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Relative raman line intensities for H2 and for D2. Correction factors for molecular non-rigidity
Authors:Lap M Cheung  David M Bishop
Institution:

Department of Chemistry, University of Ottawa, Ottawa, Canada K1N 9B4

Department of Chemistry, The Pennsylvania State University, University Park, Pennsylvania 16802, USA

Abstract:Ab initio calculations are presented for H2 and D2 relative Raman intensities originating from common rotational levels for both vibrational-rotational and pure rotational transitions. Factors f(J) required to correct measured intensities for molecular non-rigidity (e.g. in temperature measurements) are tabulated. The calculations are compared with literature perturbation-theory equations (significant differences at large J in vibration-rotation) and with experiment.
Keywords:Present address: Chemical Engineering Division  Argonne National Laboratory  Argonne  Illinois 60439  USA  
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