Structural changes in nanoporous MFI zeolites induced by tetrachloroethene adsorption: A joint experimental and simulation study

Journal of Physical Chemistry C

Volumn 115, Issue 10, 2011, Pages 3854-3865

  Jeffroy, Marie ^a,d   Weber, Guy ^b   Hostachy, Sarah ^a   Bellat, Jean Pierre ^b   Fuchs, Alain H ^c   Boutin, Anne ^a  

^a ECOLE NORMALE SUPÉRIEURE   (France)

^b UNIVERSITÉ DE BOURGOGNE   (France)

^c PSL RESEARCH UNIVERSITY   (France)

^d UNIVERSITÉ PARIS SUD   (France)

Author keywords

[No Author keywords available]

Indexed keywords

ADSORPTION MECHANISM; ADSORPTION PROCESS; CHANNEL INTERSECTIONS; EXPERIMENTAL CURVES; ISOSTERIC HEATS; MFI ZEOLITE; MICROPORE FILLING; MOLECULAR SIMULATIONS; MONOCLINIC FORMS; NANO-POROUS; ORTHORHOMBIC FORMS; PNMA SYMMETRY; PURE SILICA; SI/AL RATIO; SILICALITE-1; SIMULATION RESULT; SIMULATION STUDIES; SINUSOIDAL CHANNELS; SODIUM CATIONS; STRUCTURAL CHANGE; SYMMETRY CHANGES; TETRACHLOROETHENE; THERMO DYNAMIC ANALYSIS; ZSM-5 ZEOLITES;

COMPUTER SIMULATION; MOLECULAR STRUCTURE; MOLECULES; SILICA; SILICATE MINERALS; THERMOANALYSIS; ZEOLITES;

ADSORPTION;

EID: 79953199844     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp109447n     Document Type: Article

References (64)

1. van den Berg, A. W. C.; Arean, C. O. Chem. Commun. 2008, 6, 668-681
2. Walton, K. S.; Millward, A. R.; Dubbeldam, D.; Frost, H.; Low, J. J.; Yaghi, O. M.; Snurr, R. Q. J. Am. Chem. Soc. 2008, 130, 406-407
3. Fuchs, A. H.; Cheetham, A. K. J. Phys. Chem. B 2001, 105, 7375-7383
4. Smit, B.; Krishna, R. Curr. Opin. Solid State Mater. Sci. 2001, 5, 455-461
5. Mellot-Drazniek, C.; Dutour, J.; Férey, G. Angew. Chem., Int. Ed. 2004, 43, 6290-6296
6. Smit, B.; Siepmann, J. I. J. Phys. Chem. 1994, 98, 8442-8452
7. Lachet, V.; Boutin, A.; Tavitian, B.; Fuchs, A. H. J. Phys. Chem. B 1998, 102, 9224-9233
8. Mellot, C. F.; Cheetham, A. K.; Harms, S.; Savitz, S.; Gorte, R. J.; Myers, A. L. Langmuir 1998, 14, 6728-6733
9. Di Lella, A.; Desbiens, N.; Boutin, A.; Demachy, I.; Ungerer, P.; Bellat, J. P.; Fuchs, A. H. Phys. Chem. Chem. Phys. 2006, 8, 5396-5406
10. Cailliez, F.; Stirnemann, G.; Boutin, A.; Demachy, I.; Fuchs, A. H. J. Phys. Chem. C 2008, 112, 10435-10445
11. Paranthaman, S.; Coudert, F.-X.; Fuchs, A. H. Phys. Chem. Chem. Phys. 2010, 12, 8123-8129
12. Leroy, F.; Rousseau, B.; Fuchs, A. H. Phys. Chem. Chem. Phys. 2004, 6, 775-783
13. Vlugt, T. J. H.; Schenk, M. J. Phys. Chem. B 2002, 106, 12757-12763
14. Vlugt, T. J. H.; Krishna, R.; Smit, B. J. Phys. Chem. B 1999, 103, 1102-1118
15. Pascual, P.; Ungerer, P.; Tavitian, B.; Pernot, P.; Boutin, A. Phys. Chem. Chem. Phys. 2003, 5, 3684-3693
16. Douguet, D.; Pellenq, R. J. M.; Boutin, A.; Fuchs, A. H.; Nicholson, D. Mol. Simul. 1996, 17, 255-288
17. Coulomb, J. P.; Llewellyn, P. L.; Martin, C.; Grillet, Y.; Rouquerol, J., Le Van, M. D., Ed. Fundamentals of Adsorption: Kluwer Academic Publishers: Boston, MA, 1996, p 211.
18. Clark, L. A.; Snurr, R. Q. Chem. Phys. Lett. 1999, 308, 155-159
19. van Koningsveld, H.; Tuinstra, F.; van Bekkum, H.; Jansen, J. C. Acta Crystallogr. B: Struct. Sci. 1989, 45, 423-431
20. Olson, D. H.; Kokotailo, G. T.; Lawton, S. L.; Meier, W. M. J. Phys. Chem. 1981, 85, 2238-2243
21. Snurr, R. Q.; Bell, A. T.; Theodorou, D. N. J. Phys. Chem. 1993, 97, 13742-13752
22. Lee, C. K.; Chiang, A. S. T. J. Chem. Soc., Faraday Trans 1996, 92, 3445-3451
23. Thamm, H. J. Phys. Chem. 1988, 92, 193-196
24. Talu, O.; Guo, C. J.; Hayhurst, D. T. J. Phys. Chem. 1989, 93, 7294-7298
25. Mentzen, B. F.; Gelin, P. Mater. Res. Bull. 1995, 30, 373-380
26. Buttefey, S.; Boutin, A.; Mellot-Draznieks, C.; Fuchs, A. H. J. Phys. Chem B 2001, 105, 9569-9575
27. Thamm, H. Zeolites 1987, 7, 341-346
28. Thamm, H. J. Phys. Chem. 1987, 91, 8-11
29. Snurr, R. Q.; Bell, A. T.; Theodorou, D. N. J. Phys. Chem. 1994, 98, 5111-5119
30. Takaishi, T.; Tsutsumi, K.; Chubachi, K.; Matsumoto, A. J. Chem. Soc., Faraday Trans. 1998, 94, 601-608
31. Hammonds, K. D.; Deng, H.; Heine, V.; Dove, M. T. Phys. Rev. Lett. 1997, 78, 3701-3704
32. Ramsahye, N. A.; Maurin, G.; Bourrelly, S.; Llewellyn, P. L.; Loiseau, T.; Serre, C.; Férey, G. Chem. Commun. 2007, 31, 3261-3263
33. Dubbeldam, D.; Walton, K. S.; Ellis, D. E.; Snurr, R. Q. Angew. Chem., Int. Ed. 2007, 46, 4496-4499
34. Coudert, F. X.; Jeffroy, M.; Fuchs, A. H.; Boutin, A.; Mellot-Draznieks, C. J. Am. Chem. Soc. 2008, 130, 14294-14302
35. Coudert, F. X.; Mellot-Draznieks, C.; Fuchs, A. H.; Boutin, A. J. Am. Chem. Soc. 2009, 131, 3442-3443
36. Ghoufi, A.; Maurin, G. J. Phys. Chem. C 2010, 114, 6496-6502
37. van Koningsveld, H.; Jansen, J. C.; van Bekkum, H. Zeolites 1990, 10, 235-242
38. Conner, W. C.; Vincent, R.; Man, P.; Fraissard, J. Catal. Lett. 1990, 4, 75-83
39. Olson, D. H.; Kokotailo, G. T.; Lawton, S. L.; Meier, W. M. J. Phys. Chem. 1981, 85, 2238-2243
40. Endoh, A. Zeolites 1988, 8, 250-251
41. Van Koningsveld, H.; Jansen, J. C. Microporous Mater. 1996, 6, 159-167
42. Van Koningsveld, H. Acta Crystallogr. B: Struct. Sci. 1990, 46, 731-735
43. van Koningsveld, H.; Jansen, J. C.; van Bekkum, H. Acta Crystallogr. B: Struct. Sci. 1996, 52, 140-144
44. Lopez, A.; Soulard, M.; Guth, J. L. Zeolites 1990, 10, 134-136
45. Floquet, N.; Coulomb, J. P.; Weber, G.; Bertrand, O.; Bellat, J. P. J. Phys. Chem. B 2003, 107, 685-693
46. Bouvier, F. Ph.D. thesis, Université de Bourgogne: Dijon, France, 1998.
47. Bouvier, F.; Weber, G. J. Therm. Anal. 1998, 54, 881-889
48. François, V. Ph.D. Thesis, Université de Bourgogne: Dijon, France, 2001.
49. Mentzen, B. F.; Lefebvre, F. C. R. Acad. Sci., Ser. IIc: Chim. 2000, 3, 843-847
50. Mentzen, B. F.; Lefebvre, F. Mater. Res. Bull. 2002, 37, 957-970
51. Bertrand, O.; Weber, G.; Maure, S.; Bernardet, V.; Bellat, J. P.; Paulin, C. J. Phys. Chem. B 2005, 109, 13312-13321
52. Jeffroy, M.; Fuchs, A. H.; Boutin, A. Chem. Commun. 2008, 28, 3275-3277
53. Mc Bain, J. W.; Bakr, A. M. J. Am. Chem. Soc. 1926, 48, 690-695
54. van Koningsveld, H.; van Bekkum, H.; Jansen, J. C. Acta Crystallogr. B: Struct. Sci. 1987, 43, 127-132
55. Desbiens, N.; Boutin, A.; Demachy, I. J. Phys. Chem. B 2005, 109, 24071-24076
56. Desbiens, N.; Demachy, I.; Fuchs, A. H.; Kirsch-Rodeschini, H.; Soulard, M.; Patarin, J. Angew. Chem., Int. Ed. 2005, 44, 5310-5313
57. Uytterhoeven, L.; Dompas, D.; Mortier, W. J. J. Chem. Soc. Faraday. Trans. 1992, 88, 2753-2760
58. Mackie, A. D.; Tavitian, B.; Boutin, A.; Fuchs, A. H. Mol. Simul. 1997, 19, 1-15
59. Cracknell, R. F.; Nicholson, D.; Parsonage, N. G.; Evans, H. Mol. Phys. 1990, 71, 931-943
60. Ungerer, P.; Tavitian, B.; Boutin, A. Applications of molecular simulation in the oil and gas industry: Monte Carlo methods; IFP Publications, Ed. Technip: Paris, 2005.
61. Peterson, B. K.; Gubbins, K. E. Mol. Phys. 1987, 62, 215-226
62. Puibasset, J.; Pellenq, R. J. M. J. Chem. Phys. 2005, 122, 094704.1-094704.10
63. Mentzen, B. F.; Letoffe, J. M.; Claudy, P. Thermochim. Acta 1996, 288, 1-7
64. Boutin, A.; Coudert, F.-X.; Springuel-Huet, M.-A.; Neimark, A. V.; Férey, G.; Fuchs, A. H. J. Phys. Chem. C 2010, 114, 22237-22244