Boutin A - Search Results

1

Breathing transitions in MIL-53(Al) metal-organic framework upon xenon adsorption.

Boutin A, Springuel-Huet MA, Nossov A, Gédéon A, Loiseau T, Volkringer C, Férey G, Coudert FX, Fuchs AH. Boutin A, et al. Angew Chem Int Ed Engl. 2009;48(44):8314-7. doi: 10.1002/anie.200903153. Angew Chem Int Ed Engl. 2009. PMID: 19780084 No abstract available.

2

Placement of cations in NaX faujasite-type zeolite using (N,V,T) Monte Carlo simulations.

Mellot-Draznieks C, Buttefey S, Boutin A, Fuchs AH. Mellot-Draznieks C, et al. Among authors: boutin a. Chem Commun (Camb). 2001 Nov 7;(21):2200-1. doi: 10.1039/b103808g. Chem Commun (Camb). 2001. PMID: 12240110

3

A numerical evidence for nonframework cation redistribution upon water adsorption in faujasite zeolite.

Beauvais C, Boutin A, Fuchs AH. Beauvais C, et al. Among authors: boutin a. Chemphyschem. 2004 Nov 12;5(11):1791-3. doi: 10.1002/cphc.200400195. Chemphyschem. 2004. PMID: 15580943 No abstract available.

4

Monte Carlo versus molecular dynamics simulations in heterogeneous systems: an application to the n-pentane liquid-vapor interface.

Goujon F, Malfreyt P, Simon JM, Boutin A, Rousseau B, Fuchs AH. Goujon F, et al. Among authors: boutin a. J Chem Phys. 2004 Dec 22;121(24):12559-71. doi: 10.1063/1.1819868. J Chem Phys. 2004. PMID: 15606277

5

Molecular dynamics simulations of electron-alkali cation pairs in bulk water.

Coudert FX, Archirel P, Boutin A. Coudert FX, et al. Among authors: boutin a. J Phys Chem B. 2006 Jan 12;110(1):607-15. doi: 10.1021/jp0542975. J Phys Chem B. 2006. PMID: 16471573

6

Dipole moment, hydrogen bonding and IR spectrum of confined water.

Coudert FX, Vuilleumier R, Boutin A. Coudert FX, et al. Among authors: boutin a. Chemphyschem. 2006 Dec 11;7(12):2464-7. doi: 10.1002/cphc.200600561. Chemphyschem. 2006. PMID: 17111458 No abstract available.

7

Molecular simulation studies of water physisorption in zeolites.

Di Lella A, Desbiens N, Boutin A, Demachy I, Ungerer P, Bellat JP, Fuchs AH. Di Lella A, et al. Among authors: boutin a. Phys Chem Chem Phys. 2006 Dec 14;8(46):5396-406. doi: 10.1039/b610621h. Epub 2006 Oct 17. Phys Chem Chem Phys. 2006. PMID: 17119646

8

The effect of local defects on water adsorption in silicalite-1 zeolite: a joint experimental and molecular simulation study.

Trzpit M, Soulard M, Patarin J, Desbiens N, Cailliez F, Boutin A, Demachy I, Fuchs AH. Trzpit M, et al. Among authors: boutin a. Langmuir. 2007 Sep 25;23(20):10131-9. doi: 10.1021/la7011205. Epub 2007 Aug 23. Langmuir. 2007. PMID: 17715950

9

Structural changes in nanoporous solids due to fluid adsorption: thermodynamic analysis and Monte Carlo simulations.

Jeffroy M, Fuchs AH, Boutin A. Jeffroy M, et al. Among authors: boutin a. Chem Commun (Camb). 2008 Jul 28;(28):3275-7. doi: 10.1039/b805117h. Epub 2008 May 16. Chem Commun (Camb). 2008. PMID: 18622442

10

Thermodynamics of water intrusion in nanoporous hydrophobic solids.

Cailliez F, Trzpit M, Soulard M, Demachy I, Boutin A, Patarin J, Fuchs AH. Cailliez F, et al. Among authors: boutin a. Phys Chem Chem Phys. 2008 Aug 28;10(32):4817-26. doi: 10.1039/b807471b. Epub 2008 Jul 9. Phys Chem Chem Phys. 2008. PMID: 18688525

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