Application of Quantum Chemistry to Atmospheric Chemistry.
Abstract
Relativistic effective potentials have been used to calculate the electronic structure and spectroscopic properties of UO+. The excitation energies of the excited states of UO+ were calculated using a restricted valence configuration interaction. Strong radiative transitions are predicted in the red part of the visible. These transitions are predominately atomic-like f to d.
Document Details
- Document Type
- Technical Report
- Publication Date
- Sep 30, 1982
- Accession Number
- ADA133836
Entities
People
- M. Krauss
- W. J. Stevens
Organizations
- National Institute of Standards and Technology