CORC

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CORC

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First-principles study of phase transition of BaF2 under high pressue 期刊论文
ACTA PHYSICA SINICA, 2022, 卷号: 71, 期号: 1, 页码: 8
作者:  Tian Cheng;  Lan Jian-Xiong;  Wang Cang-Long;  Zhai Peng-Fei;  Liu Jie
收藏  |  浏览/下载：17/0  |  提交时间：2022/04/11
Many-core acceleration of the first-principles all-electron quantum perturbation calculations 期刊论文
COMPUTER PHYSICS COMMUNICATIONS, 2021, 卷号: 267, 页码: 8
作者:  Shang, Honghui;  Duan, Xiaohui;  Li, Fang;  Zhang, Libo;  Xu, Zhiqian
收藏  |  浏览/下载：49/0  |  提交时间：2021/12/01
Controlled synthesis and Raman study of a 2D antiferromagnetic P-type semiconductor: alpha-MnSe dagger 期刊论文
NANOSCALE, 2021, 页码: 12
作者:  Li, Ningning;  Zhu, Leilei;  Shang, Honghui;  Wang, Feng;  Zhang, Yu
收藏  |  浏览/下载：21/0  |  提交时间：2021/12/01
Efficient parallel linear scaling method to get the response density matrix in all-electron real-space density-functional perturbation theory 期刊论文
COMPUTER PHYSICS COMMUNICATIONS, 2021, 卷号: 258, 页码: 11
作者:  Shang, Honghui;  Liang, WanZhen;  Zhang, Yunquan;  Yang, Jinlong
收藏  |  浏览/下载：149/0  |  提交时间：2021/12/01
Theoretical studies on the hydrous lower mantle and D″ layer minerals 期刊论文
Earth and Planetary Science Letters, 2019, 卷号: 525, 页码: 1-12
作者:  Jiajun Jiang;Feiwu Zhang
收藏  |  浏览/下载：1/0  |  提交时间：2020/10/27
First-principles investigation of the effect of crystal structure on sulfur isotope fractionation in sulfide polymorphs 期刊论文
EUROPEAN JOURNAL OF MINERALOGY, 2018, 卷号: 30, 期号: 6, 页码: 1047-1061
作者:  Liu, Shanqi;  Li, Yongbing;  Liu, Jie;  Gao, Tian;  Guo, Yang
收藏  |  浏览/下载：46/0  |  提交时间：2019/03/04
First-principles calculations of sulphur isotope fractionation in MX2 minerals, with M = Fe, Co, Ni and X-2 = AsS, SbS 期刊论文
CHEMICAL GEOLOGY, 2016, 卷号: 441, 页码: 204-211
作者:  Liu, Shanqi;  Li, Yongbing;  Gong, Hujun;  Chen, Caiyun;  Liu, Jianming
收藏  |  浏览/下载：24/0  |  提交时间：2017/11/21
Structure, elastic and piezoelectric properties of a(3)bo(7) (a = ga, al; b = p, as) compounds: a dft study 期刊论文
Computational materials science, 2015, 卷号: 106, 页码: 1-4
作者:  Ren, Jing;  Ma, Zuju;  He, Chao;  Sa, Rongjian;  Li, Qiaohong
收藏  |  浏览/下载：29/0  |  提交时间：2019/05/10
First-principles study of sulfur isotope fractionation in pyrite-type disulfides 期刊论文
AMERICAN MINERALOGIST, 2015, 卷号: 100, 期号: 1, 页码: 203-208
作者:  Liu, Shanqi;  Li, Yongbing;  Liu, Jianming;  Shi, Yaolin
收藏  |  浏览/下载：21/0  |  提交时间：2018/09/26
First-principles study of sulfur isotope fractionation in pyrite-type disulfides 期刊论文
AMERICAN MINERALOGIST, 2015, 卷号: 100, 期号: 1, 页码: 203-208
作者:  Liu, Shanqi;  Li, Yongbing;  Liu, Jianming;  Shi, Yaolin
收藏  |  浏览/下载：18/0  |  提交时间：2018/09/26

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