| Adsorptive behavior of CO 2, CH 4 and their mixtures in carbon nanospace: a molecular simulation study JC Palmer, JD Moore, TJ Roussel, JK Brennan, KE Gubbins Physical Chemistry Chemical Physics 13 (9), 3985-3996, 2011 | 83 | 2011 |
| Experimental and atomistic simulation study of the structural and adsorption properties of faujasite zeolite− templated nanostructured carbon materials T Roussel, A Didion, RJM Pellenq, R Gadiou, C Bichara, C Vix-Guterl The Journal of Physical Chemistry C 111 (43), 15863-15876, 2007 | 74 | 2007 |
| Microporous carbon adsorbents with high CO 2 capacities for industrial applications S Builes, T Roussel, CM Ghimbeu, J Parmentier, R Gadiou, C Vix-Guterl, ... Physical Chemistry Chemical Physics 13 (35), 16063-16070, 2011 | 71 | 2011 |
| Adsorption and diffusion of argon confined in ordered and disordered microporous carbons JD Moore, JC Palmer, YC Liu, TJ Roussel, JK Brennan, KE Gubbins Applied Surface Science 256 (17), 5131-5136, 2010 | 57 | 2010 |
| Optimization of the separation of sulfur hexafluoride and nitrogen by selective adsorption using monte carlo simulations S Builes, T Roussel, LF Vega AIChE journal 57 (4), 962-974, 2011 | 55 | 2011 |
| Transition from single-file to Fickian diffusion for binary mixtures in single-walled carbon nanotubes Q Chen, JD Moore, YC Liu, TJ Roussel, Q Wang, T Wu, KE Gubbins The Journal of chemical physics 133 (9), 2010 | 50 | 2010 |
| Thermodynamic and neutron scattering study of hydrogen adsorption in two mesoporous ordered carbons T Roussel, RJM Pellenq, M Bienfait, C Vix-Guterl, R Gadiou, F Beguin, ... Langmuir 22 (10), 4614-4619, 2006 | 40 | 2006 |
| Hydrogen storage enhanced in Li-doped carbon replica of zeolites: A possible route to achieve fuel cell demand T Roussel, C Bichara, KE Gubbins, RJM Pellenq The Journal of chemical physics 130 (17), 2009 | 36 | 2009 |
| Dual diffusion mechanism of argon confined in single-walled carbon nanotube bundles YC Liu, JD Moore, TJ Roussel, KE Gubbins Physical Chemistry Chemical Physics 12 (25), 6632-6640, 2010 | 35 | 2010 |
| Predicting supramolecular self-assembly on reconstructed metal surfaces TJ Roussel, E Barrena, C Ocal, J Faraudo Nanoscale 6 (14), 7991-8001, 2014 | 32 | 2014 |
| Molecular simulations of water in hydrophobic microporous solids RJM Pellenq, T Roussel, J Puibasset Adsorption 14, 733-742, 2008 | 31 | 2008 |
| Modeling the self-assembly of nano objects: applications to supramolecular organic monolayers adsorbed on metal surfaces TJ Roussel, LF Vega Journal of Chemical Theory and Computation 9 (5), 2161-2169, 2013 | 30 | 2013 |
| Testing the feasibility of using the density functional theory route for pore size distribution calculations of ordered microporous carbons T Roussel, J Jagiello, RJM Pellenq, M Thommes, C Bichara Molecular Simulation 32 (7), 551-555, 2006 | 28 | 2006 |
| Self-assembly of a catechol-based macrocycle at the liquid–solid interface: experiments and molecular dynamics simulations J Saiz-Poseu, A Martínez-Otero, T Roussel, JKH Hui, ML Montero, ... Physical Chemistry Chemical Physics 14 (34), 11937-11943, 2012 | 21 | 2012 |
| Selenium and Carbon Nanostructures in the Pores of AlPO4-5 T Roussel, C Bichara, RJM Pellenq Adsorption 11 (Suppl 1), 709-714, 2005 | 17 | 2005 |
| Structure of narrow-diameter single-wall carbon nanotubes grown in zeolite T Roussel, RJM Pellenq, C Bichara Physical Review B—Condensed Matter and Materials Physics 76 (23), 235418, 2007 | 13 | 2007 |
| Observation and modeling of conformational molecular structures driving the self-assembly of tri-adamantyl benzene on Ag (111) B Calmettes, N Estrampes, C Coudret, TJ Roussel, J Faraudo, R Coratger Physical Chemistry Chemical Physics 18 (30), 20281-20289, 2016 | 5 | 2016 |
| Crossover from single-file to Fickian diffusion in carbon nanotubes and nanotube bundles: pure components and mixtures YC Liu, JD Moore, Q Chen, TJ Roussel, Q Wang, KE Gubbins Proceedings of the Diffusion Fundamentals III Conference, 164-180, 2009 | 5 | 2009 |
| Local order in undercooled liquid metals: A tight binding molecular dynamics approach T Roussel, C Mottet, C Bichara Journal of non-crystalline solids 353 (32-40), 3679-3683, 2007 | 4 | 2007 |
| Simulation numérique de répliques de zéolithes en carbone: structures et propriétés d'adsorption en vue d'une application au stockage d'hydrogène| Theses. fr TJ Roussel Aix-Marseille 2, 2007 | 2 | 2007 |