Density functional theory based HSE06 calculations to probe the effects of defect on electronic properties of monolayer TMDCs
出版年份 2021 全文链接
标题
Density functional theory based HSE06 calculations to probe the effects of defect on electronic properties of monolayer TMDCs
作者
关键词
DFT, TMDCs, Semiconductor, Band structure, Work functions
出版物
Computational and Theoretical Chemistry
Volume 1205, Issue -, Pages 113445
出版商
Elsevier BV
发表日期
2021-09-11
DOI
10.1016/j.comptc.2021.113445
参考文献
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