Solvation ultrafast dynamics of reactions. 14. Molecular dynamics and ab Initio studies of charge-transfer reactions of iodine in benzene clusters

Journal of Physical Chemistry A

Volumn 102, Issue 23, 1998, Pages 4082-4099

  Su, Julius T ^a   Zewail, Ahmed H ^a  

^a CALIFORNIA INSTITUTE OF TECHNOLOGY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0001455393     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp980572u     Document Type: Article

References (41)

1. Mulliken, R. S. J. Am. Chem. Soc. 1950, 72, 610.
2. Lenderink, E.; Duppen, K.; Everdij, F. P. X.; Marvi, J.; Torre, R.; Wiersma, D. A. J. Phys. Chem. 1996, 100, 7822.
3. Zewail, A. H. In Femtochemistry and Femtobiology; Sundstrom, V., Ed. World Scientific: Singapore, 1998.
4. Cheng, P. Y.; Zhong, D.; Zewail, A. H. J. Chem. Phys. 1996, 105, 6216.
5. Cheng, P. Y.; Zhong, D.; Zewail, A. H. J. Phys. Chem. 1995, 99, 15733.
6. Collin, J.; D'Or, L. J. Chem. Phys. 1955, 23, 397.
7. Yarwood, J.; Person, W. B. J. Am. Chem. Soc. 1968, 90, 594.
8. Mulliken, R. S. J. Chem. Phys. 1955, 23, 397.
9. Ferguson, E. E. J. Chem. Phys. 1956, 25, 577.
10. Fredin, L.; Nelander, B. J. Am. Chem. Soc. 1974, 96, 1672.
11. Hassel, O.; Stromme, K. O. Acta Chem. Scand. 1959, 13, 1781.
12. Hassel, O.; Stromme, K. O. Acta Chem. Scand. 1958, 12, 1146.
13. Mulliken, R. S.; Person, W. B. Molecular Complexes: a Lecture and Reprint Volume; Wiley-Interscience: New York, 1969.
14. Lippert, J. L.; Hanna, M. W.; Trotter, P. J. J. Am. Chem. Soc. 1969, 91, 4035.
15. Cook, E. G.; Schug, J. C. J. Chem. Phys 1970, 53, 723.
16. Schug, J. C.; Dyson, M. C. J. Chem. Phys 1973, 58, 297.
17. Mulliken, R. S. J. Chem. Phys 1965, 43, S2.
18. Stone, A. J. Chem. Phys. Lett. 1993, 211, 101.
19. Schug, J. C.; Levinson, K. A. Theor. Chim. Acta 1975, 37, 269.
20. Bruns, R. E. J. Molecular Structure 1977, 36, 121.
21. Jano, I. Theor. Chim. Acta 1985, 66, 341.
22. Lucchese, R. R.; Schaefer, H. F. J. Am. Chem. Soc. 1975, 97, 7205.
23. Kochanski, E.; Prissette, J. Nouv. J. Chimie 1980, 4, 509.
24. Everdij, F. P. X.; van der Spoel, D.; Mavri, J.; Wiersma, D. A. In Femtochemistry and Femtobiology; Sundstrom, V. Ed.; World Scientific: Singapore; 1998. Also personal communication.
25. Danovich, D.; Hrusak, J.; Shaik, S. Chem. Phys. Lett. 1995, 233, 249.
26. Lin, Z.; Hall, M. B. Polyhedron 1993, 12, 1499.
27. Hu, W.; Truhlar, D. G. J. Phys. Chem. 1994, 98, 1049.
28. Oberle, C.; Eysel, H. H. J. Mol. Struct. (THEOCHEM) 1993, 280, 107.
29. Setokuchi, O.; Shimizu, Y. J. Mol. Struct. (THEOCHEM) 1993, 281, 67.
30. 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.; Gonzales, C.; Martin, R. L.; Fox, D. J.; Defrees, D. J.; Baker, J.; Stewart, J. J. P.; Pople, J. A. Gaussian 92 Gaussian, Inc.: Pittsburgh, PA.
31. Potter, D. Comput. Phys. Wiley: New York; 1972.
32. Chalasinski, G.; Szczesniak, M. M. Chem. Rev. 1994, 94, 1723.
33. Hobza, P.; Selzle, H. L.; Schlag, E. W. Chem. Rev. 1994, 94, 1767.
34. Danten, Y.; Guillot, B.; Guissani, Y. J. Chem. Phys. 1991, 96, 3782.
35. Straub, P. A.; McLean, A. D. Theor. Chim. Acta 1974, 32, 227.
36. Rodger, P. M.; Stone, A. J.; Tildesley, D. J. Chem. Phys. Lett. 1988, 145, 365.
37. Atack, D.; Rice, O. K. J. Phys. Chem. 1954, 58, 1017.
38. Lang, F. T.; Strong, R. L. J. Am. Chem. Soc. 1965, 87, 2345.
39. Duerksen, W. K.; Tamres, M. J. Am. Chem. Soc. 1968, 90, 1379.
40. Martens, C. G. In Femtochemistry; Chergui, M. Ed.; World Scientific: Singapore; 1996.
41. Schröder, T.; Schinke, R.; Liu, S., Bačić, Z.; Moskowitz, J. W. J. Chem. Phys. 1995, 103, 9228.