Computer simulation of the adsorption of thiophene/benzene mixtures on MFI and MOR

Separation and Purification Technology

Volumn 55, Issue 1, 2007, Pages 82-90

  Zeng, Yongping ^a   Ju, Shengui ^a   Xing, Weihong ^a   Chen, Changlin ^a  

^a NANJING TECH UNIVERSITY   (China)

Author keywords

Adsorption; Benzene; Computer simulation; MFI; MOR; Thiophene

Indexed keywords

ADSORPTION; BENZENE; COMPUTER SIMULATION; MONTE CARLO METHODS; OLEFINS; SEGREGATION (METALLOGRAPHY);

BINARY SYSTEMS; THIOPHENE MOLECULES;

MIXTURES;

EID: 33947625531     PISSN: 13835866     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.seppur.2006.11.007     Document Type: Article

References (51)

1. Davis M. Ind. Eng. Chem. Res. 30 (1991) 1675-1683
2. Garcia C.L. J. Phys. Chem. 95 (1991) 10729-10736
3. Woods G.B., and Rowlinson J.S. J. Chem. Soc. Faraday Trans. 2 85 (1989) 765-781
4. Gupta A., Chempath S., Sanborn M.J., Clark L.A., and Snurr R.Q. Mol. Sim. 29 (2003) 29-46
5. Soto J.L., and Myers A.L. Mol. Phys. 42 (1981) 971-983
6. Goodbody S.J., Watanabe K., Macgowan D., Walton J.P.R.B., and Quirke N. J. Chem. Soc., Faraday Trans. 87 (1991) 1951-1958
7. Lachet V., Boutin A., Tavitian B., and Fuchs A.H. J. Phys. Chem. B 102 (1998) 9224-9233
8. Du Z., Manos G., Thijs J.H.V., and Smit B. AIChE J. 44 (1998) 1756-1764
9. Fuchs A.H., and Cheetham A.K. J. Phys. Chem. B 105 (2001) 7375-7383
10. Tassel P.R.V., Davis H.T., and McCormick A.V. J. Chem. Phys. 98 (1993) 8919-8928
11. Rackaert J.P., and Bellemans A. Faraday Discuss. Chem. Soc. 66 (1978) 95-106
12. Jorgensen W.L., Madura J.D., and Swenson C.J. J. Am. Chem. Soc. 106 (1984) 6638-6646
13. Gelin B.R., and Karplus M. Protein, and Solvent Environment. Biochemistry 18 (1979) 1256-1258
14. Jorgensen W.L. J. Phys. Chem. 90 (1986) 6379-6388
15. Tildesley D.J., and Madden P.A. Mol. Phys. 42 (1981) 1137-1156
16. Pascual P., Ungerer P., Tavitian B., and Boutin A. J. Phys. Chem. B 108 (2004) 393-398
17. Chandrasekhar J., and Jorgensen W.L. J. Chem. Phys. 77 (1982) 5073-5079
18. Allen M.P., and Tildesley D.J. Computer Simulation of Liquids (1987), Claredon, Oxford
19. June R.L., Bell A.T., and Theodorou D.N. J. Phys. Chem. 94 (1990) 8232-8240
20. Snurr R.Q., Bell A.T., and Theodorou D.N. J. Phys. Chem. 97 (1993) 13742-13752
21. Wallis E.P. Fluid Phase Equilib. 103 (1995) 97-111
22. Ju S., Zeng Y., and Yao H. J. Chem. Phys. 121 (2004) 9098-9102
23. Shi X., and Bartell L.S. J. Phys. Chem. 92 (1988) 5667-5673
24. Bezus A.G., Kiselev A.V., Lopatkin A.A., and Du P.Q. J. Chem. Soc., Faraday Trans. II 74 (1978) 367-379
25. Van Koningsveld H., Tuinstra F., van Bekkum H., and Jansen J.C. Acta Crystallogr. B45 (1989) 423-431
26. Maddox M., and Rowlinson J.S. J. Chem. Soc. Faraday Trans. 89 (1993) 3619-3621
27. Vlugt T.J.H., Zhu W., Kapteijn F., Moulijn J.A., Smit B., and Krishna R. J. Am. Chem. Soc. 120 (1998) 5599-5600
28. Schenk M., Vidal S.L., Vlugt T.J.H., Smit B., and Krishna R. Langmuir 17 (2001) 1558-1570
29. Pasterny K., Wrzalik R., Kupka T., and Pastern G. J. Mol. Struct. 614 (2002) 297-304
30. Lonsinger S.R., Chakraborty A.K., Theodorou D.N., and Bell A.T. Catal. Lett. 11 (1991) 209-217
31. June R.L., Bell A.T., and Theodorou D.N. J. Phys. Chem. 94 (1990) 8232-8234
32. Heuchel M., Snurr R.Q., and Buss E. Langmuir 13 (1997) 6795-6804
33. Woods G.B., Panagiotopoulos A.Z., and Rowlinson J.S. Mol. Phys. 63 (1988) 49-63
34. Frenkel D., and Smit B. Understanding Molecular Simulation-From Algorithms to Applications (1996), Academic Press, New York
35. Karavias F., and Myers A.L. Langmuir 7 (1991) 3118-3126
36. Tassel P.R., Davis H.T., and McComick A.V. J. Chem. Phys. 98 (1993) 8919-8929
37. Snurr R.Q., Bell A.T., and Theodorou D.N. J. Phys. Chem. 97 (1993) 13742-13752
38. Weitkamp J., Schwark M., and Ernst S. J. Chem. Soc. Chem. Commun. (1991) 1133-1135
39. D.L. King, C. Faz, T. Flynn, Desulfurization of gasoline feedstocks for application in fuel reforming, SAE Paper 2000-01-0002, Society of Automotive Engineers, Detroit, Michigan, 2000, p. 9.
40. Takahashi A., Yang F.H., and Yang R.T. Eng. Chem. Res. 41 (2002) 2487-2496
41. Chica A., Strohmaier K., and Iglesia E. Langmuir 20 (2004) 10982-10991
42. Garcia C.L., and Lercher J.A. J. Phys. Chem. (1992) 2669-2675
43. Song L., Sun Z., Ban H., Dai M., and Rees L.V.C. Phys. Chem. Chem. Phys. 6 (2004) 4722-4731
44. Simon L.J., Rep M., van Ommen J.G., and Lercher J.A. Appl. Catal. A: Gen. 218 (2001) 161-170
45. Yu S.Y., Garcia-Martines J., Li W., Meitzner G.D., and Iglesia E. Phys. Chem. Chem. Phys. 4 (2004) 1241-1251
46. Vuong T., and Monson P.A. Langmuir 12 (1996) 5425-5432
47. Florian E., and Lercher J.A. Zeolites 18 (1997) 75-81
48. Smit B., and Siepmann J.I. Science 264 (1994) 1118-1120
49. Meier W.M., Olson D.H., and Baerlocher C. Atlas of Zeolite Structure types (1996), Elsevier, Amsterdam
50. Clark L.A., Gupta A., and Snurr R.Q. J. Phys. Chem. B 102 (1998) 6720-6731
51. Gupta A., Clark L.A., and Snurr R.Q. Langmuir 16 (2000) 3910-3919