| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 1405586 | Journal of Molecular Structure | 2012 | 5 Pages |
Abstract
Auger resonances 1s2s22S and 1s(2s2p3Po) 2Po of Li and Li-like cations (Be, B, C, N, O) have been studied with a complex scaled multi-reference configuration interaction method (CMR-CI). The multi-reference orbitals are optimized with complex scaled MCSCF for the specific state. Our calculations show that the present CMR-CI resonance parameters agree very well with the experiment and theoretical results.
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Physical Sciences and Engineering
Chemistry
Organic Chemistry
Authors
Song Bin Zhang, Danny L. Yeager,