A DFT study of methanol synthesis from CO2 hydrogenation on Cu/ZnO catalyst

Xingzi Wang; Hai Zhang; Huang Qin; Kunming Wu; Kai Wang; Junfang Ma; Weidong Fan

doi:10.1016/j.fuel.2023.128381

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A DFT study of methanol synthesis from CO2 hydrogenation on Cu/ZnO catalyst

Xingzi Wang Hai Zhang Huang Qin Kunming Wu Kai Wang Junfang Ma Weidong Fan

Year: 2023 Journal: Fuel Vol: 346 Pages: 128381-128381 Publisher: Elsevier BV

DOI: 10.1016/j.fuel.2023.128381

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Keywords:

Catalysis Methanol Materials science Adsorption Density functional theory Metal Chemical engineering Heterojunction Carbon fibers Doping Physical chemistry Inorganic chemistry Computational chemistry Chemistry Organic chemistry Composite number Metallurgy Composite material

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Catalysts for Methane Reforming

Physical Sciences → Chemical Engineering → Catalysis

Catalytic Processes in Materials Science

Physical Sciences → Materials Science → Materials Chemistry

Carbon dioxide utilization in catalysis

Physical Sciences → Chemical Engineering → Process Chemistry and Technology

A DFT study of methanol synthesis from CO2 hydrogenation on Cu/ZnO catalyst

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