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邱潇乐

理论计算

发布时间:2025-02-20


邱潇乐,副教授,毕业于中国人民大学,获博士学位,主要研究方向为第一性原理计算。

 

参与项目与获奖:

国家自然科学基金,面上项目:铁基超导材料表面磁性质的计算研究,61万元,2022.01-2025.12(排名第二)

国家自然科学基金,青年项目:电子化合物衬底调控二维材料电子和超导性质的理论研究30万元,2024.01-2026.12(主持)

山东省自然科学,青年项目:电子化合物对二维材料磁性质调控的理论研究15万元,2024.01-2026.12(主持)

山东省高等学校青创团队计划:二维材料光电调控及新物性研究创新团队12万元,2024.01-2026.12(主持)

 

发表论文

1. Xiao-Le Qiu, Jian-Feng Zhang, Zhong-Yi Lu*, and Kai Liu*, Manipulating the Electronic and Magnetic Properties of Monolayer Electride Ca2N by Hydrogenation., J. Phys. Chem. C 123, 2469824704 (2019)

2. Xiao-Le Qiu, Ben-Chao Gong, Huan-Cheng Yang, Zhong-Yi Lu*, and Kai Liu*, LaO as a candidate substrate for realizing superconductivity in an FeSe epitaxial film, Phys. Rev. B 103, 035143 (2021)

3. Xiao-Le Qiu, Jian-Feng Zhang, Ben-Chao Gong, Huan-Cheng Yang, Zhong-Yi Lu*, and Kai Liu*, Modulating charge density wave states in TaSe2 by an electride substrate, Phys. Rev. B 104, 165109 (2021)

4. Xiao-Le Qiu, Jian-Feng Zhang, Huan-Cheng Yang, Zhong-Yi Lu, and Kai Liu*, Superconductivity in monolayer Ba2N electride: First-principles study, Phys. Rev. B 105, 165101 (2022)

5. Xihui Wang, Xiaole Qiu, Chang Sun, Xinyu Cao, Yujie Yuan, Kai Liu*, and Xiao Zhang*, Layered Transition Metal Electride Hf2Se with Coexisting Two-Dimensional Anionic d-Electrons and Hf–Hf Metallic Bonds, Chin. Phys. Lett. 38, 017302 (2021)

6. Long Chen, Linlin Zhao, Xiaole Qiu, Qinghua Zhang, Kai Liu, Qisheng Lin,* and Gang Wang*, Quasi-One-Dimensional Structure and Possible Helical Antiferromagnetism of RbMn6Bi5, Inorg. Chem. 60, 1294112949 (2021)

7. Qi Wang, Xiao-Le Qiu, Cuiying Pei, Ben-Chao Gong, Lingling Gao, Yi Zhao, Weizheng Cao, Changhua Li, Shihao Zhu, Mingxin Zhang, Yulin Chen, Kai Liu, and Yanpeng Qi∗, Superconductivity emerging from a pressurized van der Waals kagome material Pd3P2S8, New J. Phys. 25, 043001 (2023)

8. Hong-Chao Yang*, Peng-Cheng Liu, Liu-Yu Mu,Ying-De Li, Kai Han, and Xiao-Le Qiu*, Multiferroic monolayers VOX ( X= Cl, Br, I): Tunable ferromagnetism via charge doping and ferroelastic switching, Chin. Phys. B 32, 067701 (2023)

9. Xiaole Qiu, Bing Liu, Lin Ge, Lianzhen Cao, Kai Han and Hongchao Yang*, High Curie temperature ferromagnetic monolayer T-CrSH and valley physics of T-CrSH/WS2 heterostructure, Phys. Chem. Chem. Phys. 26, 5589 (2024)

10. Xiaole Qiu, Xiaoxuan Wang, Xiaolu Liu, Saifei Yuan, Kai Han, and Hongchao Yang*, Theoretical Study of the Ternary Compound Monolayer CuP2Se for Photocatalytic Water Splitting with Efficient Optical Absorption, Chem. Eur. J. 30, e202400348 (2024)

11. Xiaole Qiu, Benchao Gong, Wenjun Zhang, Bing Liu, Kai Hana and Hongchao Yang*, Regulation of the valleytronic properties in single-layer NbSeCl, Phys. Chem. Chem. Phys. 27, 1834 (2025)

 


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