遇见数据集

(05) SCIGEN-Generated Materials with Ti or Cu Constraints (Raw Output)

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DataCite Commons2025-08-26 更新2025-09-08 收录
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资源简介:

An additional dataset of <b>2.2 million materials</b>, generated with SCIGEN by constraining selected atomic sites to Ti or Cu. Each ZIP folder contains a batch of CIF files. (No pre-screening applied.)Triangular: <code>tri</code>Honeycomb: <code>hon</code>Kagome: <code>kag</code>Square: <code>sqr</code>Elongated triangular: <code>elt</code>Snub square: <code>sns</code>Truncated square: <code>tsq</code>Small rhombitrihexagonal: <code>srh</code>Snub hexagonal: <code>snh</code>Truncated hexagonal: <code>trh</code>Lieb: <code>lieb</code>

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figshare
创建时间:
2025-08-26
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