The intermolecular potential between an inert gas and a halogen: Prediction and observation of transitions between the linear and T-shaped isomers of HeClF

Journal of Chemical Physics

Volumn 109, Issue 8, 1998, Pages 3048-3061

  Higgins, Kelly ^a   Tao, Fu Ming ^a   Klemperer, William ^a  

^a HARVARD UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0000786782     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.476896     Document Type: Article

References (43)

1. C. R. Bieler and K. C. Janda, in Atomic and Molecular Clusters, edited by E. R. Bernstein (Elsevier, Amsterdam, 1990), pp. 455-506.
2. S. M. Cybulski, R. Burcl, G. Chałasiński, and M. M. Szczȩśniak, J. Chem. Phys. 103, 10,116 (1995).
3. A. Rohrbacher, J. Williams, K. C. Janda, S. M. Cybulski, R. Burcl, M. M. Szczȩśniak, G. Chałasiński, and N. Halberstadt, J. Chem. Phys. 106, 2685 (1997).
4. Y. J. Xu, W. Jäger, I. Ozier, and M. C. L. Gerry, J. Chem. Phys. 98, 3726 (1993).
5. F. M. Tao and W. Klemperer, J. Chem. Phys. 97, 440 (1992).
6. J. Williams, A. Rohrbacher, D. Djahandideh, K. C. Janda, A. Jamka, F. M. Tao, and N. Halberstadt, Mol. Phys. 91, 573 (1997).
7. S. J. Harris, S. E. Novick, W. Klemperer, and W. E. Falconer, J. Chem. Phys. 61, 193 (1974).
8. S. S. Huang, C. R. Bieler, K. C. Janda, F. M. Tao, W. Klemperer, P. Casavecchia, G. G. Volpi, and N. Halberstadt, J. Chem. Phys. 102, 8846 (1995).
9. J. W. Simmons, W. E. Anderson, and W. Gordy, Phys. Rev. 86, 1055 (1952).
10. S. Huzinaga and M. Klobukowski, J. Mol. Struct.: THEOCHEM 167, 1 (1988).
11. T. W. Dingle, S. Huzinaga, and M. Klobukowski, J. Comput. Chem. 10, 753 (1989).
12. S. Huzinaga, J. Chem. Phys. 42, 1293 (1965).
13. R. R. Teachout and R. T. Pack, At. Data 3, 195 (1971).
14. B. Fabricant and J. S. Muenter, J. Chem. Phys. 66, 5274 (1977).
15. Table of Isotopes, 7th ed., edited by C. M. Lederer and V. S. Shirley (Wiley, New York, 1978).
16. S. F. Boys and F. Bernardi, Mol. Phys. 19, 553 (1970).
17. GAUSSIAN 92, Revision C, M. J. Frisch, G. W. Trucks, M. Head-Gordon, P. M. W. Gill, M. W. Wong, J. B. Foresman, B. G. Johnson, H. B. Schlegel, M. A. Robb, E. S. Replogle, R. Gomperts, J. L. Andres, K. Raghavachari, J. S. Binkley, C. Gonzalez, R. L. Martin, D. J. Fox, D. J. Defrees, J. Baker, J. J. P. Stewart, and J. A. Pople, Gaussian, Inc., Pittsburgh PA (1992).
18. R. C. Cohen and R. J. Saykally, J. Chem. Phys. 94, 7991 (1990);
19. 98, 6001 (1993).
20. J. M. Hutson, BOUND computer code, version 5 (1993), distributed by Collaborative Computational Project No. 6 of the Science and Engineering Research Council (UK).
21. D. E. Manolopoulos, Ph.D. thesis, Cambridge University, 1988.
22. J. M. Hutson, Chem. Phys. Lett. 151, 565 (1988).
23. S. Drucker, A. L. Cooksy, and W. Klemperer, J. Chem. Phys. 98, 5158 (1993).
24. T. E. Gough, R. E. Miller, and G. Scoles, Appl. Phys. Lett. 30, 338 (1977).
25. S. Drucker, F. M. Tao, and W. Klemperer, J. Phys. Chem. 99, 2646 (1995).
26. Stainless steel rods of 9.525 diameter and 1000 mm length are placed in a square with sides of 12.62 mm from rod center to rod center.
27. G. T. Fraser (personal communication).
28. The spacing of the Stark plates is 0.9842(16) cm as determined using the J=1←0 transition of ClF.
29. K. Higgins, W. Klemperer, F. M. Tao, E. Arunan, T. Emilsson, and H. S. Gutowsky (in preparation).
30. C. M. Lovejoy and D. J. Nesbitt, J. Chem. Phys. 93, 5387 (1990).
31. M. D. Marshall, A. Charo, H. O. Leung, and W. Klemperer, J. Chem. Phys. 83, 4924 (1985).
32. A. L. Cooksy, S. Drucker, J. Faeder, C. A. Gottlieb, and W. Klemperer, J. Chem. Phys. 95, 3017 (1991).
33. M. J. Weida, J. M. Sperhac, and D. J. Nesbitt, J. Chem. Phys. 101, 8351 (1994).
34. E. J. Bohac, M. D. Marshall, and R. E. Miller, J. Chem. Phys. 97, 4890 (1992).
35. S. E. Novick, P. Davies, S. J. Harris, and W. Klemperer, J. Chem. Phys. 59, 2273 (1973).
36. J. M. Hutson, Mol. Phys. 84, 185 (1995).
37. W. Jäger and M. C. L. Gerry, Chem. Phys. Lett. 196, 274 (1992).
38. W. Gordy and R. L. Cook, Microwave Molecular Spectra, 3rd ed. (Wiley, New York, 1984), Sec. 9.4.
39. a, θ, and R remain unchanged for a cycle.
40. M. L. Burke and W. Klemperer, J. Chem. Phys. 98, 1797 (1993).
41. M. C. R. Cockett, D. A. Beattie, R. J. Donovan, and K. P. Lawley, Chem. Phys. Lett. 259, 554 (1996).
42. T. van Mourik and T. H. Dunning, Jr., J. Chem. Phys. 107, 2451 (1997).
43. F.-M. Tao and W. Klemperer, J. Chem. Phys. 101, 1129 (1994).