Machine-learned interatomic potentials for alloys and alloy phase diagrams

Rosenbrock, Conrad W; Gubaev, Konstantin; Shapeev, Alexander V; Pártay, Livia B; Bernstein, Noam; Csányi, Gábor; Hart, Gus LW

by Conrad W Rosenbrock, Konstantin Gubaev, Alexander V Shapeev, Livia B Pártay, Noam Bernstein, Gábor Csányi, Gus LW Hart

Reference:

Machine-learned interatomic potentials for alloys and alloy phase diagrams (Conrad W Rosenbrock, Konstantin Gubaev, Alexander V Shapeev, Livia B Pártay, Noam Bernstein, Gábor Csányi, Gus LW Hart), npj Computational Materials, Nature Publishing Group, volume 7, 2021.

Bibtex Entry:

@article{rosenbrock2021-nested-sampling,
  title={Machine-learned interatomic potentials for alloys and alloy phase diagrams},
  author={Rosenbrock, Conrad W and Gubaev, Konstantin and Shapeev, Alexander V and P{\'a}rtay, Livia B and Bernstein, Noam and Cs{\'a}nyi, G{\'a}bor and Hart, Gus LW},
  journal={npj Computational Materials},
  volume={7},
  number={1},
  pages={1--9},
  year={2021},
  publisher={Nature Publishing Group}
}