Performance comparison of hybrid functionals for describing narrow-gap semiconductors: A study on low-temperature thermoelectric material α-SrSi2

标题
Performance comparison of hybrid functionals for describing narrow-gap semiconductors: A study on low-temperature thermoelectric material α-SrSi2
作者
关键词
α-SrSi, 2, Narrow bandgap, Low-temperature thermoelectrics, First-principles calculations, Hybrid functional
出版物
Computational Condensed Matter
Volume 30, Issue -, Pages e00620
出版商
Elsevier BV
发表日期
2021-12-06
DOI
10.1016/j.cocom.2021.e00620

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