Autor: |
A L Frapiccini, Dario Marcelo Mitnik, Lorenzo Ugo Ancarani |
Rok vydání: |
2021 |
Předmět: |
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Zdroj: |
New Electron Correlation Methods and their Applications, and Use of Atomic Orbitals with Exponential Asymptotes ISBN: 9780128235461 |
DOI: |
10.1016/bs.aiq.2021.05.002 |
Popis: |
We propose and implement a spectral approach to describe continuum states of diatomic systems. The method is based on Generalized Sturmian Functions in prolate spheroidal coordinates. With the one-electron dihydrogen cation as an example, we demonstrate the numerical efficiency by calculating photoionization cross sections. |
Databáze: |
OpenAIRE |
Externí odkaz: |
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