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First-principles study of CO<sub>2</sub> hydrogenation to formic acid on single-atom catalysts supported on SiO<sub>2</sub>

Jikai Sun, Shuchao Jiang, Yanliang Zhao, Honglei Wang, Dong Zhai, Wei Deng, Lei Sun

2022Physical Chemistry Chemical Physics11 citationsDOI

Abstract

Schematic diagram of hydrogen spillover and CO 2 hydrogenation on SiO 2 surface.

Topics & Concepts

CatalysisFormic acidAtom (system on chip)Materials scienceChemistryInorganic chemistryChemical engineeringPhysical chemistryOrganic chemistryComputer scienceEngineeringParallel computingCarbon dioxide utilization in catalysisCatalysts for Methane ReformingCO2 Reduction Techniques and Catalysts
First-principles study of CO<sub>2</sub> hydrogenation to formic acid on single-atom catalysts supported on SiO<sub>2</sub> | Litcius