Published July 12, 2023 | Version 1
Dataset Open

Dataset for "A general purpose potential for glassy and crystalline phases of Cu-Zr alloys based on the ACE formalism"

Authors/Creators

  • 1. TU Darmstadt

Description

This dataset was used to fit a general purpose machine learning interatomic potential for the Cu-Zr system. It supports the paper "A general purpose potential for glassy and crystalline phases of Cu-Zr alloys based on the ACE formalism".

Notes

This research was funded by the Deutsche Forschungsgemeinschaft (DFG, German Research Foundation) under grant number RO 4542/4-1. We gratefully acknowledge computing time provided by the high performance computer Lichtenberg at the NHR Center NHR4CES at TU Darmstadt.

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