Abstract
As a promising material for heterogeneous catalytic applications, layered iron (II) monosulfide (FeS) contains active edges and an inert basal (001) plane. Activating the basal (001) plane could improve the catalytic performance of the FeS material towards CO2 activation and reduction reactions. Herein, we report dispersion‐corrected density functional theory (DFT‐D3)
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