Data for: Insight into the Catalytic Mechanism of NO Oxidation and the Role of NO2 in Fast Selective Catalytic Reduction DeNOx at Low-Temperature over MnOx/TiO2 Catalyst

Published: 20-07-2019| Version 1 | DOI: 10.17632/x4wz7fbvdg.1
Contributor:
Zhi Liu

Description

The calculation details of the proposed surface states including the optimized results, ZPE correction and TS script for calculating Gibbs free energy.

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