The interaction of benzene with Cu+ sites in zeolites. IR studies and DFT quantum chemical calculations

Applied Catalysis A: General

Volumn 307, Issue 1, 2006, Pages 46-50

  Kukulska Zajac, Ewa ^a   Kozyra, Paweł ^a   Datka, Jerzy ^a  

^a JAGIELLONIAN UNIVERSITY   (Poland)

Author keywords

Benzene; Cu+ cations; DFT calculations; IR spectroscopy; Zeolites

Indexed keywords

ACETYLENE; ACTIVATION ANALYSIS; BENZENE; COPPER; INFRARED SPECTROSCOPY; OLEFINS; QUANTUM THEORY;

ADDUCT; BOND ACTIVATION; DFT CALCULATIONS; ORGANIC MOLECULES;

ZEOLITES;

EID: 33646506605     PISSN: 0926860X     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.apcata.2006.03.005     Document Type: Article

References (24)

1. Iwamoto M., Furukawa H., Mine Y., Uemura F., Mikuriya S., and Kagawa S. J. Chem. Soc., Chem. Commun. (1986) 1272
2. Iwamoto M., Yakoo S., Sakai K., and Kagawa S. J. Chem. Soc., Faraday Trans. 77 (1981) 1629
3. Iwamoto M., Yachiro H., Mine Y., and Kagawa S. Chem. Lett. (1989) 213
4. Iwamoto M., Yachiro H., Kutsuno T., Bunyu S., and Kagawa S. Bull. Chem. Soc. Jpn. 62 (1989) 583
5. Brocławik E., Datka J., Gil B., Piskorz W., and Kozyra P. Top. Catal. 11/12 (2000) 335
6. E. Brocławik, J. Datka, B. Gil, P. Kozyra, in: A. Galarneau, F. Di Renzo, F. Fajula, J. Vedrine (Eds.), Zeolites and Mesoporous Materials at the Dawn of the 21st Century, Elsevier Science B.V., Stud. Surf. Sci. Catal. 135 (2001) 15P13.
7. E. Brocławik, J. Datka, B. Gil, P. Kozyra, in: R. Aiello, G. Giordano, F. Testa (Eds.), Impact of Zeolites and Other Porous Materials on the New Technologies at the Beginning of the New Millennium, Elsevier Science B.V., Stud. Surf. Sci. Catal. 142 (2002) 1971.
8. Datka J., Kukulska-Zajac E., and Kozyra P. Catal. Today 90 (2004) 109
9. Goursot A., Coq B., and Fajula F. J. Catal. 216 (2003) 324
10. Datka J., and Kukulska-Zajac E. J. Phys. Chem. B 108 (2004) 11760
11. Datka J., Kozyra P., Kukulska-Zajac E., and Kobyzewa W. Catal. Today 101 (2005) 117
12. Datka J., and Kukulska-Zajac E. Catal. Today 101 (2005) 123
13. Brocławik E., Kozyra P., and Datka J. Comptes Rendus Chimie 8 (2005) 491
14. Dmol, Insight II Release 96.0, User Guide (1996), Molecular Simulations, San Diego
15. J. Sarkany, W.M.H. Sachtler, in: H.K. Beyer, H.G. Karge, J.B. Nagy (Eds.), Catalysis by Microporous Materials, Elsevier Science B.V., Stud. Surf. Sci. Catal. 94 (1995) 649.
16. Lei G.D., Adelman B.J., Sarkany J., and Sachtler W.M.H. Appl. Catal. B 5 (1995) 245
17. Sarkany J. J. Mol. Struct. 410/411 (1997) 95
18. Sarkany J. J. Mol. Struct. 410/411 (1997) 137
19. Sarkany J. J. Mol. Struct. 410/411 (1997) 145
20. Sobalik Z., Tvaruzkova Z., and Wichterlova B. J. Phys. Chem. B 102 (1998) 1077
21. Sobalik Z., Tvaruzkova Z., and Wichterlova B. In: Treacy M.M.J., Marcus B.K., Bisher M.E., and Higgins J.B. (Eds). Proceedings of 12th IZC Conference (1998), Materials Research Society, Baltimore 2339
22. Sobalik Z., Dedecek J.Z., and Wichterlova B. Micropor. Mesopor. Mater. 21 (1998) 525
23. Brocławik E., Datka J., Gil B., and Kozyra P. Phys. Chem. Chem. Phys. 2 (2000) 401
24. Molina J.M., Dobado J.A., and Melchor S. J. Mol. Struct. 589/590 (2002) 337