Browsing Computational File Repository by Author "Singh, Arunima"
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MoS2-MoTe2
Burton, Benjamin P; Singh, ArunimaA first principles phase diagram calculation, that included van der Waals interactions, was performed for the system (1-X)$\cdot$MoS$_{2}$-(X)$\cdot$MoTe$_{2}$. Surprisingly, the predicted phase diagram has at least ...