Zobrazeno 1 - 10
of 808
pro vyhledávání: '"Liu Hai Feng"'
The $f$-electron materials have many unique properties under pressure, thus of great interest in high-pressure physics and related industrial fields. However, the $f$-electrons pose a substantial challenge to simulations since the electron correlatio
Externí odkaz:
http://arxiv.org/abs/2410.09498
Autor:
Chen, Zi-Hang, Sheng, Jie, Liu, Yu, Shi, Xiao-Ming, Huang, Houbing, Xu, Ke, Wang, Yue-Chao, Wu, Shuai, Sun, Bo, Liu, Hai-Feng, Song, Hai-Feng
Publikováno v:
Chin. Phys. B, 2024, 33(4): 048201
Hydride precipitation in zirconium cladding materials can damage their integrity and durability.Service temperature and material defects have a significant effect on the dynamic growth of hydrides. In this study, we have developed a phase field model
Externí odkaz:
http://arxiv.org/abs/2311.03162
Autor:
Jia Jun Guo, Xing Jian Xu, Song Jin Hai, Xiao Chao Yun, Jia Jun, Liu Hai Feng, Zheng Song Song
Publikováno v:
E3S Web of Conferences, Vol 256, p 01011 (2021)
Electric vessels have developed rapidly with the advancement of transportation electrification in recent years. The power battery capacity of large vessels usually reaches several MWhs, in which case battery change technology is more applicable. A ve
Externí odkaz:
https://doaj.org/article/ead87d53279e4a55b3d21c251c02c653
Publikováno v:
J. Phys. Chem. Lett. 2023, 14, 8930
Strongly correlated systems containing d/f-electrons present a challenge to conventional density functional theory (DFT), such as the widely used local density approximation (LDA) or generalized gradient approximation (GGA). In this work, we develope
Externí odkaz:
http://arxiv.org/abs/2307.07745
Autor:
Sheng, Jie, Liu, Yu, Shi, Xiao-Ming, Wang, Yue-Chao, Chen, Zi-Hang, Xu, Ke, Wu, Shuai, Huang, Hou-Bing, Sun, Bo, Liu, Hai-Feng, Song, Hai-Feng
Publikováno v:
Comp. Mater. Sci. 235 (2024) 112779
Hydrogen-induced multi-spot corrosion on the surface of polycrystalline rare metals is a complex process, which involves the interactions between phases (metal, hydride and oxide), grain orientations, grain boundaries, and corrosion spots. To accurat
Externí odkaz:
http://arxiv.org/abs/2306.16920
Autor:
Liu, Bei-Lei, Wang, Yue-Chao, Liu, Yu, Xu, Yuan-Ji, Chen, Xin, Song, Hong-Zhou, Bi, Yan, Liu, Hai-Feng, Song, Hai-Feng
Publikováno v:
J. Chem. Phys. 158 (2023) 084108
As correlation strength has a key influence on the simulation of strongly correlated materials, many approaches have been proposed to obtain the parameter using first-principles calculations. However, the comparison of the different Coulomb strengths
Externí odkaz:
http://arxiv.org/abs/2211.16260
Publikováno v:
In Ocean Engineering 15 November 2024 312 Part 3
Autor:
Sheng, Jie, Wang, Yue-Chao, Liu, Yu, Wu, Shuai, Xu, Ke, Chen, Zi-Hang, Sun, Bo, Liu, Hai-Feng, Song, Hai-Feng
Publikováno v:
Comp. Mater. Sci. 213 (2022) 111663
Hydrogen-induced pitting corrosion of metallic is a common phenomenon that damages the integrity and durability of the materials. Its numerical simulation is still a challenge due to many complex mechanisms, especially solid-solid phase transformatio
Externí odkaz:
http://arxiv.org/abs/2203.07289
Autor:
Liu, Hai-Feng1 (AUTHOR), Wang, Ya-Yu2 (AUTHOR), Zhang, Xue-Zu3 (AUTHOR), Li, He-Yun4 (AUTHOR), Xiang, Mei5 (AUTHOR), Lu, Rui6 (AUTHOR), Liu, Cong-Yun7 (AUTHOR), Li, Wang8 (AUTHOR), Feng, Quan-Li1 (AUTHOR), Guo, Yun-Jie1 (AUTHOR), Huang, Rong-Wei1 (AUTHOR), Fu, Hong-Min1 (AUTHOR) fuhongmin@kmmu.edu.cn
Publikováno v:
BMC Infectious Diseases. 9/19/2024, Vol. 24 Issue 1, p1-12. 12p.
Autor:
Wang, Yue-Chao, Liu, Bei-Lei, Liu, Yu, Liu, Hai-Feng, Bi, Yan, Gao, Xing-Yu, Sheng, Jie, Song, Hong-Zhou, Tian, Ming-Feng, Song, Hai-Feng
Density functional theory plus $U$ (DFT+$U$) is one of the most efficient first-principles methods to simulate the cold pressure properties of strongly-correlated materials. However, the applicability of DFT+$U$ at ultra-high pressure is not sufficie
Externí odkaz:
http://arxiv.org/abs/2111.12863