# Knowledge Bank

## University Libraries and the Office of the Chief Information Officer

The Knowledge Bank is scheduled for regular maintenance on Sunday, April 20th, 8:00 am to 12:00 pm EDT. During this time users will not be able to register, login, or submit content.

# CALCULATED SPECTROSCOPIC PROPERTIES OF SOME SMALL POLYATOMIC ANIONS

Please use this identifier to cite or link to this item: http://hdl.handle.net/1811/16915

Files Size Format View
1986-ME-12.jpg 104.3Kb JPEG image

 Title: CALCULATED SPECTROSCOPIC PROPERTIES OF SOME SMALL POLYATOMIC ANIONS Creators: Botschwina, P. Issue Date: 1986 Abstract: Near-equilibrium potential surfaces have been calculated for the electronic ground states of the anions $NH_{2}^{-}, PH_{2}^{-}, AsH_{2}^{-}, HCC^{-}, HO_{2}^{-}, N_{3}^{-}$, and $HCO_{2}^{-}$ from highly correlated CEPA wavefunctions. Anharmonic vibrational frequencies and IR intensities have been computed and other spectroscopic properties such as rototional constants, centrifugal distortion constants and rotation-vibration coupling constants are reported. URI: http://hdl.handle.net/1811/16915 Other Identifiers: 1986-ME-12