Structures and electronic states of one-dimensional atomic wires based on first principles calculations
收藏科学数据银行2021-03-25 更新2026-04-23 收录
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https://www.scidb.cn/en/detail?dataSetId=824222768940711936
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资源简介：
In this database, 367 kinds of one-dimensional (1D) atomic wires (AWs) are included with JSON format. The corresponding structures, electronic structures, magnetic states, phonon spectra and exfoliation energies of these 1D AWs are provided and organized. Besides, a python code is also attached to extract the data from the JSON file based on the keys in each layer. This database will serve as a valuable resource for the scientific community to further explore 1D exotic quantum states and design practical devices using 1D AWs.
提供机构：
Nankai university; Jintao Cui; Meichen Lin; Yahui Cheng; Weichao Wang; Kyeongjae Cho
创建时间：
2021-03-25
