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Order-disorder phase transitions in the two-dimensional semiconducting transition metal dichalcogenide alloys Mo(1−x)W(x)X(2) (X = S, Se, and Te)

A combination of density functional theory, an empirical model, and Monte Carlo simulations is used to shed light on the evolution of the atomic distribution in the two-dimensional semiconducting transition metal dichalcogenide alloys Mo(1−x)W(x)X(2) (X = S, Se, and Te) as a function of the W concen...

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Detalhes bibliográficos
Main Authors: Gan, Li-Yong, Zhang, Qingyun, Zhao, Yu-Jun, Cheng, Yingchun, Schwingenschlögl, Udo
Formato: Artigo
Idioma:Inglês
Publicado em: Nature Publishing Group 2014
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC4204064/
https://ncbi.nlm.nih.gov/pubmed/25331363
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/srep06691
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