9 citations · 11 across the 8 of their papers we have counts for
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Actively-trained magnetic Moment Tensor Potentials for mechanical, dynamical, and thermal properties of paramagnetic CrN
Alexey S. Kotykhov, Max Hodapp, Christian Tantardini +4
We present a protocol for automated fitting of magnetic Moment Tensor Potential explicitly including magnetic moments in its functional form. For the fitting of this potential we u…
Accelerating Structure Prediction of Molecular Crystals using Actively Trained Moment Tensor Potential
Nikita Rybin, Ivan S. Novikov, Alexander Shapeev
Inspired by the recent success of machine-learned interatomic potentials for crystal structure prediction of the inorganic crystals, we present a methodology that exploits Moment T…
Fitting to magnetic forces improves the reliability of magnetic Moment Tensor Potentials
Alexey S. Kotykhov, Konstantin Gubaev, Vadim Sotskov +4
We developed a method for fitting machine-learning interatomic potentials with magnetic degrees of freedom, namely, magnetic Moment Tensor Potentials (mMTP). The main feature of ou…