Accelerating the discovery of low-energy structure configurations: a computational approach that integrates first-principles calculations, Monte Carlo sampling, and Machine Learning
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arXiv
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| Main Authors: | Musa, Md Rajib Khan, Qian, Yichen, Peng, Jie, Cereceda, David |
|---|---|
| Format: | Preprint |
| Published: |
2024
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| Subjects: | |
| Online Access: | |
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