Electronic band structure of 4d and 5d transition metal trichalcogenides
نویسندگان
چکیده
منابع مشابه
Tuning the electronic properties of transition-metal trichalcogenides via tensile strain.
A comprehensive study of the effect of tensile strain (ε = 0% to 8%) on the electronic structures of two-dimensional (2D) transition-metal trichalcogenide (TMTC) monolayers MX3 (M = Ti, Zr, Hf, Nb; X = S, Se Te) is performed on the basis of density functional theory (DFT) computation. The unstrained TiS3, ZrS3, ZrSe3, HfS3, HfSe3 and NbS3 monolayers are predicted to be semiconductors with their...
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ژورنال
عنوان ژورنال: Physica B: Condensed Matter
سال: 2018
ISSN: 0921-4526
DOI: 10.1016/j.physb.2017.10.126