職稱：講師

博導(dǎo)/碩導(dǎo)：碩士生導(dǎo)師

學(xué)科專業(yè)：計算化學(xué)

研究方向：高能量密度化合物性能及構(gòu)筑模擬研究/高能氣體在石油開發(fā)中的應(yīng)用

聯(lián)系方式：[email protected]

湖北仙桃人，博士，講師。近年來，湖北省自然科學(xué)基金青年項目1項、新疆維吾爾自治區(qū)科技廳面上項目1項、荊州市科技局科研專項1項；以第一作者/通訊發(fā)表SCI論文22篇；主講本科生《有機化學(xué)D》、《物理化學(xué)C》、《物理化學(xué)C實驗》等課程；以第一指導(dǎo)老師身份指導(dǎo)本科生獲湖北省大學(xué)生化學(xué)（化工）學(xué)術(shù)創(chuàng)新成果報告會二等獎1項。

個人簡歷

●2008.09—2012.07 長江大學(xué)，化學(xué)（師范），學(xué)士

●2012.09—2015.03 南京理工大學(xué)，化學(xué)工程，碩士

●2015.04—2018.06 南京理工大學(xué)，化學(xué)工程與技術(shù)，博士

●2018.07—至今 長江大學(xué)，beat365，講師

主要研究項目

(1) 湖北省科技廳, 青年項目, 2022CFB634, CL-20基主客體復(fù)合物炸藥性能及構(gòu)筑的理論研究, 2022-10 至 今, 5萬元, 主持

(2) 新疆維吾爾自治區(qū)科技廳, 面上項目, 2022D01A329, 吉木薩爾頁巖油的爆炸壓裂機理研究, 2022-12 至 2025-12, 10萬元, 主持

(3) 荊州市科技局, 科研專項, 2022CC54-02, 炸藥對頁巖氣儲層改造機理的理論研究, 2022-10 至 2023- 06, 4萬元, 主持

學(xué)術(shù)論文（第一作者/通訊作者）

●Zhou, M., Ye, C., Xiang, D.* Theoretical Studies on the Role of Guest in α-CL-20/Guest Crystals. Molecules, 27 (2022), 3266.

●Zhou M M, Xiang D.* Theoretical Prediction of Structures and Properties of 2, 4, 6-Trinitro-1, 3, 5-Triazine (TNTA) Green Energetic Materials from DFT and ReaxFF Molecular Modeling[J]. Materials, 15 (2022), 3873.

●Xiang, D.*, Xie, X., Yao, P. Atomistic Insight into Thermal Decomposition of 1, 3, 5‐Triamino‐2, 4, 6‐trinitrobenzene Nanoparticles According to the ReaxFF Molecular Dynamics Method. ChemistrySelect, 7 (2022), e202102465.

●Dong Xiang, Weihua Zhu.* Heming Xiao. Initial Decomposition Reactions of Dihydrazinium 3,3’-dinitro-5,5’-bis-1,2,4-triazole-1,1-diolate from Quantum Molecular Dynamics Simulations. Fuel, 202 (2017) 246–259. 

●Dong Xiang, Weihua Zhu.* Thermal Decompositions of Crystalline 4,10-Dinitro-2,6,8,12- tetraoxa-4,10- diazaisowutrzitane from Ab Initio Molecular Dynamics Simulations. RSC Adv., 7 (2017) 8347-8356.

●Dong Xiang, Weihua Zhu,* and Heming Xiao. Thermal Decomposition of Energetic MOFs Nickel Hydrazine Nitrate Crystals from an ab Initio Molecular Dynamics Simulation. Comput. Mat. Sci., 143 (2018) 170-181.

●Dong Xiang, Hao Chen, Weihua Zhu,* and Heming Xiao. Searching for a new family of high energy explosives by introducing N atoms, N-oxides, and NO₂ into a cage adamantine. Can. J. Chem., 94 (2016) 667–673.

●Dong Xiang, Qiong Wu, Zhichao Liu, Weihua Zhu Zhu,* Heming Xiao. Pressure-induced changes in the structural and absorption properties of crystalline 5-nitramino-3,4-dinitropyrazole. J. Chem. Sci., 127 (2015) 1777–1784.

●Dong Xiang, Qiong Wu, Zhichao Liu, Weihua Zhu,* and Heming Xiao. Comparative DFT-D studies on structural and absorption properties of crystalline 3,3-dinitroamino-4,4-azoxyfurazan, 3,3-dinitro-4,4-azoxyfurazan, and 3,4-bis (3-nitrofurazan-4-yl) furoxan under high pressures. Can. J. Chem., 93 (2015) 1191–1198.

●Dong Xiang, Qiong Wu, Zhichao Liu, Weihua Zhu,* and Heming Xiao. DFT-D studies on structural variation and absorption properties of crystalline benzotrifuroxan under high pressure. Can. J. Chem., 92 (2014) 1131-1137. 

●Dong Xiang, Weihua Zhu*. Adiabatic and constant volume decomposition process of condensed phase δ-1, 3, 5, 7-tetranitro-1, 3, 5, 7-tetrazocane at high temperatures: Quantum molecular dynamics simulations. J. Mol. Graph. Model. 85 (2018) 68-74 . 

●Dong Xiang, Weihua Zhu*. Environmental degradability of 1, 2, 3, 4-tetrazine-1, 3-dioxide-functionalized FOX-7 derivatives with high energy and low sensitivity: a computational evaluation. Struct. Chem. 30 (2019) 327-340. 

●Dong Xiang, Weihua Zhu*. Structural and Vibrational Properties of Crystalline β‐Octahydro‐1, 3, 5, 7‐tetranitro‐1, 3, 5, 7‐tetrazocine at High Temperatures: Ab Initio Molecular Dynamics Studies. ChemistrySelect 4 (2019) 4244-4250. 

●Dong Xiang, Weihua Zhu*. Mechanisms and kinetics of initial pyrolysis and combustion reactions of 1, 1-diamino-2, 2-dinitroethylene from density functional tight-binding molecular dynamics simulations[J]. Can. J. Chem., 999 (2019) 1-10.

●Dong Xiang, Qiong Wu, and WeiHua Zhu*. Decomposition Mechanisms of Crystalline α-RDX Under High Temperature Coupled With Detonation Pressure from Ab Initio Molecular Dynamics Simulations. Chin. J. Energ. Mater., 26 (2018) 477-482.

●Dong Xiang, Qiong Wu, and WeiHua Zhu*. Ab Initio Molecular Dynamics Studies on the Decomposition Mechanisms of CL-20 Crystal under Extreme Conditions. Chin. J. Energ. Mater., 26 (2018) 59-65.

●Dong Xiang, and WeiHua Zhu*. Structural Transformations and Absorption Properties of Crystalline4,10-dinitro-2,6,8,12-tetraoxa-4,10-diazaisowurtzitane under High Pressures. AIChE 2017 annual meeting.

學(xué)術(shù)會議

●2019.11, 含能材料前言及交叉科學(xué)高端論壇暨第四屆先進(jìn)含能材料國際學(xué)術(shù)研討會，四川成都出版著作