居学海

男， 南京理工大学， 教授/研究员/教授级高工或同等级别

学习/工作经历

1979.9.-1983.7. 湖北师范大学化学系本科.
1983.7.-1987.9. (水利部)长江职工大学助教.
1987.9.-1990.7. 郑州大学化学系硕士研究生.
1990.7.-1994.10. 湖北师范大学化学系讲师.
1994.10.-1997.8. 郑州大学药学系讲师.
1997.9.-2000.6. 北京大学环境科学中心博士研究生.
2000.7.-2002.6. 南京理工大学博士后.
2002.6.-2004.12. 南京理工大学化工学院, 副教授.
2007.9.-2008.6. (美国)哈佛大学博士后.
2013.10.-2013.12. (美国)加州理工学院访问学者.
2005.1.-至今 南京理工大学化工学院, 教授, 博士生导师.

研究领域和兴趣

材料物理与化学、计算材料学、分子模拟

主要业绩

主持或作为主要成员承担国家973子课题、国家自然科学基金、总装备部086专项及省部级科研课题共22项. 在Angew. Chem. Int. Ed., J. Mater. Chem., JPC, JCP, PCCP等期刊发表学术论文300余篇, 270篇被SCI收录，H-index 29。 出版学术专著1部, 译著1部. 获国防科学技术2等奖(2004年)及教育部自然科学奖2等奖(2005年)各1项. 南京理工大学优秀教材一等奖(2004)及董事会基金奖(2005)、江苏省优秀博士后(2005)。江苏省"333高层次人才培养工程"中青年科学技术带头人(2007)。江苏省优秀博士学位论文指导教师、江苏省省优秀硕士学位论文指导教师。

代表成果

1 Yang-Yang Wu, Feng-Qi Zhao, Si-Yu Xu, and Xue-Hai Ju*. Access to novel graphene-like sheet of hydroboron: First-principles investigation. Chem. Asian J., 2015, 10(2), 362–369
2 Jun Yin, Kadali Chaitanya and Xue-Hai Ju*. Structures and charge transport properties of "selenosulflower" and its selenium analogue "selflower": computer-aided design of high-performance ambipolar organic semiconductors. J. Mater. Chem. C, 2015, 3, 3472–3481 DOI:10.1039/c4tc02655a
3 Zhi-Dan Sun, Xiao-Long Fu, Hong-Jian Yu, Xue-Zhong Fan, Xue-Hai Ju*. Theoretical Study on Stabilization Mechanisms of Nitrate Esters Using Aromatic Amines as Stabilizers. J. Hazard. Mater., 2017, 339, 401−408
4 Zheng Mei, Qi An, Feng-Qi Zhao, Si-Yu Xu and Xue-Hai Ju*. Reactive molecular dynamics simulation of thermal decomposition for nano-aluminized explosives. Phys. Chem. Chem. Phys., 2018, 20, 29341–29350 DOI: 10.1039/c8cp05006f
5 Liang Song, Si-Yu Xu, Feng-Qi Zhao, Xue-Hai Ju*. Atomistic insight into shell-core evolution of aluminum nanoparticles in reaction with gaseous oxides at high temperature. J. Mater. Sci., 2020, 55, 14858–14872 https://doi.org/10.1007/s10853-020-05062-y
6 Liang Song, Feng-Qi Zhao, Si-Yu Xu, Xue-Hai Ju*. Atomic origin of the morphological evolution of aluminum hydride (AlH3) nanoparticles during oxidation using reactive force field simulations. Appl. Surf. Sci., 2020, 519, 146249 https://doi.org/10.1016/j.apsusc.2020.146249
7 Rui-Kang Dong, Zheng Mei, Feng-Qi Zhao, Si-Yu Xu, Xue-Hai Ju*. Initial oxidation of nano-aluminum particles by H2O/H2O2: Molecular dynamics simulation. Int. J. Hydrogen Energ., 2021, 46, 1234–1245 https://doi.org/10.1016/j.ijhydene.2020.09.164
8 Liang Song, Si-Yu Xu, Feng-Qi Zhao, Xue-Hai Ju*. Atomistic insight into dehydrogenation and oxidation of aluminum hydride nanoparticles (AHNPs) in reaction with gaseous oxides at high temperature. International Journal of Hydrogen Energy, 2021, 46(11), 8091−8103. https://doi.org/10.1016/j.ijhydene.2020.12.002
9 Liang Song, Feng-Qi Zhao, Si-Yu Xu, Xue-Hai Ju*. Encapsulated aluminum nanoparticles into carbon nanotubes for combustion: A molecular dynamics study. Phys. Chem. Chem. Phys., 2021, 23, 11886−11892 https:/doi.org/10.1039/D1CP01135A
10 Ying Zhao, Feng-Qi Zhao, Si-Yu Xu, Xue-Hai Ju*. Atomic perspectives revealing the evolution behavior of aluminum nanoparticles in energetic materials. Appl. Surf. Sci., 2021, 563, 150296 https://doi.org/10.1016/j.apsusc.2021.150296

*以上信息由高级会员个人更新和维护。