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Juan Fernando Espinal
Juan Fernando Espinal
Profesor Titular, Instituto de Química, Universidad de Antioquia
在 udea.edu.co 的电子邮件经过验证
标题
引用次数
引用次数
年份
Improving the deconvolution and interpretation of XPS spectra from chars by ab initio calculations
M Smith, L Scudiero, J Espinal, JS McEwen, M Garcia-Perez
Carbon 110, 155-171, 2016
4402016
Structural analysis of char by Raman spectroscopy: Improving band assignments through computational calculations from first principles
MW Smith, I Dallmeyer, TJ Johnson, CS Brauer, JS McEwen, JF Espinal, ...
Carbon 100, 678-692, 2016
3662016
A DFT study of interaction of carbon monoxide with carbonaceous materials
JF Espinal, A Montoya, F Mondragon, TN Truong
The Journal of Physical Chemistry B 108 (3), 1003-1008, 2004
952004
Thermodynamic evaluation of steam gasification mechanisms of carbonaceous materials
JF Espinal, F Mondragón, TN Truong
Carbon 47 (13), 3010-3018, 2009
622009
Mechanisms of NH3 formation during the reaction of H2 with nitrogen containing carbonaceous materials
JF Espinal, TN Truong, F Mondragón
Carbon 45 (11), 2273-2279, 2007
552007
Mechanisms for methane and ethane formation in the reaction of hydrogen with carbonaceous materials
JF Espinal, F Mondragón, TN Truong
Carbon 43 (9), 1820-1827, 2005
522005
Experimental characterization and molecular simulation of nitrogen complexes formed upon NO–char reaction at 270° C in the presence of H2O and O2
P Garcı́a, JF Espinal, CSM de Lecea, F Mondragón
Carbon 42 (8-9), 1507-1515, 2004
522004
Molecular Interaction of (Ethanol)2−Water Heterotrimers
SM Mejía, JF Espinal, A Restrepo, F Mondragón
The Journal of Physical Chemistry A 111 (33), 8250-8256, 2007
462007
Effect of calcium on gasification of carbonaceous materials with CO2: A DFT study
JD González, F MondragÓn, JF Espinal
Fuel 114, 199-205, 2013
412013
Cooperative effects on the structure and stability of (ethanol) 3–water,(methanol) 3–water heterotetramers and (ethanol) 4,(methanol) 4 tetramers
SM Mejía, JF Espinal, F Mondragón
Journal of Molecular Structure: THEOCHEM 901 (1-3), 186-193, 2009
392009
Mechanisms for homogeneous and heterogeneous formation of methane during the carbon–hydrogen reaction over zigzag edge sites
LA Calderón, E Chamorro, JF Espinal
Carbon 102, 390-402, 2016
312016
Theoretical study of sodium effect on the gasification of carbonaceous materials with carbon dioxide
LA Calderón, J Garza, JF Espinal
The Journal of Physical Chemistry A 119 (51), 12756-12766, 2015
292015
Understanding the kinetics of carbon-hydrogen reaction: Insights from reaction mechanisms on zigzag edges for homogeneous and heterogeneous formation of methane
LA Calderón, E Chamorro, JF Espinal
Carbon 118, 597-606, 2017
142017
Calcination Temperature Effect in Catalyst Reactivity for the CO SELOX Reaction Using Perovskite-like LaBO3 (B: Mn, Fe, Co, Ni) Oxides
J Tapia-P, J Gallego, JF Espinal
Catalysis Letters, 1-14, 2021
122021
Experimental and Computational Analysis of the Formation of Surface Oxygen Functional Groups during Iron Catalyzed Char Gasification with CO2
C Jimenez-Orozco, F Mondragón, JF Espinal
Combustion Science and Technology 190 (4), 687-706, 2018
112018
Estudio del azeótropo etanol-agua. Caracterización molecular de dímeros de etanol, heterodímeros y heterotrímeros de etanol-agua
SM Mejía, JF Espinal, F Mondragón
Energética, 5-18, 2006
102006
Thermochemistry and kinetic analysis for the conversion of furfural to valuable added products
N Pino, D López, JF Espinal
Journal of Molecular Modeling 25, 1-10, 2019
82019
Thermodynamic evaluation of carbon dioxide gasification reactions at oxy-combustion conditions
K Palacio, A Sanchez, JF Espinal
Combustion Science and Technology 190 (9), 1515-1527, 2018
82018
CSM d. Lecea and F. Mondragón (2004). Experimental characterization and molecular simulation of nitrogen complexes formed upon NO–char reaction at 270 oC in the presence of H2O …
P García, JF Espinal
Carbon 42, 1507-1515, 0
8
Mechanism of glycerol dehydration and dehydrogenation: an experimental and computational correlation
M Velásquez, C Batiot-Dupeyrat, JF Espinal, A Sánchez, A Santamaría
Dyna 86 (208), 126-135, 2019
72019
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