Design and screening of transition-metal doped chalcogenides as CO2-to-CO electrocatalysts
Junzhuo Wei, Yingju Yang, Jing Liu, Bo Xiong
Topics & Concepts
OverpotentialDensity functional theoryTransition metalCatalysisMean absolute errorLimitingElectrochemistryMean squared errorChemistrySelectivitySupport vector machineMaterials scienceComputer scienceComputational chemistryMathematicsMachine learningPhysical chemistryElectrodeEngineeringStatisticsMechanical engineeringBiochemistryCO2 Reduction Techniques and CatalystsAdvanced Thermoelectric Materials and DevicesCarbon dioxide utilization in catalysis