1.王宗國(guó), 郭令舉, 萬(wàn)萌, 李凱, 劉志威, 郭佳龍, “基于單元素?fù)诫s的TiO2光催化材料數(shù)據(jù)庫(kù)”，中國(guó)科學(xué)數(shù)據(jù), 2021,6(1).
2. Zongguo Wang, Xiaoyu Yang, Ligen Wang, Juan Wang, Mingming Zhang, Xushan Zhao, Jie Ren, and Zhi Zeng. “CE Screen: An energy-based structure screening automatic workflow”, Computational Materials Science, 143(2018):55-62.
3. Zongguo Wang, Shaojing Qin, and Chuilin Wang, “Properties of single-layer graphene with supercell doped by one defect only”, International Journal of Modern Physics B, 31(2017):1750196.
4. Zong-Guo Wang, Xiao-Yu Yang, Shao-Jing Qin, and Chui-Lin Wang, “Properties of Single-Layer Boron Sheets: First-Principle through MatCloud Platform*”, Communications in Theoretical Physics, 68(2017):125-130.
5. Xiaoyu Yang, Zongguo Wang, Xushan Zhao, Jianlong Song, Mingming Zhang, Haidong Liu, “MatCloud: A high-throughput computational infrastructure for integrated management of materials simulation, data and resources”, Computational Materials Science, 146 (2018): 319-333.
6. Chen Ling, Qiancheng Wang, Xiaoqian Wang, Zhengjing Zhao, Zongguo Wang, Jingbo Li, Yongjie Zhao, Haibo Jin. “Hole Dopants Disentangling Peierls-Mott Relevance States of VO2 by First-Principles Calculation”, The Journal of Physical Chemistry C, 156(2021)10:5816-5823.
7. 郭佳龍, 王宗國(guó), 王彥棡, 趙旭山, 宿彥京, 劉志威, “基于計(jì)算機(jī)技術(shù)的材料研發(fā)方法概述”, 數(shù)據(jù)與計(jì)算發(fā)展前沿，2021, 3(2):120-132.
8. Qianchen Wang, Chen Ling, Jingbo Li, Hongcai Gao, Zongguo Wang, Haibo Jin. “Experimental and theoretical investigation of Na4MnAl(PO4)3 cathode material for sodium-ion batteries”, Chemical Engineering Journal, 425(2021):130680.
