This dataset contains first version of TheMeCat database collecting information about different catalyst used for thermal conversion of CO2 into methanol in TheMeCat_v1.csv. The dataset is explained in: Árpád I. Toldy, Prajwal Pisal, Ondřej Krejčí, Patrick Rinke, and Annukka Santasalo-Aarnio, TheMeCat: Dataset of Thermocatalytic Conversion of CO2 to Methanol, (reference to be updated) Important note: the distinction between "active" and "support" materials is solely based on the denotions in the source materials, and it can be removed for further processing (for e.g., data-driven materials discovery).

2025