A computational study of stereospecifity in the thermal elimination reaction of menthyl benzoate in the gas phase E Velez, J Quijano, R Notario, E Pabon, J Murillo, J Leal, E Zapata, ... Journal of Physical Organic Chemistry 22 (10), 971-977, 2009 | 151 | 2009 |
Experimental and theoretical determination of the antioxidant properties of isoespintanol (2-isopropyl-3, 6-dimethoxy-5-methylphenol) B Rojano, J Saez, G Schinella, J Quijano, E Vélez, A Gil, R Notario Journal of molecular Structure 877 (1-3), 1-6, 2008 | 118 | 2008 |
Mercury removal in wastewater by iron oxide nanoparticles E Vélez, GE Campillo, G Morales, C Hincapié, J Osorio, O Arnache, ... Journal of physics: conference series 687 (1), 012050, 2016 | 70 | 2016 |
Silver Nanoparticles Obtained by Aqueous or Ethanolic Aloe vera Extracts: An Assessment of the Antibacterial Activity and Mercury Removal Capability E Vélez, G Campillo, G Morales, C Hincapié, J Osorio, O Arnache Journal of Nanomaterials 2018 (1), 7215210, 2018 | 65 | 2018 |
Theoretical study of the mechanism of thermal decomposition of carbonate esters in the gas phase R Notario, J Quijano, C Sánchez, E Vélez Journal of physical organic chemistry 18 (2), 134-141, 2005 | 49 | 2005 |
Synthesis of silver nanoparticles (AgNPs) with antibacterial activity EC Gloria, V Ederley, M Gladis, H César, O Jaime, A Oscar, IU José, ... Journal of Physics: Conference Series 850 (1), 012023, 2017 | 23 | 2017 |
N–H Activation of Ammonia by [{M(μ-OMe)(cod)}2] (M = Ir, Rh) Complexes: A DFT Study E Vélez, MP Betoré, MA Casado, V Polo Organometallics 34 (16), 3959-3966, 2015 | 23 | 2015 |
Thermal decomposition of 4‐hydroxy‐2‐butanone in m‐xylene solution: Experimental and computational study J Murillo, D Henao, E Vélez, C Castaño, J Quijano, J Gaviria, E Zapata International Journal of Chemical Kinetics 44 (6), 407-413, 2012 | 23 | 2012 |
Understanding the reaction mechanism of the oxidative addition of ammonia by (PXP) Ir (i) complexes: The role of the X group J Munarriz, E Velez, MA Casado, V Polo Physical Chemistry Chemical Physics 20 (2), 1105-1113, 2018 | 21 | 2018 |
Computational study of the mechanism of thermal decomposition of xanthates in the gas phase (the Chugaev reaction) E Velez, J Quijano, R Notario, J Murillo, JF Ramirez Journal of Physical Organic Chemistry 21 (9), 797-807, 2008 | 20 | 2008 |
A density functional theory study of the magnetic exchange coupling in dinuclear manganese (II) inverse crown structures E Vélez, A Alberola, V Polo The Journal of Physical Chemistry A 113 (50), 14008-14013, 2009 | 19 | 2009 |
Sulfur-Based Redox Reactions in Mo3S74+ and Mo3S44+ Clusters Bearing Halide and 1,2-Dithiolene Ligands: a Mass Spectrometric and Density Functional … R Llusar, V Polo, E Velez, C Vicent Inorganic chemistry 49 (17), 8045-8055, 2010 | 15 | 2010 |
Calorimetric and computational study of 3-buten-1-ol and 3-butyn-1-ol. Estimation of the enthalpies of formation of 1-alkenols and 1-alkynols E Vélez, J Quijano, J Gaviria, MV Roux, P Jiménez, M Temprado, ... The Journal of Physical Chemistry A 109 (34), 7832-7838, 2005 | 13 | 2005 |
Theoretical study of the gas-phase thermolysis reaction of alkyl (ethyl, isopropyl, and tert-butyl) N, N-dimethylcarbamates and N, N-diethylcarbamates C Quijano, R Notario, J Quijano, C Sánchez, LA León, E Vélez Theoretical Chemistry Accounts 110, 377-386, 2003 | 13 | 2003 |
A density functional theory study of the gas-phase elimination reactions of 4-arylideneimino-1, 2, 4-triazol-3 (2H)-ones and their 3 (2H)-thione analogues LA León, R Notario, J Quijano, E Vélez, C Sánchez, JC Quijano, ... Theoretical Chemistry Accounts 110, 387-394, 2003 | 10 | 2003 |
Theoretical Insight into mechanism of antioxidant capacity of atorvastatin and its o-hydroxy and p-hydroxy metabolites, using DFT methods L Duque, G Guerrero, JH Colorado, JA Restrepo, E Velez Computational and Theoretical Chemistry 1214, 113758, 2022 | 8 | 2022 |
Mechanism of Antioxidant Activity of Betanin, Betanidin and Respective C15-Epimers via Shape Theory, Molecular Dynamics, Density Functional Theory and Infrared Spectroscopy IM Ramirez-Velasquez, E Velez, A Bedoya-Calle, FJ Caro-Lopera Molecules 27 (6), 2003, 2022 | 8 | 2022 |
Green synthesis of magnetic nanoparticles using leaf extracts of Aloe vera and Kalanchoe daigremontiana to remove divalent mercury from natural waters G Morales, G Campillo, E Vélez, J Osorio, J Urquijo, ÁA Velásquez Journal of physics: conference series 1247 (1), 012021, 2019 | 8 | 2019 |
Experimental and computational thermochemical study of 3-hydroxypropanenitrile MV Roux, R Notario, E Vélez, M Temprado, A Guerrero, SP Verevkin, ... The Journal of Chemical Thermodynamics 39 (10), 1377-1383, 2007 | 8 | 2007 |
The mechanism of formation of glass-ionomer cement: a theoretical study J Gaviria, CG García, E Vélez, J Quijano Modeling and Numerical Simulation of Material Science 2013, 2013 | 7 | 2013 |