AAAAAA
Results:
1-18
|
Results: 18
Authors:
Perez, P
Toro-Labbe, A
Citation: P. Perez et A. Toro-labbe, Theoretical analysis of some substituted imine-enamine tautomerism, THEOR CH AC, 105(6), 2001, pp. 422-430
Authors:
Chattaraj, PK
Perez, P
Zevallos, J
Toro-Labbe, A
Citation: Pk. Chattaraj et al., Ab initio SCF and DFT studies on solvent effects on intramolecular rearrangement reactions, J PHYS CH A, 105(17), 2001, pp. 4272-4283
Authors:
Herrera, B
Toro-Labbe, A
Citation: B. Herrera et A. Toro-labbe, Theoretical study of the internal rotation of cubylcubane and cubylcubane difluoride, CHEM P LETT, 344(1-2), 2001, pp. 193-199
Authors:
Perez, P
Toro-Labbe, A
Contreras, R
Citation: P. Perez et al., Solvent effects on electrophilicity, J AM CHEM S, 123(23), 2001, pp. 5527-5531
Authors:
Perez, P
Toro-Labbe, A
Citation: P. Perez et A. Toro-labbe, Characterization of keto-enol tautomerism of acetyl derivatives from the analysis of energy, chemical potential, and hardness, J PHYS CH A, 104(7), 2000, pp. 1557-1562
Authors:
Perez, P
Toro-Labbe, A
Contreras, R
Citation: P. Perez et al., A semiquantitative description of electrostatics and polarization substituent effects: Gas-phase acid-base equilibria as test cases, J PHYS CH A, 104(51), 2000, pp. 11993-11998
Authors:
Jaque, P
Toro-Labbe, A
Citation: P. Jaque et A. Toro-labbe, Theoretical study of the double proton transfer in the CHX-XH center dot center dot center dot CHX-XH (X = O, S) complexes, J PHYS CH A, 104(5), 2000, pp. 995-1003
Authors:
Margalef-Roig, J
Miret-Artes, S
Toro-Labbe, A
Citation: J. Margalef-roig et al., Characterization of elementary chemical reactions from bifurcation theory, J PHYS CH A, 104(49), 2000, pp. 11589-11592
Authors:
Gutierrez-Oliva, S
Jaque, P
Toro-Labbe, A
Citation: S. Gutierrez-oliva et al., Using Sanderson's principle to estimate global electronic properties and bond energies of hydrogen-bonded complexes, J PHYS CH A, 104(39), 2000, pp. 8955-8964
Authors:
Perez, P
Toro-Labbe, A
Contreras, R
Citation: P. Perez et al., Global and local analysis of the gas-phase acidity of haloacetic acids, J PHYS CH A, 104(24), 2000, pp. 5882-5887
HSAB analysis of charge transfer in the gas-phase acid-base equilibria of alkyl-substituted alcohols
Authors:
Perez, P
Toro-Labbe, A
Contreras, R
Citation: P. Perez et al., HSAB analysis of charge transfer in the gas-phase acid-base equilibria of alkyl-substituted alcohols, J PHYS CH A, 103(50), 1999, pp. 11246-11249
Authors:
Chattaraj, PK
Fuentealba, P
Jaque, P
Toro-Labbe, A
Citation: Pk. Chattaraj et al., Validity of the minimum polarizability principle in molecular vibrations and internal rotations: An ab initio SCF study, J PHYS CH A, 103(46), 1999, pp. 9307-9312
Authors:
Sola, M
Toro-Labbe, A
Citation: M. Sola et A. Toro-labbe, The Hammond postulate and the principle of maximum hardness in some intramolecular rearrangement reactions, J PHYS CH A, 103(44), 1999, pp. 8847-8852
Authors:
Toro-Labbe, A
Citation: A. Toro-labbe, Characterization of chemical reactions from the profiles of energy, chemical potential and hardness, J PHYS CH A, 103(22), 1999, pp. 4398-4403
Authors:
Letelier, JR
Toro-Labbe, A
Citation: Jr. Letelier et A. Toro-labbe, Extended Huckel orbital forces in molecules, BOL SOC CH, 44(1), 1999, pp. 87-98
Authors:
Aguirre, MJ
Cardenas-Jiron, GI
Toro-Labbe, A
Zagal, JH
Citation: Mj. Aguirre et al., A theoretical procedure to determine interaction energies in complex systems: application to the oxygen-iron tetraazaporphyrin interaction, J MOL ST-TH, 493, 1999, pp. 219-224
Authors:
Gutierrez-Oliva, S
Letelier, JR
Toro-Labbe, A
Citation: S. Gutierrez-oliva et al., Energy, chemical potential and hardness profiles for the rotational isomerization of HOOH, HSOH and HSSH, MOLEC PHYS, 96(1), 1999, pp. 61-70
Authors:
Letelier, JR
Toro-Labbe, A
Chiu, YN
Citation: Jr. Letelier et al., Extended Huckel orbital forces and the Jahn-Teller distortions in molecules, J CHIN CHEM, 46(3), 1999, pp. 333-339
Risultati:
1-18
|