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首页 » 师资队伍 » 教师名录 » 按本科专业 » 光电信息科学与工程 » 正文

王仁海

助理研究员

  • 研究方向:1.机器学习与数据库开发 2.三元体系晶体结构预测 3.超导材料设计与调控
  • wangrh@gdut.edu.cn
  • 个人经历
  • 科研项目
  • 代表性论文著作
  • 教学工作
  • 招生信息
王仁海,广东工业大学物理与光电工程学院硕士生导师,主要从事新材料结构预测与设计研究。2021年于中国科学技术大学获凝聚态物理博士学位,其中2016-2020于美国埃姆斯国家实验室联合培养。2021年5月至2023年5月,于广东工业大学与埃姆斯实验室做联合培养博士后。2023年6月起,在广东工业大学物理与光电工程学院工作。主持国家自然科学青年基金、广东省自然科学基金等项目,在Physical Review B、npj Computational Materials、Inorganic Chemistry等期刊发表SCI论文30余篇。开发了机器学习辅助自适应遗传算法(ML+AGA)和电声耦合高通量计算方法,成功预测多个新型超导、磁性及电极材料,部分成果已获实验验证。
1.国家自然科学基金委员会, 青年科学基金项目(C类), 12504069, 基于电声耦合与自旋涨落协同机制的三元金属硼化物超导体高通量预测, 2026-01-01至2028-12-31,30万元,在研,主持 2.广东省基础与应用基础研究基金委员会,区域联合基金-青年基金项目,2021A1515110328,碱金属镍硼化物的结构预测与性能计算,2021-10至2024-09,10万元,结题,主持 3.广东省基础与应用基础研究基金委员会,广东省自然科学基金-面上项目,2022A1515012174,三元锂-3d过渡金属硼化物的晶体结构预测,2022-01至2024-12,10万元,结题,主持 4.广东省财政厅,广东省青年优秀科研人才国际培养计划博士后项目,非六方二维硼化物超导体的晶体结构预测,2022-03至2023-03,40万元,结题,主持 国家自然科学基金委员会, 面上项目, 12074362, 固体氧化物电解池阴极反应动力学与多物理场建模仿真, 2021-01-01至2024-12-31,63万元,结题,参与
1.Wang R, Sun Y, Antropov V, Lin Z, Wang C-Z, Ho K-M. Theoretical prediction of a highly responsive material: Spin fluctuations and superconductivity in FeNiB2 system. Applied Physics Letters 2019, 115(18): 182601. 2. Wang R, Wu S, Zhang F, Zhao X, Lin Z, Wang C-Z, et al. Stabilizing the crystal structures of NaFePO4 with Li substitutions. Physical Chemistry Chemical Physics 2020, 22(25): 13975-13980. 3. Wang R, Sun Y, Gvozdetskyi V, Zhao X, Zhang F, Xu L-H, et al. Theoretical search for possible Li–Ni–B crystal structures using an adaptive genetic algorithm. Journal of Applied Physics 2020, 127(9): 094902. 4. Wang R, Sun Y, Wentzcovitch RM, Zheng F, Fang Y, Wu S, et al. Prediction of crystal structures and motifs in the Fe–Mg–O system at Earth’s core pressures. New Journal of Physics 2021, 23(6): 063050. 5. Wang R, Sun Y, Zhang F, Zheng F, Fang Y, Wu S, et al. High-Throughput Screening of Strong Electron–Phonon Couplings in Ternary Metal Diborides. Inorganic chemistry 2022, 61(45): 18154-18161. 6. Wang R, Xia W, Slade TJ, Fan X, Dong H, Ho K-M, et al. Machine learning guided discovery of ternary compounds involving La and immiscible Co and Pb elements. npj Computational Materials 2022, 8(1): 258. 7. Wang R, Zheng F, Zhang Z, Wu S, Dong H, Wang C-Z, et al. Anticorrelation between electron-phonon coupling strength and stability of ternary metal diborides. Physical Review B 2025, 111(1): 014104. 8. Sun J, Wang R, Ding Z, Zhang X, Zhang Q, Zhang B, et al. Layered Li–Co–B as a Low-Potential Anode for Lithium-Ion Batteries. Inorganic chemistry 2023, 62(21): 8136-8144. 9. Sun J, Wang R, Liang Y, Zhang B, Wu F, Dong H. Layered Na–Ni–B with Low Volume Expansion for Sodium-Ion Batteries. The Journal of Physical Chemistry C 2024, 128(20): 8161-8168. 10. Lyu W, Wang R. Fe–P networks and the Li insertion extraction induced electrochemical performance in LiFePO$_{4}$cathode materials. Ionics 2024, 30(7): 3809-3817. 11. Feng C, Liang Y, Sun J, Wang R, Sun H, Dong H. Predicting miscibility in binary compounds: a machine learning and genetic algorithm study. Physical Chemistry Chemical Physics 2025, 27(8): 4121-4128. 12. Sakurai M, Wang R, Liao T, Zhang C, Sun H, Sun Y, et al. Discovering rare-earth-free magnetic materials through the development of a database. Physical Review Materials 2020, 4(11): 114408. 13. Gvozdetskyi V, Wang R, Xia W, Zhang F, Lin Z, Ho K-M, et al. How to Look for Compounds: Predictive Screening and in situ Studies in Na−Zn−Bi System. Chemistry – A European Journal 2021, 27(64): 15954-15966. 14. Gvozdetskyi V, Bhaskar G, Batuk M, Zhao X, Wang R, Carnahan SL, et al. Computationally Driven Discovery of a Family of Layered LiNiB Polymorphs. Angewandte Chemie International Edition 2019, 58(44): 15855-15862. 15. Bhaskar G, Gvozdetskyi V, Batuk M, Wiaderek KM, Sun Y, Wang R, et al. Topochemical Deintercalation of Li from Layered LiNiB: toward 2D MBene. Journal of the American Chemical Society 2021, 143(11): 4213-4223. 16. Fang Y, Sun Y, Wang R, Zheng F, Wu S, Wang C-Z, et al. Unconventional iron-magnesium compounds at terapascal pressures. Physical Review B 2021, 104(14): 144109. 17. Gvozdetskyi V, Lee SJ, Owens-Baird B, Dolyniuk J-A, Cox T, Wang R, et al. Ternary Zinc Antimonides Unlocked Using Hydride Synthesis. Inorganic chemistry 2021, 60(14): 10686-10697. 18. Bhaskar G, Gvozdetskyi V, Carnahan SL, Wang R, Mantravadi A, Wu X, et al. Path Less Traveled: A Contemporary Twist on Synthesis and Traditional Structure Solution of Metastable LiNi12B8. ACS Materials Au 2022, 2(5): 614-625. 19. Zheng F, Sun Y, Wang R, Fang Y, Zhang F, Da B, et al. Structure and motifs of iron oxides from 1 to 3 TPa. Physical Review Materials 2022, 6(4): 043602. 20. Liao T, Xia W, Sakurai M, Wang R, Zhang C, Sun H, et al. Predicting magnetic anisotropy energies using site-specific spin-orbit coupling energies and machine learning: Application to iron-cobalt nitrides. Physical Review Materials 2022, 6(2): 024402. 21. Sun H, Zhang C, Xia W, Tang L, Wang R, Akopov G, et al. Machine Learning-Guided Discovery of Ternary Compounds Containing La, P, and Group 14 Elements. Inorganic chemistry 2022, 61(42): 16699-16706. 22. Xia W, Sakurai M, Balasubramanian B, Liao T, Wang R, Zhang C, et al. Accelerating the discovery of novel magnetic materials using machine learning–guided adaptive feedback. Proceedings of the National Academy of Sciences 2022, 119(47): e2204485119. 23. Zheng F, Sun Y, Wang R, Fang Y, Zhang F, Wu S, et al. Superconductivity in the Li-B-C system at 100 GPa. Physical Review B 2023, 107(1): 014508. 24. Liao T, Xia W, Sakurai M, Wang R, Zhang C, Sun H, et al. Magnetic iron-cobalt silicides discovered using machine-learning. Physical Review Materials 2023, 7(3): 034410. 25. Gvozdetskyi V, Rana K, Ribeiro RA, Mantravadi A, Adeyemi AN, Wang R, et al. From Layered Antiferromagnet to 3D Ferromagnet: LiMnBi-to-MnBi Magneto-Structural Transformation. Chemistry of Materials 2023, 35(8): 3236-3248. 26. Sun H, Zhang C, Tang L, Wang R, Xia W, Wang C-Z. Molecular dynamics simulation of Fe-Si alloys using a neural network machine learning potential. Physical Review B 2023, 107(22): 224301. 27. Zheng F, Zhang Z, Wu Z, Wu S, Lin Q, Wang R, et al. Prediction of ambient pressure superconductivity in cubic ternary hydrides with MH6 octahedra. Materials Today Physics 2024, 42: 101374. 28. Fang Y, Sun Y, Wang R, Zheng F, Zhang F, Wu S, et al. Structural prediction of Fe-Mg-O compounds at super-Earth's pressures. Physical Review Materials 2023, 7(11): 113602. 29. Zheng F, Sun Y, Wang R, Fang Y, Zhang F, Wu S, et al. Prediction of superconductivity in metallic boron–carbon compounds from 0 to 100 GPa by high-throughput screening. Physical Chemistry Chemical Physics 2023, 25(47): 32594-32601. 30. Liao T, Xia W, Sakurai M, Zhang C, Sun H, Wang R, et al. Machine learning-accelerated discovery of iron cobalt phosphides as rare-earth-free magnets. Physical Review Materials 2024, 8(10): 104404. 31. Xia W, Sakurai M, Liao T, Wang R, Zhang C, Sun H, et al. Machine learning assisted search for Fe–Co–C ternary compounds with high magnetic anisotropy. APL Machine Learning 2024, 2(4). 32. Peng J, Dong H, Zhang J, Wang R, Cui P, Zhang W, et al. Importance of London dispersion force in stabilizing $\mathrm{L}{\mathrm{a}}_{3}\mathrm{N}{\mathrm{i}}_{2}{\mathrm{O}}_{7}$ under hydrostatic or anisotropic pressure. Physical Review B 2024, 110(18): 184514. 33. Sun H, Zhang C, Huang J, Fan X, Xia W, Tang L, et al. Prediction of lanthanide-containing ternary compounds. Computational Materials Science 2025, 251: 113717. 34. Liang X, Peng J, Wu F, Wang R, Yang Y, Li X, et al. Thermally Induced Ion Magnetic Moment in H4O Superionic State. Crystals 2025, 15(4): 304. 35. Xu Z, Zhang J, Peng J, Zhang R, Liang Y, Dong H, et al. Layer-dependent piezoelectricity and stacking effects in 2D CdInGaS4: a first-principles study. Computational Materials Science 2025, 260: 114208. 36. Cox T, Gvozdetskyi V, Bertolami M, Osborn K, Wang R, Ribeiro RA, et al. Bridging Experiment and Theory to Reveal Compounds in K–Zn(Cd)–Bi Systems. Zeitschrift für anorganische und allgemeine Chemie 2025, 651(10): e202500049.
《量子力学》、《数学物理方法》、《计算物理》
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