Mechanism of H2 generation on the unsaturated Mo and S of Mo-Edge in 2H-MoS2 from density functional theory

Title
Mechanism of H2 generation on the unsaturated Mo and S of Mo-Edge in 2H-MoS2 from density functional theory
Authors
Keywords
-
Journal
Computational and Theoretical Chemistry
Volume 1168, Issue -, Pages 112623
Publisher
Elsevier BV
Online
2019-10-20
DOI
10.1016/j.comptc.2019.112623

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