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Calculated Frequencies for PSe (Phosphorus monoselenide) 2Π C∞v

MP4=FULL/CEP-31G 2Π C*V

19 05 15 13 41
InChI=1S/PSe/c1-2 INChIKey=DFRFKDSWUNYYGW-UHFFFAOYSA-N
Mode
Number
Symmetry Frequency
(cm-1)
Scaled Frequency
(cm-1)
IR Intensity
(km/mol)
reduced mass
(u)
description Raman Act
4/u)
Dep P Dep U
List of frequencies only

Unscaled Zero Point Vibrational Energy (zpe)   cm-1
Scaled (by 1) Zero Point Vibrational Energy (zpe)   cm-1

See section Calculated; Vibrations; Scale Factors; Set scaling factors to change the scale factors used here.
See section Calculated; Vibrations; Scale Factors; Calculate a scale factor to determine the least squares best scaling factor.

List of Irreducible Representations for

Rep deg. n vib IR R