Rotation-vibration energy level clustering in the over(X, ∼)2 B1 ground electronic state of PH2

Journal of Molecular Spectroscopy

Volumn 239, Issue 2, 2006, Pages 160-173

  Yurchenko, S N ^a   Thiel, W ^a   Jensen, Per ^b   Bunker, P R ^c  

^a MAX PLANCK INSTITUT FÜR KOHLENFORSCHUNG   (Germany)

^b UNIVERSITY OF WUPPERTAL   (Germany)

^c NATIONAL RESEARCH COUNCIL CANADA   (Canada)

Author keywords

Ab initio; Dipole moment; Intensity; Local mode; Phosphino; Renner

Indexed keywords

CENTRIFUGATION; ELECTRON ENERGY LEVELS; FREE RADICALS; GROUND STATE; VIBRATION CONTROL;

AB INITIO; DIPOLE MOMENT; INTENSITY; LOCAL MODE; PHOSPHINO; RENNER;

PHOSPHORUS COMPOUNDS;

EID: 33750609869     PISSN: 00222852     EISSN: 1096083X     Source Type: Journal    
DOI: 10.1016/j.jms.2006.07.002     Document Type: Article

References (31)

1. Jakubek Z.J., Bunker P.R., Zachwieja M., Nakhate S.G., Simard B., Yurchenko S.N., Thiel W., and Jensen P. J. Chem. Phys. 124 (2006) 094306/1-5
2. Jensen P., Odaka T.E., Kraemer W.P., Hirano T., and Bunker P.R. Spectrochim. Acta 58 (2002) 763-794
3. P. Jensen, P.R. Bunker, (Eds.), Computational Molecular Spectroscopy, Wiley, Chichester, England, 2000. See .
4. Jensen P., Brumm M., Kraemer W.P., and Bunker P.R. J. Mol. Spectrosc. 171 (1995) 31-57
5. Kolbuszewski M., Bunker P.R., Jensen P., and Kraemer W.P. Mol. Phys. 88 (1996) 105-124
6. Osmann G., Bunker P.R., Jensen P., and Kraemer W.P. Chem. Phys. 225 (1997) 33-54
7. Kozin I.N., Belov S.P., Polyanski O.L., and Tretyakov M.Yu. J. Mol. Spectrosc. 152 (1992) 13-28
8. Jensen P., and Kozin I.N. J. Mol. Spectrosc. 160 (1993) 39-57
9. Kozin I.N., and Jensen P. J. Mol. Spectrosc. 161 (1993) 186-207
10. Jensen P., Osmann G., and Kozin I.N. In: Papoušek D. (Ed). Vibration-Rotational Spectroscopy and Molecular Dynamics (1997), World Scientific, Singapore
11. Jensen P. Mol. Phys. 98 (2000) 1253-1285
12. Hills G.W., and McKellar A.R.W. J. Chem. Phys. 71 (1979) 1141-1149
13. Bunker P.R., and Jensen P. Molecular Symmetry and Spectroscopy. second ed. (1998), NRC Research Press, Ottawa, Canada. http://www.nrc.ca/cgi-bin/cisti/journals/rp/rp2_book_e?mlist1_90 See
14. Alijah A., and Duxbury G. J. Opt. Soc. Am. B 11 (1994) 208-218
15. MOLPRO is a package of ab initio programs written by H.-J. Werner and P.J. Knowles, with contributions from R.D. Amos, A. Bernhardsson, A. Berning, P. Celani, D.L. Cooper, M.J.O. Deegan, A.J. Dobbyn, F. Eckert, C. Hampel, G. Hetzer, T. Korona, R. Lindh, A.W. Lloyd, S.J. McNicholas, F.R. Manby, W. Meyer, M.E. Mura, A. Nicklass, P. Palmieri, R.M. Pitzer, G. Rauhut, M. Schütz, H. Stoll, A.J. Stone, R. Tarroni, T. Thorsteinsson.
16. Werner H.-J., and Knowles P.J. J. Chem. Phys. 89 (1988) 5803-5814
17. Knowles P.J., and Werner H.-J. Chem. Phys. Lett. 145 (1988) 514-522
18. Kendall R.A., Dunning T.H., and Harrison R.J. J. Chem. Phys. 96 (1992) 6796-6806
19. Woodcock H.L., Wesolowski S.S., Yamaguchi Y., and Schaefer III H.F. J. Phys. Chem. A 105 (2001) 5037-5045
20. Jensen P. J. Mol. Spectrosc. 132 (1988) 429-457
21. Perić M., Buenker R.J., and Peyerimhoff S.D. Can. J. Chem. 57 (1979) 2491-2497
22. Xuan C.N., and Margani A. J. Chem. Phys. 93 (1990) 136-146
23. Xuan C.N., and Margani A. J. Chem. Phys. 100 (1994) 7000-7011
24. Dixon R.N. Mol. Phys. 10 (1965) 1-6
25. Dixon R.N., Duxbury G., and Ramsay D.A. Proc. R. Soc. A 296 (1967) 137-160
26. Bertou J.-M., Pascat B., Guenebaut H., and Ramsay D.A. Can. J. Phys. 50 (1972) 2265-2276
27. Child M.S., and Lawton R.T. Faraday Discuss. Chem. Soc. 71 (1981) 273-285
28. Mortensen O.S., Henry B.R., and Mohammadi M.A. J. Chem. Phys. 75 (1981) 4800-4808
29. Bunker P.R., and Jensen P. Fundamentals of Molecular Symmetry (2004), IOP Publishing, Bristol
30. Baugh D., Koplitz B., Xu Z., and Wittig C. J. Chem. Phys. 88 (1988) 879-887
31. Pascat B., Bertou J.-M., Prudhomme J.-C., Guenebaut H., and Ramsay D.A. J. Chim. Phys. 65 (1968) 2022-2029