Elena García‐Pérez

Universidad Pablo de Olavide — Spain

Chemistry · Physical Sciences

19h-index1.8kcitations32works0.02yr avg
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Research Topics

Zeolite Catalysis and Synthesis(15), Metal-Organic Frameworks: Synthesis and Applications(11), Membrane Separation and Gas Transport(8), Mesoporous Materials and Catalysis(5), Covalent Organic Framework Applications(5)

Publications32 total

Understanding the stability and structural properties of ordered nanoporous metals towards their rational synthesis
Proceedings of the Royal Society A Mathematical Physical and Engineering Sciences·2022· 4 citedOpen Access
Ordered_Nanoporous_Metals_SI.zip from Understanding the stability and structural properties of ordered nanoporous metals toward their rational synthesis
TU/e Research Portal·2022Open Access
Thermostructural Characterization of Silicon Carbide Nanocomposite Materials via Molecular Dynamics Simulations
Advanced Composite Materials·2021· 5 citedOpen Access
Multiscale thermo-mechanical analysis of multi-layered coatings in solar thermal applications
Finite Elements in Analysis and Design·2017· 16 citedOpen Access
Thermostructural behaviour of Ni–Cr materials: modelling of bulk and nanoparticle systems
Physical Chemistry Chemical Physics·2015· 16 cited
Molecular simulation of gas adsorption and diffusion in a breathing MOF using a rigid force field
Physical Chemistry Chemical Physics·2014· 38 citedOpen Access
Metal‐Organic Frameworks: Visualizing MOF Mixed Matrix Membranes at the Nanoscale: Towards Structure‐Performance Relationships in CO<sub>2</sub>/CH<sub>4</sub> Separation Over NH<sub>2</sub>‐MIL‐53(Al)@PI (Adv. Funct. Mater. 2/2014)
Advanced Functional Materials·2014· 9 cited
Visualizing MOF Mixed Matrix Membranes at the Nanoscale: Towards Structure‐Performance Relationships in CO<sub>2</sub>/CH<sub>4</sub> Separation Over NH<sub>2</sub>‐MIL‐53(Al)@PI
Advanced Functional Materials·2013· 299 citedOpen Access
Effect of the molecular interactions on the separation of nonpolar mixtures using Cu-BTC metal–organic framework
Microporous and Mesoporous Materials·2012· 16 cited
Understanding Gas-Induced Structural Deformation of ZIF-8
The Journal of Physical Chemistry Letters·2012· 163 cited
NH2-MIL-53(Al) based mixed matrix membranes for separation of CO2 and CH4
2012
External Surface Adsorption on Silicalite-1 Zeolite Studied by Molecular Simulation
The Journal of Physical Chemistry C·2011· 19 cited
Effect of air humidity on the removal of carbon tetrachloride from air using Cu–BTC metal–organic framework
Physical Chemistry Chemical Physics·2011· 59 cited
A Simulation Study of Hydrogen in Metal–Organic Frameworks
Adsorption Science & Technology·2010· 16 citedOpen Access
On the performance of Cu-BTC metal organic framework for carbon tetrachloride gas removal
Chemical Communications·2010· 36 cited
Influence of the sodium and calcium non-framework cations on the adsorption of hexane isomers in zeolite BEA
Theoretical Chemistry Accounts·2010· 7 cited
Identification of Adsorption Sites in Cu-BTC by Experimentation and Molecular Simulation
Langmuir·2009· 114 cited
Low-coverage adsorption properties of the metal–organic framework MIL-47 studied by pulse chromatography and Monte Carlo simulations
Physical Chemistry Chemical Physics·2009· 77 cited
Computing the Heat of Adsorption using Molecular Simulations: The Effect of Strong Coulombic Interactions
Journal of Chemical Theory and Computation·2008· 220 cited
Molecular simulations for adsorption and separation of natural gas in IRMOF-1 and Cu-BTC metal-organic frameworks
Physical Chemistry Chemical Physics·2008· 110 cited
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Frequent Co-authors

Sofı́a Calero(27), David Dubbeldam(11), Said Hamad(7), Berend Smit(7), Rajamani Krishna(6), Freek Kapteijn(5), Jorge Gascón(5), Thijs J. H. Vlugt(4), Rocío Bueno-Pérez(4), Jose M. Ortiz-Roldan(4), A. Rabdel Ruiz‐Salvador(4), Tania Ródenas(3), Marion van Dalen(3), Pablo Serra‐Crespo(3), Almudena García-Sánchez(3), Jasper M. van Baten(3), Juan José Gutiérrez‐Sevillano(3), Juan Manuel Castillo(3), Ana Martín-Calvo(3), Theo L. M. Maesen(3)