Investigation on Chemical Behavior of Ni and Fe Impurities in LBE by Deep Potential Molecular Dynamics Simulation

Investigation on Chemical Behavior of Ni and Fe Impurities in LBE by Deep Potential Molecular Dynamics Simulation

The compatibility of liquid lead-bismuth eutectic (LBE) with structural materials is one of the problems in its application in advanced nuclear reactors. At present, the understanding of impurity atoms diffusion in liquid LBE is still limited. It is particularly difficult to study the chemical behav...

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Bibliographic Details
Main Author:	LIANG Ruting1,2;BO Tao2,;NIE Changming1;ZHANG Lei2;CHAI Zhifang2;SHI Weiqun3,
Format:	Article
Language:	English
Published:	Editorial Board of Atomic Energy Science and Technology 2023-12-01
Series:	Yuanzineng kexue jishu
Subjects:	lbe thermophysical property diffusion coefficient first-principle molecular dynamics machine learning

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