论文 · 建模 / 计算研究
二维理论可扭转材料数据库
2D theoretically twistable material database
作者:Yi Jiang, Urko Petralanda, Hanqi Pi, Grigorii Skorupskii, Qiaoling Xu, Dumitru Călugăru, Haoyu Hu, Jiaze Xie, Rose Albu Mustaf, Peter Höhn, Vicky Haase, Abdelmajid Ouahchi 等 33 人
Science · 2026年9月24日 · Jiang 等 33 位作者
不需要生物学背景,多打比方
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摘要Abstract
The study of twisted two-dimensional (2D) materials, in which twisting layers create moiré superlattices, has created opportunities for investigating topological phases and strongly correlated physics. The broader potential of a seemingly infinite set of twistable 2D materials remains largely unexplored. Here, we define "theoretically twistable materials" as single- or multilayer structures that allow for the construction of simple continuum models of their moiré structures. Our high-throughput algorithm systematically searches for theoretically twistable semimetals and insulators based on the Topological 2D Materials Database(2D-TQCDB). By analyzing key electronic properties, we identify thousands of candidate materials, propose representative twistable materials, and provide examples of crystal growth and exfoliation for several of them. Our results provide a resource for future experimental and theoretical studies of moiré systems.
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