Accessing complex reconstructed material structures with hybrid global optimization accelerated via on-the-fly machine learning

The complex reconstructed structure of materials can be revealed by global optimization. This paper describes a hybrid evolutionary algorithm (HEA) that combines differential evolution and genetic algorithms with a multi-tribe framework. An on-the-fly machine learning calculator is adopted to expedi...

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Detalles Bibliográficos
Autores principales: Shi, Xiangcheng, Cheng, Dongfang, Zhao, Ran, Zhang, Gong, Wu, Shican, Zhen, Shiyu, Zhao, Zhi-Jian, Gong, Jinlong
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2023
Materias:
Chemistry
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10445438/
https://www.ncbi.nlm.nih.gov/pubmed/37621421
http://dx.doi.org/10.1039/d3sc02974c

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10445438/
https://www.ncbi.nlm.nih.gov/pubmed/37621421
http://dx.doi.org/10.1039/d3sc02974c

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