Zihao Yao - Dissemin

All papers authored by Zihao Yao

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2024 Jinyan Zhao, Zihao Yao

, Yaqiu Wang, Jianguo Wang

Identifying Pd9OX as the optimum catalyst for the direct synthesis of H2O2 through microkinetic modeling with coverage effects

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This paper is made freely available by the publisher.

Chenglong Qiu, Jianfa Chen, Feicheng Huan, Shengwei Deng, Zihao Yao

, Shibin Wang

, Jianguo Wang

Curing and Cross-Linking Processes in the Poly(3,3-bis-azidomethyl oxetane)-tetrahydrofuran/Toluene Diisocyanate/Trimethylolpropane System: A Density Functional Theory and Accelerated ReaxFF Molecular Dynamics Investigation

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Zihao Yao

, Xu Liu, Rhys J. Bunting, Jianguo Wang

Unravelling the reaction mechanism for H2 production via formic acid decomposition over Pd: Coverage-Dependent microkinetic modeling

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2023 Jinyan Zhao, Zihao Yao

, Rhys J. Bunting

, P. Hu

, Jianguo Wang

Microkinetic Modeling with Size-Dependent and Adsorbate–Adsorbate Interactions for the Direct Synthesis of H₂O₂ over Pd Nanoparticles

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Mingzhe Xue, Jinyan Zhao, Xuan Yu, Lei Ding, Xiaosa Wang, Jia Liu, Huaijie Shi, Yufeng Xue, Zihao Yao

, Xing Zhong, Jianguo Wang

Facilitating Electrochemical Ozone Production and Chlorine Evolution Reaction by Synergistic Effect of Multicomponent Metal Oxides

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Lan Shen, Zihao Yao

, Shengwei Deng

, Shibin Wang, Chengli Mao, Jian‐Guo Wang

Solid propellants: A first‐principles study of nitrous oxide generation from A3

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Chenglong Qiu, Shengwei Deng, Feicheng Huan, Yin Sun, Zihao Yao

, Shibin Wang

, Zhiyan Pan

, Jianguo Wang

Molecular-Level Insights into Adsorption and Diffusion Properties of CO and CO₂ on Pt-Supported Graphene

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Zhikang Bao, Zihao Yao

, Chongzhi Zhu, Yikuan Liu, Shijie Zhang, Jinyan Zhao, Lei Ding, Zaixiang Xu, Xing Zhong, Yihan Zhu, Jianguo Wang

Coherent Sub‐Nanometer Interface between Crystalline and Amorphous Materials Boosts Electrochemical Synthesis of Hydrogen Peroxide

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Xiaosa Wang, Jiayuan Li, Lei Ding, Huaijie Shi, Jia Liu, Xinying Yang, Min Li, Xing Zhong, Zihao Yao

, Jianguo Wang

Tailoring crystal facet microenvironments for simultaneous electrochemical ozone and hydrogen peroxide production

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Zhikang Bao, Jinyan Zhao, Shijie Zhang, Xiaoge Peng, Yizhen Shao, Chenghang Jiang, Zaixiang Xu, Xing Zhong, Zihao Yao

, Jianguo Wang

Tuning the ratio of Bi/Bi2O3 in Bi/PNC nanosheet for high-efficiency electrosynthesis hydrogen peroxide

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Xin‐Qian Gao, Zi‐Hao Yao

, Wen‐Cui Li, Gao‐Ming Deng, Lei He, Rui Si, Jian‐Guo Wang, An‐Hui Lu

Calcium‐Modified PtSn/Al₂O₃ Catalyst for Propane Dehydrogenation with High Activity and Stability

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Zhongzhe Wei, Zijiang Zhao, Chenglong Qiu, Songtao Huang, Zihao Yao

, Mingxuan Wang, Yi Chen, Yue Lin

, Xing Zhong

, Xiaonian Li, Jianguo Wang

Tripodal Pd metallenes mediated by Nb2C MXenes for boosting alkynes semihydrogenation

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Jiayuan Li, Zihao Yao

, Jinyan Zhao, Shengwei Deng, Shibin Wang, Jianguo Wang

Microkinetic simulations of acetylene(acetylene-d2) hydrogenation(deuteration) on Ag nanoparticles

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Fangjun Shao, Jiaxu Cheng, Xin Song, Zhongzhe Wei, Xing Zhong

, Zihao Yao

, Hong Wang

, Xiangdong Sun, Aiyun Li, Jianguo Wang

Effects of manganese on the catalytic performance of CuCo catalysts for direct conversion of CO/CO₂ to higher alcohols

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Wenwen Li, Ge Feng, Shibin Wang, Xing Zhong

, Zihao Yao

, Shengwei Deng, Jianguo Wang

Accelerating high-throughput screening of hydrogen peroxide productionviaDFT and machine learning

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2022 Shurui Fan, Zihao Yao

, Wei Cheng, Xian Zhou, Yao Xu, Xuetao Qin, Siyu Yao

, Xi Liu, Jianguo Wang

, Xiaonian Li, Lili Lin

Subsurface Ru-Triggered Hydrogenation Capability of TiO_2–x Overlayer for Poison-Resistant Reduction of N-Heteroarenes

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Jiayuan Li, Dahai Zheng, Zihao Yao

, Shixin Wang, Ruinian Xu

, Shengwei Deng

, Biaohua Chen

, Jianguo Wang

Formation Mechanism of Monocyclic Aromatic Hydrocarbons during Pyrolysis of Styrene Butadiene Rubber in Waste Passenger Car Tires

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Ge Feng, Wenwen Li, Jia Liu, Xing Zhong, Zihao Yao

, Shengwei Deng, Wenan Zhang, Shibin Wang, Jianguo Wang

Potential dependence of OER/EOP performance on heteroatom-doped carbon materials by grand canonical density functional theory

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Xiang Sun, JingNan Zheng, Zihao Yao

, Shengwei Deng, Zhiyan Pan

, ShiBin Wang

, Jianguo Wang

DFT Investigation of Single Metal Atom-Doped 2D MA₂Z₄ Materials for NO Electrocatalytic Reduction to NH₃

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Yijing Gao, Shijie Zhang, Xiang Sun, Wei Zhao, Han Zhuo, Guilin Zhuang, Shibin Wang, Zihao Yao

, Shengwei Deng, Xing Zhong, Zhongzhe Wei, Jian-Guo Wang

Computational screening of O-functional MXenes for electrocatalytic ammonia synthesis

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All papers authored by Zihao Yao