Geometric Optimization of Restricted-Open and Complete Active Space Self-Consistent Field Wavefunctions
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arXiv
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| Main Authors: | Vidal, Laurent, Nottoli, Tommaso, Lipparini, Filippo, Cancès, Eric |
|---|---|
| Format: | Preprint |
| Published: |
2024
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| Subjects: | |
| Online Access: | |
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