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20242026
most citedApplication-specific machine-learned interatomic potentials: exploring the trade-off between DFT convergence, MLIP expressivity, and computational cost

5 citations · 6 across the 5 of their papers we have counts for

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cond-mat.mtrl-sci2026

Surrogate-Gated Generation and Foundation-Model Embeddings for Bayesian Materials Design

Sk Md Ahnaf Akif Alvi, Jan Janssen, Danny Perez +2

Closed-loop materials discovery iterates between proposing candidate structures and evaluating their properties, and property evaluation dominates the cost. In the generative varia…