| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5376812 | Chemical Physics | 2006 | 7 Pages |
Abstract
The Fock space multi-reference coupled-cluster (FSMRCC) method is used for the study of the shape resonance energy and width in an electron-atom/molecule collision. The procedure is based upon combining a complex absorbing potential (CAP) with FSMRCC theory. Accurate resonance parameters are obtained by solving a small non-Hermitian eigen-value problem. We study the shape resonances in eâ-C2H4 and eâ-Mg.
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Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Sourav Pal, Y. Sajeev, Nayana Vaval,