Theoretical study of electronic autoionization in CO: Vibrationally resolved results between 17 and 18.3 eV
- 1 October 1986
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review A
- Vol. 34 (4) , 2920-2935
- https://doi.org/10.1103/physreva.34.2920
Abstract
We have theoretically studied the electronic autoionization between 17 and 18.3 eV of the Rydberg series converging to the B state of ( series). We have obtained the partial and vibrationally resolved differential and total photoionization cross sections by combining ab initio electronic quantities with a variant of the two-step multichannel quantum-defect theory (MQDT). The formalism of the Feshbach projection operators is used to separate the electronic quantities needed in the first and second steps of the MQDT. We have introduced the vibrational motion within the Condon approximation. Our results lead to new unambiguous assignments of the series. The vibrationally resolved cross sections, the associated branching ratios, and the background and resonant features are discussed in detail and compared with the available experimental data. There is an overall agreement between theory and experiment except for the angular distribution of photoelec- trons.
Keywords
This publication has 42 references indexed in Scilit:
- Autoionization observed in the CO+ (A 2Π–X 2Σ+) and (B 2Σ+–X 2Σ+) fluorescence excitation spectraThe Journal of Chemical Physics, 1985
- Vibrational-state dependence of partial cross sections and photoelectron angular distributions through autoionizing resonances: the n =3 Rydberg state converging to the B 2 Ʃ + state of CO +Proceedings of the Royal Society of London. Series A. Mathematical and Physical Sciences, 1981
- Molecular rydberg transitions in carbon monoxide: term value/ionization energy correlation of BF, CO and N2Chemical Physics, 1980
- Vibrational intensity distributions for the various electronic states of O2+, N2+ and CO+ produced by photoionizationJournal of Electron Spectroscopy and Related Phenomena, 1978
- Partial photoionization cross sections ofand CO using synchrotron radiationPhysical Review A, 1977
- Partial photoionization cross-sections and branching ratios of CO from 750 to 304 ÅJournal of Electron Spectroscopy and Related Phenomena, 1976
- Absorption spectrum of CO in the Hopfield helium continuum region, 600–1020 ÅJournal of Molecular Spectroscopy, 1972
- Rydberg Series Converging to the B 2Σ+ State of CO+The Journal of Chemical Physics, 1965
- Absorption Coefficients of Carbon Monoxide in the 1006–600-Å Wavelength RegionThe Journal of Chemical Physics, 1964
- Die Absorptionsspektren von Kohlendioxyd, Kohlenmonoxyd und Wasserdampf im Gebiet von 600–900 ÅEAnnalen der Physik, 1932