A first-principles examination of conducting monolayer 1T[prime or minute]-MX2 (M = Mo, W; X = S, Se, Te): promising catalysts for hydrogen evolution reaction and its enhancement by strain

Phys. Chem. Chem. Phys., 2015, 17,21702-21708
DOI: 10.1039/C5CP03799A, Paper

Darwin Barayang Putungan, Shi-Hsin Lin, Jer-Lai Kuo
We investigated the application of 1T[prime or minute]-MX₂ (M = Mo, W; X = S, Se, Te) 2D materials as hydrogen evolution reaction (HER) catalysts using density functional theory.
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