Held-Out Test and Production-Model Provenance for the Pt–C–O NEP Used in Graphene/Pt(111) Intercalation Simulations
This dataset provides held-out testing and production-model provenance analysis for the Pt–C–O fourth-generation neuroevolution potential (NEP4) used in the manuscript “Species-Dependent Interfacial Aggregation and Local Graphene Lifting on Pt(111)”. It supplements the principal computational dataset at https://doi.org...