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Results: 1-22 |
Results: 22
VIBRONIC STRUCTURE IN TRIATOMIC-MOLECULES - THE HYDROCARBON FLAME BANDS OF THE FORMYL RADICAL (HCO) - A THEORETICAL-STUDY
Authors: SERRANOANDRES L FORSBERG N MALMQVIST PA
Citation: L. Serranoandres et al., VIBRONIC STRUCTURE IN TRIATOMIC-MOLECULES - THE HYDROCARBON FLAME BANDS OF THE FORMYL RADICAL (HCO) - A THEORETICAL-STUDY, The Journal of chemical physics, 108(17), 1998, pp. 7202-7216
INTERPRETATION OF THE ELECTRONIC ABSORPTION-SPECTRUM OF FREE-BASE PORPHIN BY USING MULTICONFIGURATIONAL 2ND-ORDER PERTURBATION-THEORY
Authors: SERRANOANDRES L MERCHAN M RUBIO M ROOS BO
Citation: L. Serranoandres et al., INTERPRETATION OF THE ELECTRONIC ABSORPTION-SPECTRUM OF FREE-BASE PORPHIN BY USING MULTICONFIGURATIONAL 2ND-ORDER PERTURBATION-THEORY, Chemical physics letters, 295(3), 1998, pp. 195-203
THE MULTISTATE CASPT2 METHOD
Authors: FINLEY J MALMQVIST PA ROOS BO SERRANOANDRES L
Citation: J. Finley et al., THE MULTISTATE CASPT2 METHOD, Chemical physics letters, 288(2-4), 1998, pp. 299-306
THEORETICAL-STUDY OF THE ELECTRONIC SPECTROSCOPY OF PEPTIDES - III - CHARGE-TRANSFER TRANSITIONS IN POLYPEPTIDES
Authors: SERRANOANDRES L FULSCHER MP
Citation: L. Serranoandres et Mp. Fulscher, THEORETICAL-STUDY OF THE ELECTRONIC SPECTROSCOPY OF PEPTIDES - III - CHARGE-TRANSFER TRANSITIONS IN POLYPEPTIDES, Journal of the American Chemical Society, 120(42), 1998, pp. 10912-10920
A THEORETICAL-STUDY OF THE INDIGOID DYES AND THEIR CHROMOPHORE
Authors: SERRANOANDRES L ROOS BO
Citation: L. Serranoandres et Bo. Roos, A THEORETICAL-STUDY OF THE INDIGOID DYES AND THEIR CHROMOPHORE, Chemistry, 3(5), 1997, pp. 717-725
VERTICAL AND ADIABATIC ELECTRONIC EXCITATIONS IN BIPHENYLENE - A THEORETICAL-STUDY
Authors: BECK ME REBENTISCH R HOHLNEICHER G FULSCHER MP SERRANOANDRES L ROOS BO
Citation: Me. Beck et al., VERTICAL AND ADIABATIC ELECTRONIC EXCITATIONS IN BIPHENYLENE - A THEORETICAL-STUDY, The Journal of chemical physics, 107(22), 1997, pp. 9464-9474
SOLVENT EFFECTS ON ELECTRONIC-SPECTRA STUDIED BY MULTICONFIGURATIONALPERTURBATION-THEORY
Authors: SERRANOANDRES L FULSCHER MP KARLSTROM G
Citation: L. Serranoandres et al., SOLVENT EFFECTS ON ELECTRONIC-SPECTRA STUDIED BY MULTICONFIGURATIONALPERTURBATION-THEORY, International journal of quantum chemistry, 65(2), 1997, pp. 167-181
THE DOMINANT ONE-PHOTON-EXCITED AND 2-PHOTON-EXCITED STATES IN THE NONLINEAR-OPTICAL RESPONSE OF OCTATETRAENE - AB-INITIO VERSUS SEMIEMPIRICAL THEORETICAL DESCRIPTIONS
Authors: BELJONNE D SHUAI Z SERRANOANDRES L BREDAS JL
Citation: D. Beljonne et al., THE DOMINANT ONE-PHOTON-EXCITED AND 2-PHOTON-EXCITED STATES IN THE NONLINEAR-OPTICAL RESPONSE OF OCTATETRAENE - AB-INITIO VERSUS SEMIEMPIRICAL THEORETICAL DESCRIPTIONS, Chemical physics letters, 279(1-2), 1997, pp. 1-8
A THEORETICAL-STUDY OF THE ELECTRONIC-SPECTRA OF ADENINE AND GUANINE
Authors: FULSCHER MP SERRANOANDRES L ROOS BO
Citation: Mp. Fulscher et al., A THEORETICAL-STUDY OF THE ELECTRONIC-SPECTRA OF ADENINE AND GUANINE, Journal of the American Chemical Society, 119(26), 1997, pp. 6168-6176
APPLICATIONS OF LEVEL SHIFT CORRECTED PERTURBATION-THEORY IN ELECTRONIC SPECTROSCOPY
Authors: ROOS BO ANDERSSON K FULSCHER MP SERRANOANDRES L PIERLOOT K MERCHAN M MOLINA V
Citation: Bo. Roos et al., APPLICATIONS OF LEVEL SHIFT CORRECTED PERTURBATION-THEORY IN ELECTRONIC SPECTROSCOPY, Journal of molecular structure. Theochem, 388, 1996, pp. 257-276
THEORETICAL-STUDY OF THE ELECTRONIC-SPECTRUM OF IMIDAZOLE
Authors: SERRANOANDRES L FULSCHER MP ROOS BO MERCHAN M
Citation: L. Serranoandres et al., THEORETICAL-STUDY OF THE ELECTRONIC-SPECTRUM OF IMIDAZOLE, Journal of physical chemistry, 100(16), 1996, pp. 6484-6491
THEORETICAL-STUDY OF THE ELECTRONIC SPECTROSCOPY OF PEPTIDES .1. THE PEPTIDIC BOND - PRIMARY, SECONDARY, AND TERTIARY AMIDES
Authors: SERRANOANDRES L FULSCHER MP
Citation: L. Serranoandres et Mp. Fulscher, THEORETICAL-STUDY OF THE ELECTRONIC SPECTROSCOPY OF PEPTIDES .1. THE PEPTIDIC BOND - PRIMARY, SECONDARY, AND TERTIARY AMIDES, Journal of the American Chemical Society, 118(48), 1996, pp. 12190-12199
THEORETICAL-STUDY OF THE ELECTRONIC SPECTROSCOPY OF PEPTIDES .2. GLYCINE AND N-ACETYLGLYCINE
Authors: SERRANOANDRES L FULSCHER MP
Citation: L. Serranoandres et Mp. Fulscher, THEORETICAL-STUDY OF THE ELECTRONIC SPECTROSCOPY OF PEPTIDES .2. GLYCINE AND N-ACETYLGLYCINE, Journal of the American Chemical Society, 118(48), 1996, pp. 12200-12206
THEORETICAL-STUDY OF THE ABSORPTION AND EMISSION-SPECTRA OF INDOLE INTHE GAS-PHASE AND IN A SOLVENT
Authors: SERRANOANDRES L ROOS BO
Citation: L. Serranoandres et Bo. Roos, THEORETICAL-STUDY OF THE ABSORPTION AND EMISSION-SPECTRA OF INDOLE INTHE GAS-PHASE AND IN A SOLVENT, Journal of the American Chemical Society, 118(1), 1996, pp. 185-195
THEORETICAL-STUDY OF THE INTERNAL CHARGE-TRANSFER IN AMINOBENZONITRILES
Authors: SERRANOANDRES L MERCHAN M ROOS BO LINDH R
Citation: L. Serranoandres et al., THEORETICAL-STUDY OF THE INTERNAL CHARGE-TRANSFER IN AMINOBENZONITRILES, Journal of the American Chemical Society, 117(11), 1995, pp. 3189-3204
THEORETICAL-STUDY OF THE ELECTRONIC-SPECTRA OF CIS-1,3,5-HEXATRIENE AND CIS-1,3-BUTADIENE
Authors: SERRANOANDRES L ROOS BO MERCHAN M
Citation: L. Serranoandres et al., THEORETICAL-STUDY OF THE ELECTRONIC-SPECTRA OF CIS-1,3,5-HEXATRIENE AND CIS-1,3-BUTADIENE, Theoretica Chimica Acta, 87(4-5), 1994, pp. 387-402
DISSOCIATION-ENERGIES WITHIN SELECTED CONFIGURATION-INTERACTION AND PERTURBATION-THEORY
Authors: GARCIACUESTA I SERRANOANDRES L DEMERAS AS NEBOTGIL I
Citation: I. Garciacuesta et al., DISSOCIATION-ENERGIES WITHIN SELECTED CONFIGURATION-INTERACTION AND PERTURBATION-THEORY, Journal of molecular structure. Theochem, 99(2-3), 1993, pp. 181-190
MULTICONFIGURATIONAL 2ND-ORDER PERTURBATION-THEORY APPLIED TO THE CALCULATION OF ELECTRONIC-SPECTRA OF CONJUGATED SYSTEMS
Authors: ROOS BO SERRANOANDRES L MERCHAN M
Citation: Bo. Roos et al., MULTICONFIGURATIONAL 2ND-ORDER PERTURBATION-THEORY APPLIED TO THE CALCULATION OF ELECTRONIC-SPECTRA OF CONJUGATED SYSTEMS, Pure and applied chemistry, 65(8), 1993, pp. 1693-1698
THEORETICAL-STUDY OF THE ELECTRONIC-SPECTRUM OF ALL-TRANS-1,3,5,7-OCTATETRAENE
Authors: SERRANOANDRES L LINDH R ROOS BO MERCHAN M
Citation: L. Serranoandres et al., THEORETICAL-STUDY OF THE ELECTRONIC-SPECTRUM OF ALL-TRANS-1,3,5,7-OCTATETRAENE, Journal of physical chemistry, 97(37), 1993, pp. 9360-9368
THEORETICAL-STUDY OF THE LOW-LYING STATES OF TRANS-1,3-BUTADIENE (VOL97, PG 7499, 1992)
Authors: SERRANOANDRES L SANCHEZMARIN J NEBOTGIL I
Citation: L. Serranoandres et al., THEORETICAL-STUDY OF THE LOW-LYING STATES OF TRANS-1,3-BUTADIENE (VOL97, PG 7499, 1992), The Journal of chemical physics, 98(9), 1993, pp. 7663-7663
A THEORETICAL-STUDY OF THE ELECTRONIC-SPECTRUM OF THIOPHENE
Authors: SERRANOANDRES L MERCHAN M FULSCHER M ROOS BO
Citation: L. Serranoandres et al., A THEORETICAL-STUDY OF THE ELECTRONIC-SPECTRUM OF THIOPHENE, Chemical physics letters, 211(1), 1993, pp. 125-135
THEORETICAL-STUDY OF THE ELECTRONIC-SPECTRA OF CYCLOPENTADIENE, PYRROLE, AND FURAN
Authors: SERRANOANDRES L MERCHAN M NEBOTGIL I ROOS BO FULSCHER M
Citation: L. Serranoandres et al., THEORETICAL-STUDY OF THE ELECTRONIC-SPECTRA OF CYCLOPENTADIENE, PYRROLE, AND FURAN, Journal of the American Chemical Society, 115(14), 1993, pp. 6184-6197
Risultati: 1-22 |