CO2, a well-known greenhouse gas, is a potential raw material used to produce various chemicals. Dissociation of CO2 to CO or hydrogenation to formate (HCOO) or carboxyl (COOH) intermediate is crucial in determining the ...

We present a machine learning (ML) framework HEART (HydrogEn storAge propeRty predicTor) for identifying suitable families of metal alloys for hydro- gen storage under ambient conditions. Our framework includes two ML ...