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Diapositive 1

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Analysis of the 18O3 CRDS spectra in the 6000 7000 cm-1 spectral ... CNRS 5588, Universit Joseph Fourier, BP 87 - 38402 Saint Martin d'H res Cedex, France. ... – PowerPoint PPT presentation

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Title: Diapositive 1


1
Analysis of the 18O3 CRDS spectra in the 6000
7000 cm-1 spectral range comparison with 16O3.
Notes a Difference between the vibrational
energy values obtained from the experimental data
reduction with variational predictions calculated
1 from the PES of Ref. 2. b Columns 4-9
represent three major contributions for the
decomposition of corresponding wave functions
derived from the potential function 2, 3 in
normal mode coordinates q1, q2, q3 using 10th
order Contact Transformations 1. Columns Pns
indicate the mixing coefficients (in ) of ? eff
in the harmonic normal mode basis. Columns Wns
indicate the corresponding vibration normal mode
quantum numbers (v1v2v3)0. n is the order of the
contribution. The subscript 0 of (v1v2v3) 0
means the normal mode representation.
  • References
  • Vl. G. Tyuterev, S. A. Tashkun and H. Seghir, to
    be published.
  • Vl. G. Tyuterev, S. A. Tashkun, P. Jensen, A.
    Barbe and T. Cours, J. Mol. Spectrosc., 1999,
    198, 5776.
  • Vl. G. Tyuterev, S. A. Tashkun, D. W. Schwenke,
    P. Jensen, T. Cours, A. Barbe and M. Jacon, Chem.
    Phys. Lett., 2000, 316, 271279.

Notes a Dominant normal mode contribution in
eigenvector expansion (see previous Table). b
Number of transitions rovibrationally assigned
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