Ab initio theoretical study of the methyl and phosphine torsion modes in ethylphosphine

Smeyers, Yves G.; Melendez, F. J.
February 1997
Journal of Chemical Physics;2/1/1997, Vol. 106 Issue 5, p1709
Academic Journal
Determines the far infrared (FIR) methyl and phosphine torsional frequencies and intensities theoretically in ethylphosphone from ab initio calculations. Restricted Hamiltonian operator; Dynamical symmetry; Intensity determination; Energy level calculations; Intensity calculations.


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