Adsorption of NO and N2O on Cu-BEA zeolite

Journal of Molecular Structure: THEOCHEM

Volumn 957, Issue 1-3, 2010, Pages 41-46

  Wang, Yuli ^a   Lei, Zhigang ^a   Zhang, Runduo ^a   Chen, Biaohua ^a  

^a BEIJING UNIVERSITY OF CHEMICAL TECHNOLOGY   (China)

Author keywords

Adsorption energy; Cu BEA zeolite; DFT; Geometry; NOx

Indexed keywords

EID: 77956184264     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2010.07.004     Document Type: Article

References (41)

1. Wuebbles D.J., Jain A., Edmonds J., Harvey D., Hayhoe K. Environ. Pollut. 1999, 100:57.
2. Rhoderick G.C., Dorko W.D. Environ. Sci. Technol. 2004, 38:2685.
3. Aplincourt P., Bohr F., Ruiz-Lopez M.F. J. Mol. Struct. 1998, 426:95.
4. Costabile F., Allegrini I. Environment 2007, 41:6637.
5. Gómez-García1 M.A., Pitchon V., Kiennemann A. Environ. Int. 2005, 31:445.
6. Traa Y., Burger B., Weitkamp J. Chem. Commun. 1999, 999:2187.
7. Heck R.M. Catal. Today 1999, 53:519.
8. Sterner T., Turnheim B. Ecol. Econ. 2009, 68:2996.
9. Parvulescu V.I., Grande P., Delmon B. Catal. Today 1998, 46:233.
10. Fischer G., Goursot A., Coq B., Delahay G., Pal S. ChemPhysChem 2006, 7:1795.
11. Li Y.J., Armor J.N. Appl. Catal. B: Environ. 1992, 1:L21.
12. Chen L., Chen H.Y., Lin J., Tan K.L. Surf. Interf. Analyt. 1999, 28:115.
13. van den Brink R.W., Booneveld S., Pels J.R., Bakker D.F., Verhook M.J.F.M. Appl. Catal. B: Environ. 2001, 32:73.
14. Labhsetwar N., Dhakad M., Biniwale R., Mitsuhashi T., Haneda H., Reddy P.S.S., Bakardjieva S., Subrt J., Kumar S., Kumar V., Saiprasad P., Rayalu S. Catal. Today 2009, 141:205.
15. Kustova M.Y., Kustov A., Christiansen S.E., Leth K.T., Rasmussen S.B. Catal. Commun. 2006, 7:705.
16. Konduru M.V., Chuang S.S.C. J. Catal. 2000, 196:271.
17. Datka J., Kozyra P., Kukulska-Zaja{ogonek}c E. Catal. Today 2004, 90:109.
18. Walker A.P. Catal. Today 1995, 26:107.
19. Dčdeček J., Bortnovsky O., Vondrová A., Wichterlová B. J. Catal. 2001, 200:160.
20. Corma A., Palomares A., Márquez F. J. Catal. 1997, 170:132.
21. Ishihara T., Ando M., Sada K., Takiishi K., Yamada K., Nishiguchi H., Takita Y. J. Catal. 2003, 220:104.
22. Xie S., Rosynek M.P., Lunsford J.H. J. Catal. 1999, 188:24.
23. Zhu J., Xiao D., Li J., Xie X., Yang X., Wu Y. J. Mol. Catal. A - Chem. 2005, 233:29.
24. Pirngruber G.D., Luechinger M., Roy P.K., Cecchetto A., Smirniotis P. J. Catal. 2004, 224:429.
25. Yuranov I., Bulushev D.A., Renken A., Kiwi-Minsker L. J. Catal. 2004, 227:138.
26. Kondratenko E.V., Perez-Ramirez J. J. Phys. Chem. B 2006, 110:22586.
27. Fellah M.F., Onal I. Catal. Today 2008, 137:410.
28. Pietrzyk P., Zasada F., Piskorz W., Kotarba A., Sojka Z. Catal. Today 2007, 119:219.
29. Chen N.Y., Garwood W.E., Dwyer F.G. Shape Selective Catalysis in Industrial Applications 1996, Dekker, New York. second ed.
30. Deem M.W., Newsam J.M., Creighton J.A. J. Am. Chem. Soc. 1992, 114:7198.
31. Fujita H., Kanougi T., Atoguchi T. Appl. Catal. A: Gen. 2006, 313:160.
32. Rice M.J., Chakraborty A.K., Bell A.T. J. Phys. Chem. A 1998, 102:7498.
33. Yang G., Zhou L., Liu X., Han X., Bao X. J. Phys. Chem. B 2006, 110:22295.
34. Frisch M.J., Trucks G.W., Schlegel H.B., Gill P.M.W., Johnson B.G., Robb M.A., Cheeseman J.R., Keith T., Petersson G.A., Montegomery J.A., Raghavachari K., Al-Laham M.A., Zakrzewski V.G., Ortiz J.V., Foresman J.B., Cioslowski J., Stefanov B.B., Nanayakkara A., Challacombe M., Peng C.Y., Ayala P.Y., Chen W., Wong M.W., Andres J.L., Replogle E.S., Gomperts R., Martin R.L., Fox D.J., Binkley J.S., Defrees D.J., Baker J., Stewart J.P., Head-Gordon M., Gonzalez C., Pople J.A. Gaussian 03, Revision B.04 2003, Gaussian Inc., Pittsburgh, PA.
35. Lee W.Y., Parr R.G. Phys. Rev. B 1988, 37:785.
36. Becke A.D. Phys. Rev. A 1988, 38:3098.
37. Bulushev D.A., Renken A., Kiwi-Minsker L. J. Phys. Chem. B 2006, 110:305.
38. Rivallan M., Ricchiardi G., Bordiga S., Zecchina A. J. Catal. 2009, 264:104.
39. Smeets P.J., Groothaert M.H., Teeffelen R.M., Leeman H., Hensen E.J.M., Schoonheydt R.A. J. Catal. 2007, 245:358.
40. Pérez-Ramírez J., Kapteijn F., Mul G., Moulijn J.A. J. Catal. 2002, 208:211.
41. Wa{ogonek}cław A., Nowínska K., Schwieger W., Zielińska A. Catal. Today 2004, 90:21.