Title of article :
Probing the accuracy of the isomerization energy of the 3-D morphed potential of Ar–HBr
Author/Authors :
Willaert، نويسنده , , F.F. and McElmurry، نويسنده , , B.A. and Lucchese، نويسنده , , R.R. and Bevan، نويسنده , , J.W.، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 2008
Pages :
6
From page :
525
To page :
530
Abstract :
Investigations of the lowest Σ-bending vibrations of Ar–DBr (v = 0) and Ar–HBr (v = 1) are reported using a co-axially configured submillimeter supersonic jet spectrometer. The v = 1 spectra were obtained using glow discharge excitation. Analyses of hyperfine substructure in these spectra provide accurate molecular parameters for Ar–DBr and Ar–BrD isomeric states, direct determination of their corresponding isomerization energies, and respective parameters in the v = 1 HBr stretching vibration of the Ar–HBr isotopomer. This experimental data provides a sensitive probe of the relative energies of potential minima for previously determined 3-D Ar–HBr morphed potential and compared with results from extrapolations to the CCSD(T)/CBS limit.
Journal title :
Chemical Physics Letters
Serial Year :
2008
Journal title :
Chemical Physics Letters
Record number :
1924605
Link To Document :
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