@article{Zihao Yao_126, author = {Zihao Yao, Jinyan Zhao, Chenxia Zhao, Shengwei Deng, Guilin Zhuang, Xing Zhong, Zhongzhe Wei, Yang Li, Shibin Wang, Jianguo Wang}, title = {A first-principles study of reaction mechanism over carbon decorated oxygen-deficient TiO2 supported Pd catalyst in direct synthesis of H2O2}, publisher = {Chinese Journal of Chemical Engineering}, year = {2021}, journal = {Chinese Journal of Chemical Engineering}, volume = {29}, number = {3}, eid = {126}, pages = {126-134}, keywords = {Direct synthesis of H#sub#2#/sub#O#sub#2#/sub#;DFT;Supported Pd-catalysts;TiO#sub#2#/sub#-support;Carbon-doped;Oxygen vacancies}, doi = https://cjche.cip.com.cn/EN/10.1016/j.cjche.2020.11.016 }