Adsorption and sensing behaviors of SF6 decomposed species on Ni-doped C3N monolayer: A first-principles study
Abstract
null null To give a first insight into the transition metal (TM) doped C3N monolayer for application of chemical gas sensors, we using first-principles theory in this paper investigated the adsorption performance of Ni-doped C3N (Ni-C3N) monolayer upon three SF6 decomposed species, including SO2, SOF2, and SO2F2. We first analyzed the stability of Ni-doping on the C3N monolayer where two sites were considered, namely the N-vacancy and C-vacancy...
Paper Details
Title
Adsorption and sensing behaviors of SF6 decomposed species on Ni-doped C3N monolayer: A first-principles study
Published Date
May 15, 2020
Journal
Volume
512
Pages
145759
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