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Dimitrios Tzivrailis

Université Paris-Saclay, CEA, List, F-91120 Palaiseau Cedex, France, LPTMS, CNRS, Université Paris-Saclay, 91405 Orsay, France

Papers on Lattice

1

Total citations

0

Topics

1

Research focus

Scientific Discovery & Drug Design (1)

Frequent co-authors

Georgios Sotiropoulos (1)Alberto Rosso (1)Eiji Kawasaki (1)

Papers (1)

Jun 30, 2026

Jun 30, 2026

Contrastive Regularization of Machine Learning Potentials

MSE training can yield chemically accurate potentials that still fail at sampling, but a simple contrastive correction can fix this critical issue.

Dimitrios Tzivrailis, Georgios Sotiropoulos, Alberto Rosso +1

Scientific Discovery & Drug Design