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This expression is a straightforward extension to J>0 of the expression given in Ref. 40 for J=0.
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The angular basis used in the CC results was truncated at j = 10, Ω = 10 and J = 24. This yielded reaction probabilities that were converged to better than 0.5%.
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note
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2 reaction, it would be necessary to calculate also the state-to-state inelastic cross sections. See the Appendix for a note on calculating the inelastic cross sections.
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81
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0003396304
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edited by R. von Schleyer Wiley, New York
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D. C. Clary, in Encyclopedia of Computational Chemistry, edited by R. von Schleyer (Wiley, New York, 1998); J. M. Bowman and G. C. Schatz, Annu. Rev. Phys. Chem. 46, 169 (1995).
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(1998)
Encyclopedia of Computational Chemistry
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Clary, D.C.1
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82
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D. C. Clary, in Encyclopedia of Computational Chemistry, edited by R. von Schleyer (Wiley, New York, 1998); J. M. Bowman and G. C. Schatz, Annu. Rev. Phys. Chem. 46, 169 (1995).
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(1995)
Annu. Rev. Phys. Chem.
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Bowman, J.M.1
Schatz, G.C.2
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private communication
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G. G. Balint-Kurti (private communication).
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Balint-Kurti, G.G.1
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