37	80	9	44
795	450 YEVSTIGNEYEV VB MECHANISM OF PHOTOSENSITIZING ACTION OF CHLOROPHYLL IN VITRO BIOPHYSICS-USSR. 1963; 8 (6): 715-&	0	0	9	119
796	460 ITOH M, OKAMOTO T, NAGAKURA S THE ELECTRON SPIN RESONANCE AND ELECTRONIC SPECTRA OF THE ANION RADICALS OF 4-NITROPYRIDINE AND 4-NITROPYRIDINE 1-OXIDE BULLETIN OF THE CHEMICAL SOCIETY OF JAPAN. 1963; 36 (12): 1665-1672	3	24	9	39
797	464 PALDUS J QUANTUM CHEMICAL STUDY OF TRANSANNULAR INTERACTION .3. MODEL OF (N,N)PARACYCLOPHANES IN AUGMENTED TIGHT-BINDING APPROXIMATION NOT CONSIDERING BENZENE RING DISTORTION COLLECTION OF CZECHOSLOVAK CHEMICAL COMMUNICATIONS. 1963; 28 (5): 1110-&	4	9	9	20
798	472 GERSON F, JOOP N, ZIMMERMANN H, HEILBRONNER E ELEKTRONENSPEKTRUM UND BASIZITAT DES CYCL[3.2.2]AZINS HELVETICA CHIMICA ACTA. 1963; 46 (6): 1940-&	2	22	9	24
799	476 BAUDET J, BERTHIER G CONFIGURATIONS ELECTRONIQUES INCOMPLETES .3. LES PREMIERS NIVEAUX DENERGIE DU RADICAL BENZYLE JOURNAL DE CHIMIE PHYSIQUE ET DE PHYSICO-CHIMIE BIOLOGIQUE. 1963; 60 (10): 1161-1172	6	24	9	47
800	505 NISHIMOTO K ELECTRONIC SPECTRA AND STRUCTURE OF ALPHA- AND BETA-NAPHTHOL JOURNAL OF PHYSICAL CHEMISTRY. 1963; 67 (7): 1443-&	11	43	9	23

Date / Author / Journal

701

DIPOLE-MOMENTS AND POLARIZABILITIES OF AZULENE IN ITS GROUND-STATE AND 1ST AND 2ND EXCITED SINGLET-STATE

CHEMICAL PHYSICS. 1977; 20 (1): 17-24

702

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

703

2691 DEWAR MJS, THIEL W

SEMIEMPIRICAL MODEL FOR 2-CENTER REPULSION INTEGRALS IN NDDO APPROXIMATION

THEORETICA CHIMICA ACTA. 1977; 46 (2): 89-104

151

704

2705 DINYA Z, BENKO P, KISS AI, PALLOS L, BERENYI E, et al.

QUANTUM CHEMICAL INVESTIGATIONS ON PYRIDO-AS-TRIAZINE AND QUINOLINO-AS- TRIAZINES .1. PYRIDO-AS-TRIAZINE UNSUBSTITUTED SYSTEMS

ACTA CHIMICA ACADEMIAE SCIENTARIUM HUNGARICAE. 1978; 96 (1): 61-74

705

2755 CHATTERJEE S, DASGUPTA NK

PI-ELECTRON STRUCTURE AND RESONANCE STABILIZATION IN DINAPHTHOAZULENE - THEORETICAL-STUDY

INDIAN JOURNAL OF CHEMISTRY SECTION B-ORGANIC CHEMISTRY INCLUDING MEDICINAL CHEMISTRY. 1978; 16 (2): 137-138

706

2765 GILLISPIE GD, LIM EC

VIBRATIONAL ANALYSIS OF S2-]S1 FLUORESCENCE OF AZULENE IN A NAPHTHALENE MIXED-CRYSTAL AT 4.2 K

JOURNAL OF CHEMICAL PHYSICS. 1978; 68 (10): 4578-4586

707

2785 KAITO A, HATANO M

EXPERIMENTAL AND THEORETICAL STUDIES ON MAGNETIC CIRCULAR-DICHROISM OF AZANAPHTHALENES - USE OF CNDO-S-CL APPROXIMATION

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. 1978; 100 (13): 4037-4044

708

2815 KNOP JV, TRINAJSTIC N, MILUN M, PEJAKOVIC S

CONFORMATIONAL-ANALYSIS AND ELECTRONIC-STRUCTURE OF THIENYL-PYRIDINES

REVUE ROUMAINE DE CHIMIE. 1978; 23 (1): 103-110

709

2822 WEISSENFELS M, PUNKT J

PHOTOABSORPTION AND COMPOSITION OF HETEROCYCLIC 1,2-ENEDIOLS

TETRAHEDRON. 1978; 34 (3): 311-316

710

2828 KLESSINGER M

MOLECULAR-ORBITAL CALCULATIONS BASED ON LINEAR COMBINATIONS OF FRAGMENT ORBITALS .1. BASIC THEORY AND INTERPRETATION OF PE SPECTRA OF PI- SYSTEMS

THEORETICA CHIMICA ACTA. 1978; 49 (1): 77-92

Date / Author / Journal

711

STUDY OF EXCITED-STATE MOLECULAR VIBRATIONS OF AROMATIC-HYDROCARBONS

CHEMICAL PHYSICS LETTERS. 1979; 64 (3): 560-566

712

2862 YAMAGUCHI H, HIGASHI M

MAGNETIC CIRCULAR-DICHROISM SPECTRA OF TRIPHENYLENE AND CORONENE

CHEMICAL PHYSICS LETTERS. 1979; 68 (1): 77-80

713

2878 HILAL R

CLOSED-SHELL SCF-CI MO TREATMENT OF ALL-REACTIVE ELECTRONS IN COMPLEX HETEROORGANIC MOLECULES

INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY. 1979; 15 (1): 37-47

714

2889 VRIES HD, WIERSMA DA

FLUORESCENCE TRANSIENT AND OPTICAL FREE INDUCTION DECAY SPECTROSCOPY OF PENTACENE IN MIXED-CRYSTALS AT 2-K - DETERMINATION OF INTERSYSTEM CROSSING AND INTERNAL-CONVERSION RATES

JOURNAL OF CHEMICAL PHYSICS. 1979; 70 (12): 5807-5822

715

2900 HAQUE MA, SANNIGRAHI AB, NIYOGI BG

ELECTRONIC-SPECTRUM OF BORAZINE

JOURNAL OF PHYSICAL CHEMISTRY. 1979; 83 (10): 1348-1349

716

2959 SIMKIN BY, GLUKHOVTSEV MN, MINKIN VI

HARTREE-FOCK INSTABILITY IN CONNECTION WITH THE STRUCTURE AND GEOMETRY OF SOME CONJUGATED MOLECULES

CHEMICAL PHYSICS LETTERS. 1980; 71 (2): 284-289

717

2965 YAMAGUCHI H, NINOMIYA K, OGATA M

THE POSITION DEPENDENCE OF THE SCF SCREENED POTENTIAL IN SEVERAL NON- BENZENOID HYDROCARBONS CONTAINING A 4-MEMBERED RING

CROATICA CHEMICA ACTA. 1980; 53 (4): 675-685

718

2970 GUPTA D, JAISWAL RMP

PI-STAR-PI-SYSTEMS IN THE QUARTZ ULTRAVIOLET ELECTRONIC ABSORPTION- SPECTRA OF SOME DISUBSTITUTED AND TRISUBSTITUTED ACETOPHENONES

INDIAN JOURNAL OF PURE & APPLIED PHYSICS. 1980; 18 (5): 332-336

719

3013 DOHNERT D, KOUTECKY J

OCCUPATION NUMBERS OF NATURAL ORBITALS AS A CRITERION FOR BIRADICAL CHARACTER - DIFFERENT KINDS OF BIRADICALS

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. 1980; 102 (6): 1789-1796

130

720

3014 ZIMMERMAN HE, FACTOR RE

PHOTOCHEMISTRY .121. THE BICYCLE REARRANGEMENT - RELATIONSHIP TO THE DI-PI-METHANE REARRANGEMENT AND CONTROL BY BIFUNNEL DISTORTION - MECHANISTIC AND EXPLORATORY ORGANIC-PHOTOCHEMISTRY

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. 1980; 102 (10): 3538-3548

Date / Author / Journal

LCS

GCS

LCR

721

3053 IGARASHI N, TAJIRI A, HATANO M

THE MAGNETIC CIRCULAR-DICHROISM OF THE CONJUGATED O-HETEROCYCLES AND S- HETEROCYCLE

BULLETIN OF THE CHEMICAL SOCIETY OF JAPAN. 1981; 54 (5): 1511-1516

722

3058 FREUND HJ, BIGELOW RW

SHAKE-UP PHENOMENA IN D+-AR-A-STRUCTURES - A CNDO-S EQUIVALENT CORE STUDY ON N,N-DIMETHYL-PARA-NITROANILINE IN THE VAPOR AND CONDENSED PHASES

CHEMICAL PHYSICS. 1981; 55 (3): 407-427

723

3062 PHILIS J, PANTOS E, ANDRITSOPOULOS G, BOLOVINOS A, IOANNIDOU A

DETECTION OF THE PI-PI-STAR E2G STATE IN SYM-TETRAFLUOROBENZENE

CHEMICAL PHYSICS LETTERS. 1981; 77 (3): 623-626

724

3097 YAMAGUCHI H, UCHIDA A, YONEDA F, BAUMANN H

MAGNETIC CIRCULAR-DICHROISM SPECTRA AND ELECTRONIC-SPECTRA OF BENZODIAZOLES

JOURNAL OF THE CHEMICAL SOCIETY-FARADAY TRANSACTIONS II. 1981; 77: 947-954

725

3133 ANGLIKER H, ROMMEL E, WIRZ J

ELECTRONIC-SPECTRA OF HEXACENE IN SOLUTION (GROUND-STATE, TRIPLET- STATE, DICATION AND DIANION)

CHEMICAL PHYSICS LETTERS. 1982; 87 (2): 208-212

726

3136 GUPTA D, JAISWAL RMP

EVALUATION OF SOME MOLECULAR-PROPERTIES OF DISUBSTITUTED AND TRI- SUBSTITUTED ACETOPHENONES BY A (PPP-CI) METHOD

INDIAN JOURNAL OF PURE & APPLIED PHYSICS. 1982; 20 (12): 945-948

727

3153 BIGELOW RW, FREUND HJ

THE CORE-HOLE EXCITATION SPECTRUM OF BENZENE - A SYMMETRY-ADAPTED CNDO/S EQUIVALENT-CORE STUDY INCLUDING SPIN-SYMMETRY BREAKING CONFIGURATIONS

JOURNAL OF CHEMICAL PHYSICS. 1982; 77 (11): 5552-5561

728

3176 YIANOULIS P, NELSON RC

ELECTRON-AFFINITY OF ADSORBED DYE MONOLAYERS

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

729

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

730

3204 GOODMAN L, RAVA RP

2-PHOTON SPECTROSCOPY OF PERTURBED BENZENES

ADVANCES IN CHEMICAL PHYSICS. 1983; 54: 177-230

Date / Author / Journal

731

BREAKDOWN IN THE KOOPMANS THEOREM INTERPRETATION OF THE OUTER VALENCE- LEVEL PHOTOEMISSION SPECTRA OF SELECTED ORGANIC-MOLECULES

CHEMICAL PHYSICS. 1983; 80 (1-2): 45-62

732

3263 MAYNAU D, DURAND P, DAUDEY JP, MALRIEU JP

DIRECT DETERMINATION OF EFFECTIVE-HAMILTONIANS BY WAVE-OPERATOR METHODS .2. APPLICATION TO EFFECTIVE-SPIN INTERACTIONS IN PI-ELECTRON SYSTEMS

PHYSICAL REVIEW A. 1983; 28 (6): 3193-3206

733

3276 JUNG C, RISTAU O, JUNG C

AN INDO-CI METHOD IN PI-APPROXIMATION FOR THE CALCULATION OF TRANSITION-METAL COMPLEXES WITH ORGANIC-LIGANDS - APPLICATION TO IRON(II)-TRISDIIMINE COMPLEXES

THEORETICA CHIMICA ACTA. 1983; 63 (2): 143-159

734

3307 EDWARDS WD, OHRN NY, WEINER BL, ZERNER MC

SEMIEMPIRICAL ANTISYMMETRIZED GEMINAL POWER CALCULATION FOR MOLECULAR- SPECTRA

INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY. 1984; : 507-517

735

3309 DEBRUIJN S

ANALYSIS OF THE INADEQUACIES OF SOME SEMI-EMPIRICAL MO METHODS AS THEORIES OF STRUCTURE AND REACTIVITY

INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY. 1984; 25 (2): 367-390

736

3360 ABUEITTAH RH, ALSUGEIR FA

STUDIES ON THE ELECTRONIC ABSORPTION-SPECTRA OF 2,2'-BITHIENYL AND SOME OF ITS DERIVATIVES - A MOLECULAR-ORBITAL TREATMENT

BULLETIN OF THE CHEMICAL SOCIETY OF JAPAN. 1985; 58 (7): 2126-2132

737

3373 ORLANDI G, ZERBETTO F

VIBRONIC COUPLING BETWEEN THE LOWEST ELECTRONIC STATES OF BIPHENYL

CHEMICAL PHYSICS LETTERS. 1985; 120 (2): 140-146

738

3393 MALRIEU JP, DURAND P, DAUDEY JP

INTERMEDIATE HAMILTONIANS AS A NEW CLASS OF EFFECTIVE-HAMILTONIANS

JOURNAL OF PHYSICS A-MATHEMATICAL AND GENERAL. 1985; 18 (5): 809-826

263

739

3395 HEMLEY RJ, DINUR U, VAIDA V, KARPLUS M

THEORETICAL-STUDY OF THE GROUND AND EXCITED SINGLET-STATES OF STYRENE

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. 1985; 107 (4): 836-844

740

3401 RAZUMOVA TK, STAROBOGATOV IO

2-PHOTON ABSORPTION OF TETRACENE SOLUTION

OPTIKA I SPEKTROSKOPIYA. 1985; 58 (2): 241-243

Date / Author / Journal

LCS

GCS

LCR

741

3403 RAMASESHA S, SOOS ZG

STATIC SPIN CORRELATIONS IN ALTERNANT QUANTUM CELL MODELS

PHYSICAL REVIEW B. 1985; 32 (8): 5368-5374

742

3463 TAKAHASHI M, PALDUS J

TIME-DEPENDENT COUPLED CLUSTER APPROACH - EXCITATION-ENERGY CALCULATION USING AN ORTHOGONALLY SPIN-ADAPTED FORMALISM

JOURNAL OF CHEMICAL PHYSICS. 1986 AUG 1; 85 (3): 1486-1501

743

3505 WANG XC, FREED KF

ELECTRONIC-STRUCTURE AND BOND LENGTH DEPENDENCE OF THE EFFECTIVE VALENCE SHELL HAMILTONIAN OF S-2 AS STUDIED BY QUASI-DEGENERATE MANY- BODY PERTURBATION-THEORY

JOURNAL OF CHEMICAL PHYSICS. 1987 MAR 1; 86 (5): 2899-2908

744

3514 ORLANDI G, ZERBETTO F

QUANTUM-MECHANICAL CALCULATION OF VIBRONIC EFFECTS ON THE S2-S0 TRANSITION OF AZULENE

CHEMICAL PHYSICS. 1987 APR 15; 113 (2): 167-173

745

3538 ZERBETTO F, ZGIERSKI MZ, ORLANDI G, MARCONI G

VIBRONIC COUPLING IN POLYENES AND THEIR DERIVATIVES - INTERPRETATION OF THE ABSORPTION AND EMISSION-SPECTRA OF A DERIVATIVE OF DODECAHEXAENE

JOURNAL OF CHEMICAL PHYSICS. 1987 SEP 1; 87 (5): 2505-2512

746

3551 LARSSON S, BROO A, KALLEBRING B, VOLOSOV A

LONG-DISTANCE ELECTRON-TRANSFER

INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY. 1988; : 1-22

126

747

3564 JONES RD, CALLIS PR

2-PHOTON SPECTRA OF INDUCTIVELY PERTURBED NAPHTHALENES

CHEMICAL PHYSICS LETTERS. 1988 FEB 19; 144 (2): 158-164

748

3612 DIRK CW, KUZYK MG

MISSING-STATE ANALYSIS - A METHOD FOR DETERMINING THE ORIGIN OF MOLECULAR NONLINEAR OPTICAL-PROPERTIES

PHYSICAL REVIEW A. 1989 FEB 1; 39 (3): 1219-1226

749

3644 FORNER W, LADIK J, HOFMANN D, SEEL M, GODZIK A, et al.

SOLITON DYNAMICS IN ALTERNATING TRANS-POLYACETYLENE AND IN STACKED SYSTEMS

THEOCHEM-JOURNAL OF MOLECULAR STRUCTURE. 1989 AUG; 57 (3-4): 231-260

108

750

3649 SPRINGBORG M, KIESS H, HEDEGARD P

MODEL-CALCULATIONS OF PI-ELECTRON SPECTRA OF CONJUGATED POLYMERS

SYNTHETIC METALS. 1989 SEP; 31 (3): 281-310

Date / Author / Journal

LCS

GCS

LCR

751

3677 FREIERMUTH B, GERBER S, RIESEN A, WIRZ J, ZEHNDER M

MOLECULAR AND ELECTRONIC-STRUCTURE OF PYRACYLENE

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. 1990 JAN 17; 112 (2): 738-744

752

3706 NEGRI F, ORLANDI G, LANGKILDE FW, WILBRANDT R

A QUANTUM CHEMICAL-ANALYSIS OF THE TIME-RESOLVED RESONANCE RAMAN- SPECTRUM OF 2,5-DIMETHYL-2,4-HEXADIENE IN THE T1 STATE

JOURNAL OF CHEMICAL PHYSICS. 1990 APR 15; 92 (8): 4907-4919

753

3755 BICH VT, BINI R, SALVI PR, MARCONI G

2-PHOTON SPECTROSCOPY OF ANTIAROMATIC MOLECULES - THE CASE OF BIPHENYLENE

CHEMICAL PHYSICS LETTERS. 1990 DEC 21; 175 (5): 413-418

754

3769 KANIS DR, RATNER MA, MARKS TJ, ZERNER MC

NONLINEAR OPTICAL CHARACTERISTICS OF NOVEL INORGANIC CHROMOPHORES USING THE ZINDO FORMALISM

CHEMISTRY OF MATERIALS. 1991 JAN-FEB; 3 (1): 19-22

755

3784 BAKER JD, ZERNER MC

A CHARGE-ITERATIVE HAMILTONIAN FOR MOLECULAR ELECTRONIC-SPECTRA

JOURNAL OF PHYSICAL CHEMISTRY. 1991 MAR 21; 95 (6): 2307-2311

756

3788 MCWILLIAMS PCM, HAYDEN GW, SOOS ZG

THEORY OF EVEN-PARITY STATES AND 2-PHOTON SPECTRA OF CONJUGATED POLYMERS

PHYSICAL REVIEW B. 1991 APR 15; 43 (12): 9777-9791

101

757

3791 BLAISE P, BREYSSE P, HENRIROUSSEAU O, MALRIEU JP, MAYNAU D

THE TRANSFERABILITY OF EFFECTIVE EXCHANGE INTEGRALS IN THE NONEMPIRICAL EFFECTIVE VALENCE BOND HAMILTONIAN - A MINIMAL BASIS STUDY OF HN SYSTEMS

THEOCHEM-JOURNAL OF MOLECULAR STRUCTURE. 1991 MAY 6; 75: 219-247

758

3792 LEJEUNE V, BERTHIER G, DESPRES A, MIGIRDICYAN E

CHANGE IN THE DISTRIBUTION OF UNPAIRED ELECTRONS INDUCED BY THE TRIPLET TRIPLET EXCITATION OF META-XYLYLENE BIRADICALS

JOURNAL OF PHYSICAL CHEMISTRY. 1991 MAY 16; 95 (10): 3895-3897

759

3794 ANTONOVA T, NESHEV N, PROINOV EI, NALEWAJSKI RF

RIGID AND RELAXED DIAGONAL ORBITAL HARDNESSES OF THE VALENCE SHELL OF TRANSITION-METAL IONS FROM X-ALPHA CALCULATIONS

ACTA PHYSICA POLONICA A. 1991 JUN; 79 (6): 805-815

760

3797 SMITH AE, LINDNER HJ

PI-SCF-MOLECULAR MECHANICS PIMM - FORMULATION, PARAMETERS, APPLICATIONS

JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN. 1991 JUN; 5 (3): 235-262

116

Date / Author / Journal

LCS

GCS

LCR

761

3813 KARNA SP, LASKOWSKI Z, TALAPATRA GB, PRASAD PN

COMPARATIVE-STUDY OF THE NONLINEAR OPTICAL-PROPERTIES OF EXTENDED PI- ELECTRON STRUCTURES OBTAINED BY ABINITIO AND INDO METHODS - HEXAPENTAENE, HEXADIYNE, AND DIVINYLACETYLENE

JOURNAL OF PHYSICAL CHEMISTRY. 1991 AUG 22; 95 (17): 6508-6511

762

3814 PEREZ J, DUPUIS M

HYDROGEN-BONDS AND (HYPER)POLARIZABILITIES IN MOLECULAR-CRYSTALS - AN ABINITIO SCF STUDY OF UREA

JOURNAL OF PHYSICAL CHEMISTRY. 1991 AUG 22; 95 (17): 6525-6529

763

3847 KOTZIAN M, ROSCH N, ZERNER MC

INTERMEDIATE NEGLECT OF DIFFERENTIAL-OVERLAP SPECTROSCOPIC STUDIES ON LANTHANIDE COMPLEXES .1. SPECTROSCOPIC PARAMETRIZATION AND APPLICATION TO DIATOMIC LANTHANIDE OXIDES LNO (LN = LA, CE, GD, AND LU)

THEORETICA CHIMICA ACTA. 1992 JAN; 81 (4-5): 201-222

764

3850 FORESMAN JB, HEADGORDON M, POPLE JA, FRISCH MJ

TOWARD A SYSTEMATIC MOLECULAR-ORBITAL THEORY FOR EXCITED-STATES

JOURNAL OF PHYSICAL CHEMISTRY. 1992 JAN 9; 96 (1): 135-149

1611

117

765

3886 SOOS ZG, ETEMAD S, GALVAO DS, RAMASESHA S

FLUORESCENCE AND TOPOLOGICAL GAP OF CONJUGATED PHENYLENE POLYMERS

CHEMICAL PHYSICS LETTERS. 1992 JUL 3; 194 (4-6): 341-346

766

3896 RAMASESHA S, ALBERT IDL

A COMPARATIVE THEORETICAL-STUDY OF HIGHER HARMONIC-GENERATION AND ELECTROOPTIC EFFECTS IN POLYENE SYSTEMS

CHEMICAL PHYSICS LETTERS. 1992 AUG 14; 196 (3-4): 287-293

767

3931 MAN KF, TRAJMAR S, MCCONKEY JW, RATLIFF JM, KHAKOO M

EXCITATION OF ANTHRACENE (C14H10) BY ELECTRON-IMPACT

JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS. 1992 DEC 14; 25 (23): 5245-5256

768

4031 SELCO JI, BROOKS T, CHANG M, TRIEU MT, MCDONALD JK, et al.

SOLUTION PHOTOCHEMISTRY OF AZULENE

JOURNAL OF ORGANIC CHEMISTRY. 1994 JAN 28; 59 (2): 429-433

769

4087 REIMERS JR, HUSH NS

THE INFLUENCE OF SPIN-FORBIDDEN MONOMER EXCITATIONS ON SPIN-ALLOWED ELECTRON-TRANSFER AND ELECTRON-LOCALIZED STATES OF MIXED-VALENCE AND SINGLE-VALENCE DIMERIC SYSTEMS

INORGANICA CHIMICA ACTA. 1994 NOV; 226 (1-2): 33-42

770

4148 Roos BO, Andersson K, Fulscher MP, Malmqvist PA, SerranoAndres L, et al.

Multiconfigurational perturbation theory: Applications in electronic spectroscopy

ADVANCES IN CHEMICAL PHYSICS, VOL XCIII. 1996; 93: 219-331

407

217

Date / Author / Journal

LCS

GCS

LCR

771

4340 Damjanovic A, Ritz T, Schulten K

Energy transfer between carotenoids and bacteriochlorophylls in light- harvesting complex II of purple bacteria

PHYSICAL REVIEW E. 1999 MAR; 59 (3): 3293-3311

106

772

4366 Tretiak S, Zhang WM, Chernyak V, Mukamel S

Excitonic couplings and electronic coherence in bridged naphthalene dimers

PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA. 1999 NOV 9; 96 (23): 13003-13008

773

4372 Ramasesha S, Pati SK, Shuai Z, Bredas JL

The density matrix renormalization group method: Application to the low-lying electronic states in conjugated polymers

ADVANCES IN QUANTUM CHEMISTRY, VOL 38. 2000; 38: 121-215

235

774

4404 Bohm MC, Saal C

Quantum statistical analysis of superconductivity, fractional quantum Hall effect, and aromaticity

INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY. 2000 AUG 15; 79 (3): 125-162

121

775

4408 Bito Y, Shida N, Toru T

Ab initio MRSD-CI calculations of the ground and the two lowest-lying excited states of pyrene

CHEMICAL PHYSICS LETTERS. 2000 SEP 29; 328 (3): 310-315

776

4409 Damjanovic A, Ritz T, Schulten K

Excitation transfer in the peridinin-chlorophyll-protein of Amphidinium carterae

BIOPHYSICAL JOURNAL. 2000 OCT; 79 (4): 1695-1705

777

4571 Koyama Y, Rondonuwu FS, Fujii R, Watanabe Y

Light-harvesting function of carotenoids in photo-synthesis: The roles of the newly found 1(1)B(u)(-) state

BIOPOLYMERS. 2004 MAY-JUN; 74 (1-2): 2-18

778

4591 Forner W

Theoretical study of bipolaron dynamics in polyparaphenylene: I. Derivation of the formalism and density functional (DFT) calculations on neutral and charged model systems

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM. 2004 AUG 31; 682 (1-3): 115-136

779

4611 Yanagi K, Gardiner AT, Cogdell RJ, Hashimoto H

Electroabsorption spectroscopy of beta-carotene homologs: Anomalous enhancement of Delta mu

PHYSICAL REVIEW B. 2005 MAY; 71 (19): Art. No. 195118

780

4623 Xiang JF, Rondonuwu FS, Kakitani Y, Fujii R, Watanabe Y, et al.

Mechanisms of electron injection from retinoic acid and carotenoic acids to TiO2 nanoparticles and charge recombination via the T-1 state as determined by subpicosecond to microsecond time-resolved absorption spectroscopy: Dependence on the conjugation length

JOURNAL OF PHYSICAL CHEMISTRY B. 2005 SEP 15; 109 (36): 17066-17077

Date / Author / Journal

LCS

GCS

LCR

781

4680 Yamakita Y, Kimura J, Ohno K

Molecular vibrations of [n]oligoacenes (n=2-5 and 10) and phonon dispersion relations of polyacene

JOURNAL OF CHEMICAL PHYSICS. 2007 FEB 14; 126 (6): Art. No. 064904

130

782

4696 Hachmann J, Dorando JJ, Aviles M, Chan GKL

The radical character of the acenes: A density matrix renormalization group study

JOURNAL OF CHEMICAL PHYSICS. 2007 OCT 7; 127 (13): Art. No. 134309

783

4752 Baba M, Saitoh M, Taguma K, Shinohara K, Yoshida K, et al.

Structure and excited-state dynamics of anthracene: Ultrahigh- resolution spectroscopy and theoretical calculation

JOURNAL OF CHEMICAL PHYSICS. 2009 APR 7; 130 (13): Art. No. 134315

784

4792 Kukushkin AK, Jalkanen KJ

Role of quantum chemical calculations in molecular biophysics with a historical perspective

THEORETICAL CHEMISTRY ACCOUNTS. 2010 MAR; 125 (3-6): 121-144

245

785

4850 Avci D

Second and third-order nonlinear optical properties and molecular parameters of azo chromophores: Semiempirical analysis

SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY. 2011 NOV; 82 (1): 37-43

786

131 OOSHIKA Y

A SEMI-EMPIRICAL THEORY OF THE CONJUGATED SYSTEMS .1. GENERAL FORMULATION

JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN. 1957; 12 (11): 1238-1245

106

787

136 MCWEENY R, PEACOCK TE

THE ELECTRONIC STRUCTURE AND SPECTRA OF SOME NITROGEN HETEROBENZENES

PROCEEDINGS OF THE PHYSICAL SOCIETY OF LONDON SECTION A. 1957; 70 (1): 41-50

106

788

194 BROWN RD, HEFFERNAN ML

THE VARIABLE ELECTRONEGATIVITY METHOD .5. PYRIDINE, THE PYRIDINIUM CATION, AND THE EVALUATION OF CORE-ATTRACTION INTEGRALS

AUSTRALIAN JOURNAL OF CHEMISTRY. 1959; 12 (4): 554-568

789

195 MATAGA N, NISHIMOTO K, MATAGA S

REMARKS ON THE MOLECULAR CALCULATION OF NAPHTHALENE AND ANTHRACENE

BULLETIN OF THE CHEMICAL SOCIETY OF JAPAN. 1959; 32 (4): 395-399

790

236 ANNO T

SEMIEMPIRICAL CALCULATION ON THE ELECTRONIC STRUCTURE OF THE NITROGEN- CONTAINING HETEROCYCLIC MOLECULES .4. ELECTRONIC STRUCTURE OF PYRIDINE

JOURNAL OF CHEMICAL PHYSICS. 1960; 32 (3): 867-871

Date / Author / Journal

791

ELECTRONIC SPECTRA OF SUBSTITUTED AROMATIC HYDROCARBONS .1. PHENOL AND ANILINE

BULLETIN OF THE CHEMICAL SOCIETY OF JAPAN. 1961; 34 (1): 76-82

792

307 MCEWEN KL

ELECTRONIC STRUCTURES AND SPECTRA OF SOME NITROGEN-OXYGEN COMPOUNDS

JOURNAL OF CHEMICAL PHYSICS. 1961; 34 (2): 547-&

132

793

385 BENJEMIA H, LEFEBVRE R

SUR LE CALCUL DES DENSITES DE SPIN DES RADICAUX AROMATIQUES

JOURNAL DE CHIMIE PHYSIQUE ET DE PHYSICO-CHIMIE BIOLOGIQUE. 1962; 59 (7-8): 754-758

794

391 KEARNS DR

DETERMINATION OF ASSIGNMENT OF TRIPLET STATES IN CATACONDENSED AROMATIC HYDROCARBONS

JOURNAL OF CHEMICAL PHYSICS. 1962; 36 (6): 1608-&

795

450 YEVSTIGNEYEV VB

MECHANISM OF PHOTOSENSITIZING ACTION OF CHLOROPHYLL IN VITRO

BIOPHYSICS-USSR. 1963; 8 (6): 715-&

119

796

460 ITOH M, OKAMOTO T, NAGAKURA S

THE ELECTRON SPIN RESONANCE AND ELECTRONIC SPECTRA OF THE ANION RADICALS OF 4-NITROPYRIDINE AND 4-NITROPYRIDINE 1-OXIDE

BULLETIN OF THE CHEMICAL SOCIETY OF JAPAN. 1963; 36 (12): 1665-1672

797

464 PALDUS J

QUANTUM CHEMICAL STUDY OF TRANSANNULAR INTERACTION .3. MODEL OF (N,N)PARACYCLOPHANES IN AUGMENTED TIGHT-BINDING APPROXIMATION NOT CONSIDERING BENZENE RING DISTORTION

COLLECTION OF CZECHOSLOVAK CHEMICAL COMMUNICATIONS. 1963; 28 (5): 1110-&

798

472 GERSON F, JOOP N, ZIMMERMANN H, HEILBRONNER E

ELEKTRONENSPEKTRUM UND BASIZITAT DES CYCL[3.2.2]AZINS

HELVETICA CHIMICA ACTA. 1963; 46 (6): 1940-&

799

476 BAUDET J, BERTHIER G

CONFIGURATIONS ELECTRONIQUES INCOMPLETES .3. LES PREMIERS NIVEAUX DENERGIE DU RADICAL BENZYLE

JOURNAL DE CHIMIE PHYSIQUE ET DE PHYSICO-CHIMIE BIOLOGIQUE. 1963; 60 (10): 1161-1172

800

505 NISHIMOTO K

ELECTRONIC SPECTRA AND STRUCTURE OF ALPHA- AND BETA-NAPHTHOL

JOURNAL OF PHYSICAL CHEMISTRY. 1963; 67 (7): 1443-&

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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