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Preprint Sep 2026

Long-Range Machine Learning Interatomic Potentials for Defect Energetics in SrTiO$_3$

Machine learning interatomic potentials (MLIPs) have advanced rapidly in recent years, yet the majority of models remain semilocal in nature and neglect long-range electrostatic interactions. A growing number of long-range models have emerged to address this limitation, but systematic benchmarks comparing their perform...

Yee-Chit Wong, Marcel F. Langer, R. Maurer et al. · 0 citations

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