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TCSP3.0: Template-Based Crystal Structure Prediction with Coefficient-Preserving Element Substitution and Structural Diversity

Author / Organization: Ying Feng, Jeffrey Hu, Lai Wei, Liang Tao, Madeline Miklos, Dipannoy Das Gupta, Hossein Erfanshekooh, Jianjun Hu

File Format PDF (Portable Document Format)
Publication Year 2026
Source Host arXiv (arxiv.org)
License / Terms arXiv Open Access / Creative Commons

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