A representation of the effective rotational Hamiltonian in the form of optimum versions of a rational series of the perturbation theory is suggested for nonisolated molecular states. This representation is used to analyze the most complete set of precise transition frequencies in the rotational spe
On the Determination of the Equilibrium Structure of the PH3 Molecule
✍ Scribed by O.N Ulenikov; E.S Bekhtereva; G.A Onopenko; E.A Sinitsin
- Publisher
- Elsevier Science
- Year
- 2002
- Tongue
- English
- Weight
- 126 KB
- Volume
- 216
- Category
- Article
- ISSN
- 0022-2852
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✦ Synopsis
Values of the r e and α e equilibrium structural parameters of the PH 3 molecule have been determined on the basis of experimental data on the fundamental bands of the PH 2 D and PHD 2 species only, without any knowledge of the force-constant-type parameters of the PH 3 molecule. The functions of the equilibrium rotational parameters A e , B e , and C e have been determined. These functions are totally independent of the values of any resonance interaction parameters. Then these functions have been used to determine r e and α e constants. The obtained values r e = (1.416 776 ± 0.000 164) Å and α e = (93.56 ± 0.29) • differ a little from those found in the earlier literature.
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