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SaveFrom electrons to phase diagrams with machine learning potentials using pyiron based automated workflows
Menon, Sarath; Lysogorskiy, Yury; Knoll, Alexander L. M.; Leimeroth, Niklas; Poul, Marvin; Qamar, Minaam; Janssen, Jan; Mrovec, Matous; Rohrer, Jochen; Albe, Karsten; Behler, Joerg; Drautz, Ralf; Neugebauer, Joerg
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SaveNon-basal plasticity in the μ-phase at room temperature
Luo, W.; Gasper, C.; Zhang, S.; Sun, P. L.; Ulumuddin, N.; Petrova, A.; Lysogorskiy, Y.; Drautz, R.; Xie, Z.; Korte-Kerzel, S.
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SavePerformant implementation of the atomic cluster expansion (PACE) and application to copper and silicon
Lysogorskiy, Yury; Oord, Cas van der; Bochkarev, Anton; Menon, Sarath; Rinaldi, Matteo; Hammerschmidt, Thomas; Mrovec, Matous; Thompson, Aidan; Csanyi, Gabor; Ortner, Christoph; Drautz, Ralf
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SaveCrowd-sourcing materials-science challenges with the NOMAD 2018 Kaggle competition
Sutton, Christopher; Ghiringhelli, Luca M.; Yamamoto, Takenori; Lysogorskiy, Yury; Blumenthal, Lars; Hammerschmidt, Thomas; Golebiowski, Jacek R.; Liu, Xiangyue; Ziletti, Angelo; Scheffler, Matthias
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