MTPu 2023
收藏materials.colabfit.org2025-01-21 收录
下载链接:
https://materials.colabfit.org/id/DS_326i4urabisb_0
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资源简介:
A comprehensive database generated using density functional theory simulations, encompassing a wide range of crystal structures, point defects, extended defects, and disordered structure.
一项综合数据库,通过密度泛函理论模拟生成,涵盖广泛晶体结构、点缺陷、扩展缺陷和无序结构。
提供机构:
ColabFit



