Understanding the wetting of transition metal dichalcogenides from an ab initio perspective
Transition metal dichalcogenides (TMDs) are a class of two-dimensional (2D) materials that have been widely studied for emerging electronic properties. In this paper, we use computational simulations to examine the water adsorption on TMDs systematically and the wetting property of tungsten diseleni...
Main Authors: | Siheng Li, Keyang Liu, Jiří Klimeš, Ji Chen |
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Format: | Article |
Language: | English |
Published: |
American Physical Society
2023-04-01
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Series: | Physical Review Research |
Online Access: | http://doi.org/10.1103/PhysRevResearch.5.023018 |
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