地址：湖北省荊州市荊州區南環路1号 電話：0716-8060650
發布時間：2020-11-27 11:17:24閱讀次數：
向東 職稱：講師 博導/碩導：碩士生導師 學科專業：計算化學 研究方向：高能量密度化合物性能及構築模拟研究/高能氣體在石油開發中的應用 聯系方式：xiangdong@yangtzeu.edu.cn 湖北仙桃人，博士，講師。近年來，湖北省自然科學基金青年項目1項、新疆維吾爾自治區科技廳面上項目1項、荊州市科技局科研專項1項；以第一作者/通訊發表SCI論文22篇；主講本科生《有機化學D》、《物理化學C》、《物理化學C實驗》等課程；以第一指導老師身份指導本科生獲湖北省大學生化學（化工）學術創新成果報告會二等獎1項。 個人簡曆 ●2008.09—2012.07 永利6774app手机版官网，化學（師範），學士●2012.09—2015.03 南京理工大學，化學工程，碩士●2015.04—2018.06 南京理工大學，化學工程與技術，博士●2018.07—至今 永利6774app手机版官网，永利6774app手机版官网，講師 主要研究項目 (1) 湖北省科技廳, 青年項目, 2022CFB634, CL-20基主客體複合物炸藥性能及構築的理論研究, 2022-10 至 今, 5萬元, 主持 (2) 新疆維吾爾自治區科技廳, 面上項目, 2022D01A329, 吉木薩爾頁岩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, 炸藥對頁岩氣儲層改造機理的理論研究, 2022-10 至 2023- 06, 4萬元, 主持 學術論文（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. 學術會議 ●2019.11, 含能材料前言及交叉科學高端論壇暨第四屆先進含能材料國際學術研讨會，四川成都出版著作
向東
職稱：講師
博導/碩導：碩士生導師
學科專業：計算化學
研究方向：高能量密度化合物性能及構築模拟研究/高能氣體在石油開發中的應用
聯系方式：xiangdong@yangtzeu.edu.cn
湖北仙桃人，博士，講師。近年來，湖北省自然科學基金青年項目1項、新疆維吾爾自治區科技廳面上項目1項、荊州市科技局科研專項1項；以第一作者/通訊發表SCI論文22篇；主講本科生《有機化學D》、《物理化學C》、《物理化學C實驗》等課程；以第一指導老師身份指導本科生獲湖北省大學生化學（化工）學術創新成果報告會二等獎1項。
個人簡曆
●2008.09—2012.07 永利6774app手机版官网，化學（師範），學士
●2012.09—2015.03 南京理工大學，化學工程，碩士
●2015.04—2018.06 南京理工大學，化學工程與技術，博士
●2018.07—至今 永利6774app手机版官网，永利6774app手机版官网，講師
主要研究項目
(1) 湖北省科技廳, 青年項目, 2022CFB634, CL-20基主客體複合物炸藥性能及構築的理論研究, 2022-10 至 今, 5萬元, 主持
(2) 新疆維吾爾自治區科技廳, 面上項目, 2022D01A329, 吉木薩爾頁岩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, 炸藥對頁岩氣儲層改造機理的理論研究, 2022-10 至 2023- 06, 4萬元, 主持
學術論文（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.
學術會議
●2019.11, 含能材料前言及交叉科學高端論壇暨第四屆先進含能材料國際學術研讨會，四川成都出版著作
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