| Electrodonating and electroaccepting powers JL Gazquez, A Cedillo, A Vela The Journal of Physical Chemistry A 111 (10), 1966-1970, 2007 | 381 | 2007 |
| Quantum chemical study of the inhibitive properties of 2-pyridyl-azoles B Gómez, NV Likhanova, MA Domínguez-Aguilar, R Martínez-Palou, ... The Journal of Physical Chemistry B 110 (18), 8928-8934, 2006 | 248 | 2006 |
| Electronegativity JA Alsono Springer Berlin Heidelberg, 1987 | 239 | 1987 |
| Charge-transfer complexes: Stringent tests for widely used density functionals E Ruiz, DR Salahub, A Vela The Journal of Physical Chemistry 100 (30), 12265-12276, 1996 | 207 | 1996 |
| Description of electron delocalization via the analysis of molecular fields G Merino, A Vela, T Heine Chemical reviews 105 (10), 3812-3841, 2005 | 180 | 2005 |
| A relationship between the static dipole polarizability, the global softness, and the fukui function A Vela, JL Gazquez Journal of the American Chemical Society 112 (4), 1490-1492, 1990 | 175 | 1990 |
| Recent advances in planar tetracoordinate carbon chemistry G Merino, MA Mendez‐Rojas, A Vela, T Heine Journal of computational chemistry 28 (1), 362-372, 2007 | 164 | 2007 |
| Defining the domain of density functionals: Charge-transfer complexes E Ruiz, DR Salahub, A Vela Journal of the American Chemical Society 117 (3), 1141-1142, 1995 | 155 | 1995 |
| Chemical reactivity in spin-polarized density functional theory M Galvan, A Vela, JL Gazquez The Journal of Physical Chemistry 92 (22), 6470-6474, 1988 | 152 | 1988 |
| Determining and extending the domain of exchange and correlation functionals EI Proynov, E Ruiz, A Vela, DR Salahub International Journal of Quantum Chemistry 56 (S29), 61-78, 1995 | 137 | 1995 |
| Planar tetracoordinate carbon in extended systems PD Pancharatna, MA Méndez-Rojas, G Merino, A Vela, R Hoffmann Journal of the American Chemical Society 126 (46), 15309-15315, 2004 | 130 | 2004 |
| Troubleshooting time-dependent density-functional theory for photochemical applications: Oxirane F Cordova, LJ Doriol, A Ipatov, ME Casida, C Filippi, A Vela The Journal of chemical physics 127 (16), 164111, 2007 | 121 | 2007 |
| Theoretical analysis of the smallest carbon cluster containing a planar tetracoordinate carbon G Merino, MA Méndez-Rojas, HI Beltrán, C Corminboeuf, T Heine, A Vela Journal of the American Chemical Society 126 (49), 16160-16169, 2004 | 118 | 2004 |
| DeMon2k G Geudtner, P Calaminici, J Carmona‐Espíndola, JM del Campo, ... Wiley Interdisciplinary Reviews: Computational Molecular Science 2 (4), 548-555, 2012 | 113 | 2012 |
| demon2k AM Köster, A Goursot, DR Salahub Elsevier, 2013 | 111 | 2013 |
| The implications of symmetry of the external potential on bond paths E Cerpa, A Krapp, A Vela, G Merino Chemistry–A European Journal 14 (33), 10232-10234, 2008 | 109 | 2008 |
| (C5M2-n)n- (M = Li, Na, K, and n = 0, 1, 2). A New Family of Molecules Containing Planar Tetracoordinate Carbons G Merino, MA Méndez-Rojas, A Vela Journal of the American Chemical Society 125 (20), 6026-6027, 2003 | 106 | 2003 |
| Stereoelectronic interpretation for the anomalous 1H NMR chemical shifts and one-bond CH coupling constants (Perlin effects) in 1, 3-dioxanes, 1, 3-oxathianes, and 1, 3 … E Juaristi, G Cuevas, A Vela Journal of the American Chemical Society 116 (13), 5796-5804, 1994 | 104 | 1994 |
| Nonlocal correlation functional involving the Laplacian of the density EI Proynov, A Vela, DR Salahub Chemical physics letters 230 (4-5), 419-428, 1994 | 97 | 1994 |
| Extended Hückel parameters from density functional theory A Vela, JL Gazquez The Journal of Physical Chemistry 92 (20), 5688-5693, 1988 | 93 | 1988 |
Dennis R. SalahubProfessor of Chemistry, University of CalgaryVerified email at ucalgary.ca
