Unraveling the controversy over a catalytic reaction mechanism using a new theoretical methodology: One probe and non-equilibrium surface Green's function

Title
Unraveling the controversy over a catalytic reaction mechanism using a new theoretical methodology: One probe and non-equilibrium surface Green's function
Authors
Keywords
One-probe, Surface Green's function, Iodine reduction reaction, Electric field, Catalytic activity, Density functional theory
Journal
Nano Energy
Volume 63, Issue -, Pages 103863
Publisher
Elsevier BV
Online
2019-07-05
DOI
10.1016/j.nanoen.2019.103863

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