Understanding the adsorption of NH3, NO and O2 on the MnOx/SiO2 β-cristobalite (101) surface with density functional theory
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DOI: 10.1007/s11144-020-01827-3
Abstract: Based on the density functional theory, the adsorption processes of NH3, and NO and O2 on the Mn active sites of MnOx/SiO2 β-cristobalite (101) surface were simulated. The results show that NH3, NO and O2… read more here.
Keywords: sio2 cristobalite; 101 surface; adsorption; cristobalite 101 ... See more keywords