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2024
- S. Menon, Y. Lysogorskiy, A. Knoll et al. From electrons to phase diagrams with machine learning potentials using pyiron based automated workflows. npj Computational Materials, 10, 261, (2024)
2022
- A. Bochkarev, Y. Lysogorskiy, S. Menon et al. Efficient parametrization of the atomic cluster expansion. Physical Review Materials, 6, 013804, (2022)
2021
- S. Menon, Y. Lysogorskiy, J. Rogal et al. Automated free-energy calculation from atomistic simulations. Physical Review Materials, 5, 103801, (2021)
- Y. Lysogorskiy, C. van der Oord, A. Bochkarev et al. Performant implementation of the atomic cluster expansion (PACE) and application to copper and silicon. npj Computational Materials, 7, 97, (2021)
2020
- S. Menon, G. Díaz Leines, R. Drautz et al. Role of pre-ordered liquid in the selection mechanism of crystal polymorphs during nucleation. The Journal of Chemical Physics, 153, 104508, (2020)
2019
- S. Menon, G. Díaz Leines, J. Rogal. Pyscal: a Python module for structural analysis of atomic environments. Journal of Open Source Software, 4, 1824, (2019)
2017
- S. Menon. Transition path sampling of seeded nucleation during solidification in nickel. (2017)