Accelerating Core-Level GW Calculations by Combining the Contour Deformation Approach with the Analytic Continuation of W
In recent years, the method has emerged as a reliable tool for computing core-level binding energies. The contour deformation (CD) technique has been established as an efficient, scalable, and numerically stable approach to compute the self-energy for deep core excitations. However, core-level calcu...
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| Veröffentlicht in: | Journal of chemical theory and computation Jg. 19; H. 16; S. 5450 |
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| Hauptverfasser: | , |
| Format: | Journal Article |
| Sprache: | Englisch |
| Veröffentlicht: |
United States
22.08.2023
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| ISSN: | 1549-9626, 1549-9626 |
| Online-Zugang: | Weitere Angaben |
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