NO 2 adsorption on ion exchanged ZSM-5: A density functional study

Applied Surface Science

Volumn 119, Issue 1-2, 1997, Pages 103-106

  Kanougi, Tomonori ^a   Furukawa, Ken Ichi ^a   Yamadaya, Michiyuki ^a   Oumi, Yasunori ^a   Kubo, Momoji ^a   Stirling, Andras ^a   Fahmi, Adil ^a   Miyamoto, Akira ^a  

^a TOHOKU UNIVERSITY   (Japan)

Author keywords

Adsorption; Density functional study; NO 2; ZSM 5

Indexed keywords

COBALT; COMPUTER SIMULATION; COPPER; GALLIUM; INDIUM; ION EXCHANGE; MOLECULAR DYNAMICS; NITROGEN OXIDES; SILVER; ZEOLITES;

NITROGEN DIOXIDE; ZEOLITE ZSM5;

GAS ADSORPTION;

EID: 0031237636     PISSN: 01694332     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0169-4332(97)00164-5     Document Type: Article

References (24)

1. S. Sato, Y. Yu-u, H. Yahiro, N. Mizuno, M. Iwamoto, Appl. Catal. 70 (1991) L1.
2. Y. Li, J.N. Armor, Appl. Catal. B 1 (1992) L31.
3. Y. Li, J.N. Armor, Appl. Catal. B 2 (1993) 239.
4. E. Kikuchi, K. Yogo, Catal. Today 22 (1994) 73.
5. M. Misono, K. Kondo, Chem. Lett. (1991) 1001.
6. M. Iwamoto, H. Yahiro, Catal. Today 22 (1994) 5.
7. J.O. Petunchi, W.K. Hall, Appl. Catal. B 2 (1993) L13.
8. Y. Li, T.L. Slager, J.N. Armor, J. Catal. 150 (1994) 388.
9. L. R.-Santiago, V. Branchadell, M. Sodupe, J. Chem. Phys. 103 (1995) 9738.
10. A. Miyamoto, M. Kubo, Sekiyu Gakkai 36 (1993) 282.
11. A. Miyamoto, H. Himei, Y. Oka, E. Maruya, M. Katagiri, R. Vetrivel, M. Kubo, Catal. Today 22 (1994) 87.
12. H. Himei, M. Yamadaya, M. Kubo, R. Vetrivel, E. Broclawik, A. Miyamoto, J. Phys. Chem. 99 (1995) 12461.
13. K. Kawamura, in: F. Yonezawa (Ed.), Molecular Dynamics Simulation (Springer, Berlin, 1992) p. 88.
14. L. Verlet, Phys. Rev. 159 (1967) 98.
15. P.P. Ewald, Ann. Phys. 64 (1921) 253.
16. W. Kohn, L.J. Sham, Phys Rev. A 140 (1965) 1133.
17. DMol version 2.3.5 San Diego: MSI, 1993.
18. B. Delley, J. Phys. Chem. 92 (1990) 508.
19. B. Delley, J. Phys. Chem. 94 (1991) 7245.
20. E.M. Flanigen, J.M. Bennett, R.W. Grose, J.P. Cohen, R.L. Patton, R.M. Kirchner, J.V. Smith, Nature 271 (1978) 521.
21. E.G. Derouane, J.G. Fripiat, Zeolites 5 (1985) 165.
22. Y. Li, T.L. Slager, J.N. Armor, J. Catal. 150 (1994) 388.
23. B.J. Adelman, T. Beutel, G.-D. Lei, W.M.H. Sachatler, J. Catal. 158 (1996) 327.
24. G.D. Meitzner, E. Iglesia, J.E. Baumgartner, E.S. Huang, J. Catal. 140 (1993) 209.