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Machine Learning-Based Prediction of Crystal Systems and Space Groups from Inorganic Materials Compositions

[Image: see text] Structural information of materials such as the crystal systems and space groups are highly useful for analyzing their physical properties. However, the enormous composition space of materials makes experimental X-ray diffraction (XRD) or first-principle-based structure determinati...

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Detalles Bibliográficos
Autores principales: Zhao, Yong, Cui, Yuxin, Xiong, Zheng, Jin, Jing, Liu, Zhonghao, Dong, Rongzhi, Hu, Jianjun
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2020
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7045551/
https://www.ncbi.nlm.nih.gov/pubmed/32118175
http://dx.doi.org/10.1021/acsomega.9b04012