DFT study on the surface properties and NO reduction mechanism of modified MnO2/TiO2 catalysts - Jiancheng Yang; Zixuan Song; Mengyi Gao; Qing Liu; Kaihui Wang; Jiaheng Hao; Xin Wang; Lianfei Xu; Zhuozhi Wang; Boxiong Shen (Fuel, 2026)