Optimized auxiliary functions for robust mitigation of finite-size errors in periodic hybrid density functional theory
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arXiv
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| Main Authors: | Quiton, Stephen Jon, Pottecher, Juan D. F., Xing, Xin, Head-Gordon, Martin, Lin, Lin |
|---|---|
| Format: | Preprint |
| Published: |
2025
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| Subjects: | |
| Online Access: | |
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