{"@context":"https://schema.org","@type":"Dataset","@id":"https://datagraph.stage.matportal.org/id/dataset/alexandria-pbe-complete-3d","name":"Alexandria PBE Complete Database 3D","description":"Large-scale database of crystal structures and property data of 3D materials computed using Density Functional Theory with the PBE exchange-correlation functional. Complements OQMD/JARVIS with different workflows and newer scale.","license":"CC BY 4.0","keywords":["DFT","PBE","crystal structures","convex hull","high-throughput"],"creator":"admin","publisher":"Alexandria Project","accountablePerson":"admin","version":"2025.07.02","url":"https://stage.matportal.org/datasets/alexandria-pbe-complete-3d","distribution":[{"@type":"DataDownload","name":"Alexandria PBE 3D Directory Index","encodingFormat":"JSON","contentUrl":"https://alexandria.icams.rub.de/data/pbe/2025.07.02/"}]}