DeMon2k G Geudtner, P Calaminici, J Carmona‐Espíndola, JM del Campo, ... Wiley Interdisciplinary Reviews: Computational Molecular Science 2 (4), 548-555, 2012 | 195 | 2012 |
Handbook of computational chemistry P Calaminici, VD Dominguez-Soria, R Flores-Moreno, GU Gamboa, ... Leszczynski J, 795-860, 2011 | 57 | 2011 |
Theoretical study of the structure and properties of Na-MOR and H-MOR zeolite models VD Dominguez-Soria, P Calaminici, A Goursot The Journal of chemical physics 127 (15), 2007 | 41 | 2007 |
Robust and efficient density fitting VD Domínguez-Soria, G Geudtner, JL Morales, P Calaminici, AM Köster The Journal of chemical physics 131 (12), 2009 | 40 | 2009 |
Auxiliary density functional theory: From molecules to nanostructures P Calaminici, A Alvarez-Ibarra, D Cruz-Olvera, VD Dominguez-Soria, ... Handbook of computational chemistry, 1, 2016 | 36 | 2016 |
Wiley Interdiscip G Geudtner, P Calaminici, J Carmona-Espíndola, JM del Campo, ... Rev.: Comput. Mol. Sci 2, 548-555, 2012 | 35 | 2012 |
Parallelization of three-center electron repulsion integrals P Calaminici, VD Domínguez-Soria, G Geudtner, E Hernández-Marín, ... Theoretical Chemistry Accounts 115, 221-226, 2006 | 28 | 2006 |
C-, N-, S-, and F-Doped Anatase TiO2 (101) with Oxygen Vacancies: Photocatalysts Active in the Visible Region JC González-Torres, E Poulain, V Domínguez-Soria, R García-Cruz, ... International Journal of Photoenergy 2018, 2018 | 27 | 2018 |
Theoretical Study of Host− Guest Interactions in the Large and Small Cavities of MOR Zeolite Models VD Dominguez-Soria, P Calaminici, A Goursot The Journal of Physical Chemistry C 115 (14), 6508-6512, 2011 | 22 | 2011 |
Optical properties of anatase TiO2: synergy between transition metal doping and oxygen vacancies JC González-Torres, LA Cipriano, E Poulain, V Dominguez-Soria, ... Journal of Molecular Modeling 24, 1-11, 2018 | 10 | 2018 |
Molecular graphs of Li n clusters (n= 2–6) from the density and the molecular electrostatic potential P Calaminici, VD Dominguez-Soria, G Geudtner, AM Köster Journal of Computational Methods in Sciences and Engineering 7 (5-6), 383-394, 2007 | 7 | 2007 |
Molecular graphs of Lin, Nan and Cun (n= 6–9) clusters from the density and the molecular electrostatic potential G Geudtner, VD Domínguez-Soria, P Calaminici, AM Köster Computational and Theoretical Chemistry 1053, 337-342, 2015 | 6 | 2015 |
Parallelization of the variational fitting of the Coulomb potential P Calaminici, VD Domínguez-Soria, G Geudtner, E Hernández-Marín, ... Superficies y vacío 18 (1), 1-5, 2005 | 6 | 2005 |
Wiley Interdiscip. Rev.: Comput. Mol. Sci. 2, 548 (2012) G Geudtner, P Calaminici, J Carmona-Espíndola, JM del Campo, ... | 5 | |
Comparison of molecular graphs of Lin, Nan and Cun (n = 2–5) clusters obtained from the density and the molecular electrostatic potential P Calaminici, VD Domínguez‐Soria, AM Köster International Journal of Quantum Chemistry 112 (22), 3624-3629, 2012 | 4 | 2012 |
The π back-donation influence in CO oxidation on small and oxidized Au–Ag clusters R García-Cruz, J Gonzalez-Torres, A Montoya-Moreno, ... Chemical Physics 556, 111462, 2022 | 3 | 2022 |
Introducción y desarrollo de las propiedades ópticas de los materiales JC Espinoza Tapia, I Hernández Pérez, L González Reyes, ... Universidad Autónoma Metropolitana (México). Unidad Azcapotzalco. División …, 2016 | 3 | 2016 |
Theoretical study of the structure and properties of Na-MOR and H-MOR zeolite models VD Dominguez-Soria, P Calaminici, A Goursot Studies in surface science and catalysis 174, 717-720, 2008 | 2 | 2008 |
Cálculo de la coordenada intrínseca de la reacción (IRC) para obtener ácido isocianídrico (HNC) a partir del ácido cianídrico (HCN) JC Espinoza Tapia, VD Domínguez Soria, Ó Olvera Neria, ... Universidad Autónoma Metropolitana (México). Unidad Azcapotzalco. División …, 2016 | 1 | 2016 |
Estudio de materiales magnéticos por medio de software VD Domínguez Soria, JC González Torres, HA González Uribe Universidad Autónoma Metropolitana (México). Unidad Azcapotzalco. División …, 2021 | | 2021 |