First-Principles Study on the Effect of Strain on Single-Layer Molybdenum Disulfide

By adopting the first-principles plane wave pseudopotential method based on density functional theory, the electronic structure properties of single-layer MoS<sub>2</sub> (molybdenum disulfide) crystals under biaxial strain are studied. The calculation results in this paper show that whe...

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Bibliographic Details
Main Authors: Chen Chong, Hongxia Liu, Shulong Wang, Kun Yang
Format: article
Language:EN
Published: MDPI AG 2021
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Online Access:https://doaj.org/article/c8ad7a3157504cfcba5d60b01a96392f
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