Nombre de documents

20

CV de François-Xavier Coudert


HDR1 document

  • François-Xavier Coudert. Outils théoriques pour l'adsorption dans les matériaux nanoporeux cristallins. Chimie théorique et/ou physique. Université Pierre et Marie Curie - Paris VI, 2013. <tel-00808487>

Article dans une revue18 documents

  • Dario Corradini, François-Xavier Coudert, Rodolphe Vuilleumier. Insight into the Li2CO3–K2CO3 eutectic mixture from classical molecular dynamics: Thermodynamics, structure, and dynamics. Journal of Chemical Physics, American Institute of Physics, 2016, 144 (10), pp.104507. <10.1063/1.4943392>. <hal-01304270>
  • Jean-Mathieu Vanson,, François-Xavier Coudert, Benjamin Rotenberg, Maximilien Levesque, Caroline Tardivat, et al.. Unexpected coupling between flow and adsorption in porous media. Soft Matter, Royal Society of Chemistry, 2015, 11 (30), pp.6125-6133. <10.1039/c5sm01348h>. <hal-01308089>
  • Lila Bouëssel Du Bourg, Aurélie U. Ortiz, Anne Boutin, François-Xavier Coudert. Thermal and mechanical stability of zeolitic imidazolate frameworks polymorphs. APL Materials, AIP Publishing 2014, 2 (12), pp.124110. <10.1063/1.4904818>. <hal-01307456>
  • Aurélie U. Ortiz, Anne Springuel-Huet, François-Xavier Coudert, Alain H. Fuchs, Anne Boutin. Predicting Mixture Coadsorption in Soft Porous Crystals: Experimental and Theoretical Study of CO 2 /CH 4 in MIL-53(Al). Langmuir, American Chemical Society, 2012, 28 (1), pp.494 - 498. <10.1021/la203925y>. <hal-01468499>
  • François-Xavier Coudert. The osmotic framework adsorbed solution theory: predicting mixture coadsorption in flexible nanoporous materials.. Physical Chemistry Chemical Physics, Royal Society of Chemistry, 2010, 12 (36), pp.10904-13. <10.1039/c003434g>. <hal-00548066>
  • Selvarengan Paranthaman, François-Xavier Coudert, Alain H. Fuchs. Water adsorption in hydrophobic MOF channels.. Physical Chemistry Chemical Physics, Royal Society of Chemistry, 2010, 12 (28), pp.8123-9. <10.1039/b925074c>. <hal-00548067>
  • Anne Boutin, Marie-Anne Springuel-Huet, Andrei Nossov, Antoine Gedeon, Thierry Loiseau, et al.. Breathing transitions in MIL-53(Al) metal-organic framework upon xenon adsorption.. Angewandte Chemie (English Edition), John Wiley & Sons, 2009, 48 (44), pp.8314-7. <10.1002/anie.200903153>. <hal-00548070>
  • Neimark Alexander, François-Xavier Coudert, Anne Boutin, Alain H. Fuchs. Stress-Based Model for the Breathing of Metal−Organic Frameworks. Journal of Physical Chemistry Letters, American Chemical Society, 2009, 1 (1), pp.445-449. <10.1021/jz9003087>. <hal-00548069>
  • François-Xavier Coudert, Caroline Mellot-Draznieks, Alain H. Fuchs, Anne Boutin. Prediction of breathing and gate-opening transitions upon binary mixture adsorption in metal-organic frameworks.. Journal of the American Chemical Society, American Chemical Society, 2009, 131 (32), pp.11329-31. <10.1021/ja904123f>. <hal-00548071>
  • François-Xavier Coudert, Mellot-Draznieks Caroline, Alain H. Fuchs, Boutin Anne. Double Structural Transition in Hybrid Material MIL-53 upon Hydrocarbon Adsorption: The Thermodynamics Behind the Scenes. Journal of the American Chemical Society, American Chemical Society, 2009, 131 (10), pp.93442-3443. <10.1021/ja8094153>. <hal-00378707>
  • François-Xavier Coudert, Anne Boutin. Confinement effect on the hydrated electron behaviour. Chemical Physics Letters, Elsevier, 2006, 428, pp.68-72. <10.1016/j.cplett.2006.07.023>. <hal-00087416>
  • François-Xavier Coudert, Rodolphe Vuilleumier, Anne Boutin. Dipole moment, hydrogen bonding and IR spectrum of confined water. ChemPhysChem, Wiley-VCH Verlag, 2006, 7, pp.2464. <10.1002/cphc.200600561>. <hal-00121925>
  • Anne Boutin, Riccardo Spezia, François-Xavier Coudert, Mehran Mostafavi. Molecular Dynamics Simulations of the Temperature and Density Dependence of the Absorption Spectra of Hydrated Electron and Solvated Silver Atom in Water. Chemical Physics Letters, Elsevier, 2005, 409 (4-6), pp.219-223. <10.1016/j.cplett.2005.05.012>. <hal-00199373>
  • Riccardo Spezia, François-Xavier Coudert, Anne Boutin. Theoretical study of neutral dipolar atom in water : structure, spectroscopy and formation of an excitonic state.. Modern Physics Letters B, World Scientific Publishing, 2004, 18, pp.1327. <hal-00137644>
  • Riccardo Spezia, François-Xavier Coudert, Anne Boutin. STUDYING NEUTRAL DIPOLAR ATOMS IN WATER VIA ATOMISTIC SIMULATIONS: STRUCTURE, SPECTROSCOPY AND FORMATION OF AN EXCITONIC STATE. Modern Physics Letters B, World Scientific Publishing, 2004, 18 (26/27), pp.1327-1345. <10.1142/S0217984904007827>. <hal-00199371>
  • Riccardo Spezia, Cédric Nicolas, François-Xavier Coudert, Pierre Archirel, Rodolphe Vuilleumier, et al.. Reactivity of an Excess Electron with Monovalent Cations in Bulk Water by Mixed Quantum Classical Molecular Dynamics Simulations. Molecular Simulation, Taylor & Francis, 2004, 30 (11 & 12), pp.749-754. <10.1080/0892702042000270142>. <hal-00203013>
  • Riccardo Spezia, Cédric Nicolas, François-Xavier Coudert, Pierre Archirel, Rodolphe Vuilleumier, et al.. Reactivity of an excess electron with monovalent cations in bulk water by mixed quantum classical molecular dynamics simulations.. Molecular Simulation, Taylor & Francis, 2004, 30, pp.749. <hal-00137645>
  • Christèle Beauvais, Xavier Guerrault, François-Xavier Coudert, Anne Boutin, Alain H. Fuchs. Distribution of Sodium Cations in Faujasite-Type Zeolite: A Canonical Parallel Tempering Simulation Study. Journal of Physical Chemistry B, American Chemical Society, 2003, 108 (1), pp.399-404. <10.1021/jp036085i>. <hal-00367857>

Thèse1 document

  • François-Xavier Coudert. L'eau et l'électron hydraté en milieu confiné : des propriétés physico-chimiques à la réactivité. Autre. Université Paris Sud - Paris XI, 2007. Français. <tel-00157339>