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Results: 1-25/50
Authors:
Ricca, A
Bauschlicher, CW
Citation: A. Ricca et Cw. Bauschlicher, A correlation-consistent basis set for Fe, THEOR CH AC, 106(4), 2001, pp. 314-318
Authors:
Salama, F
Bauschlicher, CW
Citation: F. Salama et Cw. Bauschlicher, Molecular spectroscopy in astrophysics - Preface, SPECT ACT A, 57(4), 2001, pp. 613-614
Authors:
Hudgins, DM
Bauschlicher, CW
Allamandola, LJ
Citation: Dm. Hudgins et al., Closed-shell polycyclic aromatic hydrocarbon cations: a new category of interstellar polycyclic aromatic hydrocarbons, SPECT ACT A, 57(4), 2001, pp. 907-930
Authors:
Bauschlicher, CW
Ram, RS
Bernath, PF
Parsons, CG
Galehouse, D
Citation: Cw. Bauschlicher et al., The A (6)Sigma(+)-X (6)Sigma(+) transition of CrH, Einstein coefficients, and an improved description of the A state, J CHEM PHYS, 115(3), 2001, pp. 1312-1318
Authors:
Martin, JML
Bauschlicher, CW
Ricca, A
Citation: Jml. Martin et al., On the integration accuracy in molecular density functional theory calculations using Gaussian basis sets, COMP PHYS C, 133(2-3), 2001, pp. 189-201
Authors:
Zhou, MF
Andrews, L
Bauschlicher, CW
Citation: Mf. Zhou et al., Spectroscopic and theoretical investigations of vibrational frequencies inbinary unsaturated transition-metal carbonyl cations, neutrals, and anions, CHEM REV, 101(7), 2001, pp. 1931-1961
Authors:
Dyall, KG
Bauschlicher, CW
Schwenke, DW
Pyykko, P
Citation: Kg. Dyall et al., Is the Lamb shift chemically significant?, CHEM P LETT, 348(5-6), 2001, pp. 497-500
Authors:
Rosi, M
Bauschlicher, CW
Citation: M. Rosi et Cw. Bauschlicher, Using hydrogen and chlorine on Si(111) to store data, an improved model, CHEM P LETT, 347(4-6), 2001, pp. 291-296
Authors:
Ricca, A
Bauschlicher, CW
Rosi, M
Citation: A. Ricca et al., Mechanisms for the incorporation of a nitrogen atom into polycyclic aromatic hydrocarbon cations, CHEM P LETT, 347(4-6), 2001, pp. 473-480
Authors:
Bauschlicher, CW
Partridge, H
Citation: Cw. Bauschlicher et H. Partridge, On interpreting the photoelectron spectra of MgO-, CHEM P LETT, 342(3-4), 2001, pp. 441-446
Authors:
Bauschlicher, CW
So, CR
Citation: Cw. Bauschlicher et Cr. So, Using hydrogen and chlorine on Si(111) to store data, CHEM P LETT, 333(1-2), 2001, pp. 1-5
Authors:
Walch, SP
Bauschlicher, CW
Ricca, A
Bakes, ELO
Citation: Sp. Walch et al., On the reaction CH2O+NH3 -> CH2NH+H2O, CHEM P LETT, 333(1-2), 2001, pp. 6-11
Authors:
Bakes, ELO
Tielens, AGGM
Bauschlicher, CW
Hudgins, DM
Allamandola, LJ
Citation: Elo. Bakes et al., Theoretical modeling of infrared emission from neutral and charged polycyclic aromatic hydrocarbons. II., ASTROPHYS J, 560(1), 2001, pp. 261-271
Authors:
Bakes, ELO
Tielens, AGGM
Bauschlicher, CW
Citation: Elo. Bakes et al., Theoretical modeling of infrared emission from neutral and charged polycyclic aromatic hydrocarbons. I., ASTROPHYS J, 556(1), 2001, pp. 501-514
Authors:
Andrews, L
Zhou, MF
Wang, XF
Bauschlicher, CW
Citation: L. Andrews et al., Matrix infrared spectra and density functional calculations of manganese and rhenium carbonyl neutral and anion complexes, J PHYS CH A, 104(39), 2000, pp. 8887-8897
Authors:
Bauschlicher, CW
Ricca, A
Citation: Cw. Bauschlicher et A. Ricca, Heats of formation for cyclic C4Fn, n=4-8, and their cations, J PHYS CH A, 104(39), 2000, pp. 9026-9028
Authors:
Bauschlicher, CW
Citation: Cw. Bauschlicher, TaFn and TaCln atomization energies for n=1-5, J PHYS CH A, 104(24), 2000, pp. 5843-5849
Authors:
Bauschlicher, CW
Ricca, A
Citation: Cw. Bauschlicher et A. Ricca, Heats of formation for CnFm, CnFm+, CHFm, and CHFm+, J PHYS CH A, 104(19), 2000, pp. 4581-4585
Authors:
Bauschlicher, CW
Zhou, MF
Andrews, L
Citation: Cw. Bauschlicher et al., A study of the products of the reaction of phosphorus and dioxygen, J PHYS CH A, 104(16), 2000, pp. 3566-3571
Authors:
Hudgins, DM
Bauschlicher, CW
Allamandola, LJ
Fetzer, JC
Citation: Dm. Hudgins et al., Infrared spectroscopy of matrix-isolated polycyclic aromatic hydrocarbon ions. 5. PAHs incorporating a cyclopentadienyl ring, J PHYS CH A, 104(16), 2000, pp. 3655-3669
Authors:
Bauschlicher, CW
Citation: Cw. Bauschlicher, The scalar relativistic contribution to the atomization energies of CF, CF4, and SiF4, J PHYS CH A, 104(11), 2000, pp. 2281-2283
Authors:
Bauschlicher, CW
Bakes, ELO
Citation: Cw. Bauschlicher et Elo. Bakes, Infrared spectra of polycyclic aromatic hydrocarbons (PAHs), CHEM PHYS, 262(2-3), 2000, pp. 285-291
Authors:
Ricca, A
Bauschlicher, CW
Citation: A. Ricca et Cw. Bauschlicher, The reactions of polycyclic aromatic hydrocarbons with OH, CHEM P LETT, 328(4-6), 2000, pp. 396-402
Authors:
Bauschlicher, CW
Ricca, A
Citation: Cw. Bauschlicher et A. Ricca, Mechanisms for polycyclic aromatic hydrocarbon (PAH) growth, CHEM P LETT, 326(3-4), 2000, pp. 283-287
Authors:
Bauschlicher, CW
Citation: Cw. Bauschlicher, Hydrogen and fluorine binding to the sidewalls of a (10,0) carbon nanotube, CHEM P LETT, 322(3-4), 2000, pp. 237-241