Figure9

Machine learning assisted crystal structure prediction made simple

Figure 9. Workflow of MAGUS. (A) Classical evolutionary algorithm; (B) Machine-learning CSP. Reproduced from Ref.[165]. Copyright 2023, Oxford University Press. MAGUS: Machine learning and graph theory assisted universal structure searcher; CSP: crystal structure prediction.

Journal of Materials Informatics
ISSN 2770-372X (Online)
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