Theoretical investigations on heterogeneous Ziegler-Natta catalyst supports: Stability of the electron donors at different coordination sites of MgCl2

Journal of Physical Chemistry A

Volumn 101, Issue 34, 1997, Pages 6063-6068

  Puhakka, Eini ^a   Pakkanen, Tuula T ^a   Pakkanen, Tapani A ^a  

^a UNIVERSITY OF EASTERN FINLAND   (Finland)

Author keywords

[No Author keywords available]

Indexed keywords

ALCOHOLS; BINDING ENERGY; COMPLEXATION; COMPUTATIONAL METHODS; ESTERS; HYDROGEN BONDS; KETONES; MAGNESIUM COMPOUNDS; MATHEMATICAL MODELS; MOLECULAR STRUCTURE; SURFACE STRUCTURE;

MAGNESIUM CHLORIDE; ZIEGLER NATTA CATALYSTS;

CATALYST SUPPORTS;

EID: 0031210704     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp963437v     Document Type: Article

References (25)

1. Pino, P.; Mülhaupt, R. Angew. Chem., Int. Ed. Engl. 1980, 19, 857.
2. Goodall, B. L. J. Chem. Educ. 1986, 63, 191.
3. Dusseault, J. J. A.; Hsu, C. C. J. Macromol. Sci., Rev. Macromol. Chem. Phys. 1993, C33, 103.
4. Di Noto, V.; Mango, A.; Viviani, M.; Marega, C.; Bresadola, S.; Zannetti, R. Makromol. Chem. 1992, 193, 123.
5. Di Noto, V.; Zannetti, R.; Viviani, M.; Marega, C.; Marigo, A.; Bresadola, S. Makromol. Chem. 1992, 193, 1653.
6. Song, W.-D.; Chu, K.-J.; Chang, H.-S.; Ihm, S.-K. J. Mol. Catal. 1993, 84, 109.
7. Chung, J. S.; Choi, J. H.; Song, I. K.; Lee, W. Y. Macromolecules 1995, 28, 1717.
8. Shin, H. W.; Chung, J. S.; Song, I. K.; Lee, W. Y. Macromol. Chem. Phys. 1995, 196, 3765.
9. Ferreira, M. L.; Juan, A.; Castellani, N. J.; Damiani, D. E. J. Mol. Catal. 1994, 87, 137.
10. 2. Licentiate thesis, University of Joensuu, 1993.
11. Gaussian 92: Frisch, M. J.; Trucks, G. W.; Head-Gordon, M.; Gill, P. M. W.; Wong, M. W.; Foresman, J. B.; Johnson, B. G.; Schlegel, H. B.; Robb, M. A.; Replogle, E. S.; Gomperts, R.; Andres, J. L.; Raghavachari, K.; Binkley, J. S.; Gonzalez, C.; Martin, R. L.; Fox, D. J.; Defrees, D. J.; Baker, J.; Stewart, J. J. P.; Pople, J. A. Gaussian, Inc., Pittsburgh, PA, 1992.
12. Dorrepaal, J. J. Appl. Crystallogr. 1984, 17, 483.
13. Bush, T. S.; Catlow, C. R. A.; Battle, P. D. J. Mater. Chem. 1995, 5 1269.
14. Willock, D. J.; Price, S. L.; Leslie, M.; Catlow, C. R. A. J. Comput. Chem. 1995, 16, 628.
15. Talamo, A.; Catlow, C. R. A.; Day, P. Chem. Commun. 1996, 1701.
16. Hobza, P.; Zahradník, R. Chem. Rev. (Washington, D.C.) 1988, 88, 871.
17. Sauer, J. Chem. Rev. (Washington, D.C.) 1989, 89, 199.
18. Wong, M. W.; Frisch, M. J.; Wiberg, K. B. J. Am. Chem. Soc. 1991, 113, 4776.
19. Wong, M. W.; Wiberg, K. B.; Frisch, M. J. J. Am. Chem. Soc. 1992, 114, 523.
20. Wong, M. W.; Wiberg, K. B.; Frisch, M. J. J. Am. Chem. Soc. 1992, 114, 1645.
21. Lin, J. S.; Catlow, C. R. A. J. Mater. Chem. 1993, 3, 1217.
22. Colbourn, E. A.; Cox, P. A.; Carruthers, B.; Jones, P. J. V. J. Mater. Chem. 1994, 4, 805.
23. Puhakka, E.; Pakkanen, T. T.; Pakkanen, T. A. Surf. Sci. 1995, 334, 289.
24. Valle, G.; Baruzzi, G.; Paganetto, G.; Depaoli, G.; Zannetti, R.; Marigo, A. Inorg. Chim. Acta 1989, 156, 157.
25. Cotton, F. A.; Wilkinson, G. Advanced Inorganic Chemistry, 5th ed.; Wiley: New York, 1988.