Prediction of BiS2-type pnictogen dichalcogenide monolayers for optoelectronics
Abstract In this work, we introduce a 2D materials family with chemical formula MX2 (M={As, Sb, Bi} and X={S, Se, Te}) having a rectangular 2D lattice. This materials family has been predicted by systematic ab-initio structure search calculations in two dimensions. Using density-functional theory an...
Main Authors: | , , , , , , |
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Format: | Article |
Language: | English |
Published: |
Nature Portfolio
2024-01-01
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Series: | npj 2D Materials and Applications |
Online Access: | https://doi.org/10.1038/s41699-023-00439-4 |