2 papers
cond-mat.mtrl-sci2026
The Precursor Genome: A Pairwise Reaction Dataset for Solid-State Synthesis
Lauren N. Walters, Matthew J. McDermott, Bernardus Rendy +3
Solid-state reactions remain the dominant route to inorganic materials, yet no large, machine-readable dataset reports their experimental protocols and outcomes with consistent pro…
cond-mat.mtrl-sci2024
Matbench Discovery -- A framework to evaluate machine learning crystal stability predictions
Janosh Riebesell, Rhys E. A. Goodall, Philipp Benner +7
The rapid adoption of machine learning (ML) in domain sciences necessitates best practices and standardized benchmarking for performance evaluation. We present Matbench Discovery,…