Atomic-thin hexagonal CuCo nanocrystals with d-band tuning for CO<sub>2</sub> reduction
Yibo Yan, Zhengping Zhao, Jun Zhao, Wenfei Tang, Wei Huang, Jong‐Min Lee
Abstract
Hexagonal CuCo nanocrystals are exploited for CO<sub>2</sub> reduction at high faradaic efficiency. Density functional theory calculates the structure-oriented binding energy of intermediates for catalyst optimization.
Topics & Concepts
NanocrystalHexagonal crystal systemDensity functional theoryReduction (mathematics)Materials scienceCatalysisFaraday efficiencyNanotechnologyOptoelectronicsCrystallographyPhysical chemistryComputational chemistryChemistryMathematicsGeometryElectrodeElectrolyteBiochemistryCO2 Reduction Techniques and CatalystsCatalytic Processes in Materials ScienceAdvanced Photocatalysis Techniques