Getting the manifold right: The crucial role of orbital resolution in DFT+U for mixed d-f electron compounds
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arXiv
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| Main Authors: | Warda, Kinga, Macke, Eric, Timrov, Iurii, Ciacchi, Lucio Colombi, Kowalski, Piotr M. |
|---|---|
| Format: | Preprint |
| Published: |
2025
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| Subjects: | |
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