Dataset Groups Activity Stream Open Catalyst 2020 (OC20) dataset The Open Catalyst 2020 (OC20) dataset is a large-scale dataset for simulating catalyst materials. BibTex: @dataset{Muhammed_Shuaibi_and_Adeesh_Kolluru_and_Abhishek_Das_and_Aditya_Grover_and_Anuroop_Sriram_and_Zachary_Ulissi_and_C_Lawrence_Zitnick_2024, abstract = {The Open Catalyst 2020 (OC20) dataset is a large-scale dataset for simulating catalyst materials.}, author = {Muhammed Shuaibi and Adeesh Kolluru and Abhishek Das and Aditya Grover and Anuroop Sriram and Zachary Ulissi and C. Lawrence Zitnick}, doi = {10.57702/o0c5eu4v}, institution = {No Organization}, keyword = {'catalyst materials', 'density functional theory', 'machine learning'}, month = {dec}, publisher = {TIB}, title = {Open Catalyst 2020 (OC20) dataset}, url = {https://service.tib.eu/ldmservice/dataset/open-catalyst-2020--oc20--dataset}, year = {2024} }