Journal of the Chinese Ceramic Society, Volume. 51, Issue 2, 531(2023)

Multi-Scale Simulation of Mechanical and Thermal Transport Properties of Materials Based on Machine Learning Potential

WU Jing1...2, HUANG An1, XIE Hanpeng1, WEI Donghai1, LI Aonan1, PENG Bo1, WANG Huimin3, QIN Zhenzhen4, LIU Te-huan2 and QIN Guangzhao1 |Show fewer author(s)
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  • 1[in Chinese]
  • 2[in Chinese]
  • 3[in Chinese]
  • 4[in Chinese]
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    With the development of artificial intelligence technology, machine learning atomic interaction potential has become popular to solve a problem regarding the low accuracy of empirical potential. Machine learning atomic interaction potential avoids a low efficiency of conventional fitting method for empirical potential and becomes an emerging tool for material exploration and research. This review represented the characteristics of existing machine learning potential and the applications in phase change, intrinsic properties and interface researches. In addition, the challenge and development trends of machine learning atomic interaction potential were also prospected.

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    WU Jing, HUANG An, XIE Hanpeng, WEI Donghai, LI Aonan, PENG Bo, WANG Huimin, QIN Zhenzhen, LIU Te-huan, QIN Guangzhao. Multi-Scale Simulation of Mechanical and Thermal Transport Properties of Materials Based on Machine Learning Potential[J]. Journal of the Chinese Ceramic Society, 2023, 51(2): 531

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    Paper Information

    Special Issue:

    Received: Oct. 1, 2022

    Accepted: --

    Published Online: Mar. 11, 2023

    The Author Email:

    DOI:10.14062/j.issn.0454-5648.20220826

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