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Results: 1-18 |
Results: 18
Vibrational structure and vibronic coupling in the carbon 1s photoelectronspectra of ethane and deuteroethane
Authors: Karlsen, T Saethre, LJ Borve, KJ Berrah, N Kukk, E Bozek, JD Carroll, TX Thomas, TD
Citation: T. Karlsen et al., Vibrational structure and vibronic coupling in the carbon 1s photoelectronspectra of ethane and deuteroethane, J PHYS CH A, 105(32), 2001, pp. 7700-7706
Vibronic structure in the carbon 1s photoelectron spectra of HCCH and DCCD- art. no. 012506
Authors: Borve, KJ Saethre, LJ Thomas, TD Carroll, TX Berrah, N Bozek, JD Kukk, E
Citation: Kj. Borve et al., Vibronic structure in the carbon 1s photoelectron spectra of HCCH and DCCD- art. no. 012506, PHYS REV A, 6301(1), 2001, pp. 2506
Theoretical analysis of d-d transitions for the reduced Cr/silica system
Authors: Espelid, O Borve, KJ
Citation: O. Espelid et Kj. Borve, Theoretical analysis of d-d transitions for the reduced Cr/silica system, CATAL LETT, 75(1-2), 2001, pp. 49-54
Second-order Moller-Plesset perturbation theory for computing molecular-field splitting: application to the S2p(3/2) level in C2H2n+1SF5, n=0, 1, and2
Authors: Karlsen, T Borve, KJ Saethre, LJ
Citation: T. Karlsen et al., Second-order Moller-Plesset perturbation theory for computing molecular-field splitting: application to the S2p(3/2) level in C2H2n+1SF5, n=0, 1, and2, CHEM PHYS, 270(1), 2001, pp. 55-65
Theoretical investigation of bis(imido)chromium (VI) cations as polymerization catalysts
Authors: Jensen, VR Borve, KJ
Citation: Vr. Jensen et Kj. Borve, Theoretical investigation of bis(imido)chromium (VI) cations as polymerization catalysts, ORGANOMETAL, 20(4), 2001, pp. 616-626
Chemical insights from high-resolution X-ray photoelectron spectroscopy and ab initio theory: Propyne, trifluoropropyne, and ethynylsulfur pentafluoride
Authors: Saethre, LJ Berrah, N Bozek, JD Borve, KJ Carroll, TX Kukk, E Gard, GL Winter, R Thomas, TD
Citation: Lj. Saethre et al., Chemical insights from high-resolution X-ray photoelectron spectroscopy and ab initio theory: Propyne, trifluoropropyne, and ethynylsulfur pentafluoride, J AM CHEM S, 123(43), 2001, pp. 10729-10737
The calculation of initial-state effects on inner-shell ionization energies
Authors: Borve, KJ Thomas, TD
Citation: Kj. Borve et Td. Thomas, The calculation of initial-state effects on inner-shell ionization energies, J ELEC SPEC, 107(2), 2000, pp. 155-161
Activity of homogeneous chromium(III)-based alkene polymerization catalysts: Lack of importance of the barrier to ethylene insertion
Authors: Jensen, VR Angermund, K Jolly, PW Borve, KJ
Citation: Vr. Jensen et al., Activity of homogeneous chromium(III)-based alkene polymerization catalysts: Lack of importance of the barrier to ethylene insertion, ORGANOMETAL, 19(4), 2000, pp. 403-410
2,2 '-selenobis(acetic acid), Se(CH2C(O)OH)(2): an old compound with a novel structure
Authors: Doudin, KI Berge, RK Borve, KJ Songstad, J Tornroos, KW
Citation: Ki. Doudin et al., 2,2 '-selenobis(acetic acid), Se(CH2C(O)OH)(2): an old compound with a novel structure, J MOL STRUC, 554(2-3), 2000, pp. 149-161
Accurate and approximate calculations of Franck-Condon intensities in the carbon 1s photoelectron spectrum of methane
Authors: Karlsen, T Borve, KJ
Citation: T. Karlsen et Kj. Borve, Accurate and approximate calculations of Franck-Condon intensities in the carbon 1s photoelectron spectrum of methane, J CHEM PHYS, 112(18), 2000, pp. 7979-7985
Evidence of Fermi resonance in core-ionized methane
Authors: Karlsen, T Borve, KJ
Citation: T. Karlsen et Kj. Borve, Evidence of Fermi resonance in core-ionized methane, J CHEM PHYS, 112(18), 2000, pp. 7986-7991
Theoretical models of ethylene polymerization over a mononuclear chromium(II)/silica site
Authors: Espelid, O Borve, KJ
Citation: O. Espelid et Kj. Borve, Theoretical models of ethylene polymerization over a mononuclear chromium(II)/silica site, J CATALYSIS, 195(1), 2000, pp. 125-139
Color and substitution pattern in anthocyanidins. A combined quantum chemical-chemometrical study
Authors: Torskangerpoll, K Borve, KJ Andersen, OM Saethre, LJ
Citation: K. Torskangerpoll et al., Color and substitution pattern in anthocyanidins. A combined quantum chemical-chemometrical study, SPECT ACT A, 55(4), 1999, pp. 761-771
Molecular adsorption of methane and methyl onto MgO(100) - An embedded-cluster study
Authors: Todnem, K Borve, KJ Nygren, M
Citation: K. Todnem et al., Molecular adsorption of methane and methyl onto MgO(100) - An embedded-cluster study, SURF SCI, 421(3), 1999, pp. 296-307
Molecular-field splitting and vibrational structure in the phosphorus 2p photoelectron spectrum of PF3
Authors: Borve, KJ Saethre, LJ Bozek, JD True, J Thomas, TD
Citation: Kj. Borve et al., Molecular-field splitting and vibrational structure in the phosphorus 2p photoelectron spectrum of PF3, J CHEM PHYS, 111(10), 1999, pp. 4472-4477
Molecular-field splitting of the 2p(3/2) peak in x-ray photoelectron spectra of second-row atoms: A theoretical study of phosphine and phosphorus trifluoride
Authors: Borve, KJ Thomas, TD
Citation: Kj. Borve et Td. Thomas, Molecular-field splitting of the 2p(3/2) peak in x-ray photoelectron spectra of second-row atoms: A theoretical study of phosphine and phosphorus trifluoride, J CHEM PHYS, 111(10), 1999, pp. 4478-4486
Molecular-field splitting in S2p photoelectron spectra of dimethyl sulfideand sulfur dichloride
Authors: Borve, KJ Saethre, LJ Svensson, S
Citation: Kj. Borve et al., Molecular-field splitting in S2p photoelectron spectra of dimethyl sulfideand sulfur dichloride, CHEM P LETT, 310(5-6), 1999, pp. 439-444
Structure and thermodynamics of gaseous oxides, hydroxides, and mixed oxohydroxides of chromium: CrOm(OH)(n) (m, n = 0-2) and CrO3. A computational study
Authors: Espelid, O Borve, KJ Jensen, VR
Citation: O. Espelid et al., Structure and thermodynamics of gaseous oxides, hydroxides, and mixed oxohydroxides of chromium: CrOm(OH)(n) (m, n = 0-2) and CrO3. A computational study, J PHYS CH A, 102(50), 1998, pp. 10414-10423
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