The active site of ethanol formation from syngas over Cu4 cluster modified MoS2 catalyst: A theoretical investigation
Jiawang Chen, Zhanhui Wang, Juan Zhao, Lixia Ling, Riguang Zhang, Baojun Wang
Topics & Concepts
OxygenateChemistryDissociation (chemistry)CatalysisMonomerSyngasEthanolCluster (spacecraft)SelectivityDensity functional theoryChemical engineeringOrganic chemistryComputational chemistryPolymerEngineeringComputer scienceProgramming languageElectrocatalysts for Energy ConversionCatalysts for Methane ReformingCatalytic Processes in Materials Science