SIFDT study of the SO2+/H2 H-atom abstraction reaction

International Journal of Mass Spectrometry and Ion Processes

Volumn 172, Issue 1-2, 1998, Pages 79-87

  Fairley, David A ^a   Scott, Graham B I ^a   Milligan, Daniel B ^a   Maclagan, Robert G A R ^a   McEwan, Murray J ^a  

^a UNIVERSITY OF CANTERBURY   (New Zealand)

Author keywords

Ab initio; H atom abstraction; Ion molecule; Potential barrier; SIFDT

Indexed keywords

EID: 0008136697     PISSN: 01681176     EISSN: None     Source Type: Journal    
DOI: 10.1016/s0168-1176(97)00242-5     Document Type: Article

References (31)

1. E. Herbst, C.M. Leung, Astrophys. J. Suppl. Ser. 69 (1989) 271.
2. K. Giles, N.G. Adams, D. Smith, Int. J. Mass Spectrom. Ion Proc. 89 (1989) 303.
3. S.D. Prodnuk, C.H. DePuy, V.M. Bierbaum, Int. J. Mass Spectrom. Ion Proc. 100 (1990) 693.
4. N.G. Adams, D. Smith, J.F. Paulson, J. Chem. Phys. 72 (1980) 288.
5. E. Herbst, D.J. DeFrees, D. Talbi, F. Pauzat, W. Koch, A.D. McLean, J. Chem. Phys. 94 (1991) 7842.
6. D. Smith, N.G. Adams, Int. J. Mass Spectrom. Ion Proc. 76 (1987) 307.
7. M.W. Wong, L. Radom, J. Amer. Chem. Soc. 115 (1993) 1507.
8. S.G. Lias, J.E. Bartmess, J.F. Liebman, J.L. Holmes, R.D. Levin, W.G. Mallard, J. Phys. Chem. Ref. Data, 17 (1988) Suppl. No. 1.
9. G.B.I. Scott, D.A. Fairley, C.G. Freeman, M.J. McEwan, P. Spanel, D. Smith, J. Chem. Phys. 106 (1997) 3982.
10. V.G. Anicich, J. Phys. Chem. Ref. Data 22 (1993) 1469.
11. M.J. McEwan, in: N.G. Adams, L.M. Babcock (Eds.), Advances in Gas Phase Ion Chemistry, Vol. 1, J.A.I. Press, CT, 1992, p. 1.
12. D. Smith, N.G. Adams, in: D. Bates, B. Bederson (Eds.), Advances in Atomic and Molecular Physics, Vol. 24, Academic Press, 1988, p. 1.
13. W. Lindinger, D. Smith, in: A. Fontijn, M.A.A. Clyne (Eds.), Reactions of Small Transient Species, Academic Press, London, 1983, p. 387.
14. H. Böhringer, M. Durup-Ferguson, D.W. Fahey, J. Chem. Phys. 79 (1983) 1974.
15. D.L. Albritton in P. Ausloos (Ed.), Kinetics of Ion Molecule Reactions, Plenum, 1979, p. 119.
16. W. Lindinger, Int. J. Mass Spectrom. Ion Proc. 80 (1987) 115.
17. M. McFarland, D.L. Albritton, F.C. Fehsenfeld, E.E. Ferguson, A.L. Schmeltekopf, J. Chem. Phys. 59 (1973) 6620.
18. M.A. Duncan, V.M. Bierbaum, G.B. Ellison, S.R. Leone, J. Chem. Phys. 79 (1983) 5448.
19. L.A. Viehland, R.E. Robson, Int. J. Mass Spectrom. Ion Proc. 90 (1989) 167.
20. W. Lindinger, M. McFarland, F.C. Fehsenfeld, D.L. Albritton, A.L. Schmeltekopf, E.E. Ferguson, J. Chem. Phys. 63 (1975) 2175.
21. W. Federer, H. Ramler, H. Villinger, W. Lindinger, Phys. Rev. Lett. 54 (1985) 540.
22. J. Glosik, D. Smith, P. Spanel, W. Freysinger, W. Lindinger, Int. J. Mass Spectrom. Ion Proc. 129 (1993) 131.
23. D. Smith, J. Glosik, V. Skalsky, P. Spanel, W. Lindinger, Int. J. Mass Spectrom. Ion Proc. 129 (1993) 145.
24. M. Tichy, G. Javahery, N.D. Twiddy, E.E. Ferguson, Int. J. Mass Spectrom. Ion Proc. 93 (1989) 165.
25. D. Smith, N.G. Adams, in: T.J. Millar, D.A. Williams (Eds.), Rate Coefficients in Astrochemistry, Kluwer Academic, 1988, p. 153.
26. M. Henchman, in: K.R. Jennings (Ed.), Fundamentals of Gas Phase Ion Chemistry, NATO ASI series, Kluwer Academic, 1991, p. 267.
27. M.J. Frisch, G.W. Trucks, H.B. Schlegel, P.M.W. Gill, B.G. Johnson, M.A. Robb, J.R. Cheeseman, T. Keith, G.A. Petersson, J.A. Montgomery, K. Raghavachari, M.A. Al-Laham, V.G. Zakrzewski, J.V. Ortiz, J.B. Foresman, J. Cioslowski, B.B. Stefanov, A. Nanayakkara, M. Challacombe, C.Y. Peng, P.Y. Ayala, W. Chen, M.W. Wong, J.L. Andres, E.S. Replogle, R. Gomperts, R.L. Martin, D.J. Fox, J.S. Binkley, D.J. DeFrees, J. Baker, J.P. Stewart, M. Head-Gordon, C. Gonzalez, J.A. Pople, Gaussian 94, Gaussian, Inc., Pittsburgh, PA, 1995.
28. L.A. Curtiss, K. Raghavachari, J.A. Pople, J. Chem. Phys. 98 (1993) 1293.
29. M. Durup-Ferguson, H. Böhringer, D.W. Fahey, E.E. Ferguson, J. Chem. Phys. 79 (1983) 265.
30. E.E. Ferguson, in: P. Ausloos, S.G. Lias (Eds.), Structure/ Reactivity and Thermochemistry of Ions, NATO ASI Series, D. Reidel, Dordrecht, 1987, p. 81.
31. D.K. Bohme, in: P. Ausloos, S.G. Lias (Eds.), Structure/ Reactivity and Thermochemistry of Ions, NATO ASI series, D. Reidel Publishing Co., Dordrecht, 1987, p. 219.