Electric-field gradients at the nuclei from all-electron, four-component relativistic density-functional theory using Gaussian-type orbitals
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arXiv
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| Main Authors: | Joosten, Marc, Repisky, Michal, Kadek, Marius, Pyykkö, Pekka, Ruud, Kenneth |
|---|---|
| Format: | Preprint |
| Published: |
2024
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| Subjects: | |
| Online Access: | |
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