Proof-Carrying Materials: Falsifiable Safety Certificates for Machine-Learned Interatomic Potentials

arXiv:2603.12183 · cond-mat.mtrl-sci, cs.AI, cs.LG, physics.comp-ph · Submitted 2026-03-12 · Read on arXiv

cond-mat.mtrl-sci, cs.AI, cs.LG, physics.comp-ph

Submitted: 2026-03-12

Updated: 2026-10-29

Terminology

• AUC — 2× in this paper · explained in 2 episodes
• Proof-Carrying Materials — 2× in this paper
• Benchmark — 1× in this paper · explained in 2 episodes
• Density Functional Theory (DFT) — 1× in this paper · explained in 3 episodes
• Feature Importance — 1× in this paper · explained in 2 episodes

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