Machine Learning for Material Science (a biased introduction)
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Stefano de Gironcoli Scuola Internazionale Superiore di Studi Avanzati Trieste-Italy Machine Learning for Material Science Machine Learning for Material Science Machine Learning for Material Science (a biased introduction)
Transcript of Machine Learning for Material Science (a biased introduction)
Stefano de GironcoliScuola Internazionale Superiore di Studi Avanzati
Trieste-Italy
Machine Learning for Material ScienceMachine Learning
for Material ScienceMachine Learning
for Material Science
(a biased introduction)
Yusuf Shaidu SISSA PhD 2020
1G: global descriptor of specific molecules2G: local descriptors via Symmetry Functions3G: long-range added via locally learned charges
4G: long-range charge determined via equilibration
arXiv 2009.06484v1
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