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We introduce Stability-Aware Boltzmann Estimator (StABlE) Training for Machine Learning Force Fields (MLFFs), which enables refinement of MLFFs using system observables (obtained via high-fidelity ...

Otaniemi Center for Atomic-scale Materials Modeling (OCAMM), hosted by the Department of Chemistry and Materials Science (CMAT). The positions to be filled are part of a new project funded by Business ...