An AIMD plus U simulation of low-energy displacement events in UO2

Jiang, M; Gong, HF; Zhou, BR; Xiao, HY; Zhang, HB; Liu, ZJ; Zu, XT

Xiao, HY (corresponding author), Univ Elect Sci & Technol China, Sch Phys, Chengdu 610054, Peoples R China.; Zhang, HB (corresponding author), China Acad Engn Phys, Inst Nucl Phys & Chem, Mianyang 621900, Sichuan, Peoples R China.

JOURNAL OF NUCLEAR MATERIALS, 2020; 540 ():

Abstract

In UO2, due to the existence of U 5f electrons, the strong-correlation effects are significant, and correction of on-site Coulomb interaction is neces......

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