| Numéro |
J. Phys. Colloques
Volume 48, Numéro C9, Décembre 1987
X-Ray and Inner-Shell ProcessesVol. 1 |
|
|---|---|---|
| Page(s) | C9-729 - C9-732 | |
| DOI | https://doi.org/10.1051/jphyscol:19879124 | |
X-Ray and Inner-Shell Processes
Vol. 1
J. Phys. Colloques 48 (1987) C9-729-C9-732
DOI: 10.1051/jphyscol:19879124
Department of Chemistry, University of Tasmania, Hobart, 7001 Tasmania, Australia
Vol. 1
J. Phys. Colloques 48 (1987) C9-729-C9-732
DOI: 10.1051/jphyscol:19879124
X-RAY EMISSION PROCESSES FOR MOLECULES : AN AB INITIO STUDY FOR THE N2O MOLECULE
F.P. LARKINS and R.A. PHILLIPSDepartment of Chemistry, University of Tasmania, Hobart, 7001 Tasmania, Australia
Abstract
The oxygen and nitrogen X-ray spectra for the N2O molecule have been calculated using an ab initio molecular orbital method at the relaxed Hartree Fock level. Transition rates include interatomic contributions. The central and terminal nitrogen atom spectra are separately identified. Comparison with the experimental spectrum reveals the extent of satellite contamination in the electron impact excited spectrum.