- 基本情况
姓名：刘晓强
籍贯：云南昆明
邮箱：xqliu@suse.edu.cn
教育背景：本科：2006-2010、曲靖师范学院、化学化工学院、《白石江流域重金属Pb、Cd预防治理研究》
博士（硕博连读）：2010-2015、四川大学、物理化学、《非均质煤表面上煤层气的吸附作用以及CO2和CH4转化为CH3COOH的理论研究》
博士后：2017-2020、中国石油大学（北京），地球科学学院、地质学、《分子模拟在非常规天然气与其它有机地球化学研究中的应用》
目前工作单位：四川轻化工大学 化学与环境工程学院
- 学术论文
[1] 刘晓强, 李美俊, 唐友军, 朱志立, 祁灵, 师生宝, 冷筠滢, 韩秋雅, 肖洪, 有机质中三联苯成熟度参数及其化学机理:基于地球化学数据和量子化学计算, 地球化学, 49 (2020) 218-226.
[2] Q. Zhang, J. Shu, Y. Zhang, Z. Xu, J. Yue, X. Liu*, B. Xu, Z. Chen, W. Jiang*, Structures and esterolytic reactivity of novel binuclear copper(ii) complexes with reduced l-serine Schiff bases as mimic carboxylesterases, Dalton Trans, 49 (2020) 10261-10269. （IF= 4.174，二区）
[3] N. Wang, M. Li*, X. Liu*, H. Hong, X. Tian, C. Yang, S. Shi, P. Liu, Geo-chromatographic fractionation effect of methyldibenzofuran in dolomite reservoirs and its application in tracing oil filling pathways in the Sichuan Basin, Marine and Petroleum Geology, 113 (2020) 104126. （IF= 3.790，二区，被引用3次）
[4] X.-Q. Liu, M. Li, C. Zhang, R. Fang, N. Zhong, Y. Xue, Y. Zhou, W. Jiang, X.-Y. Chen, Mechanistic insight into the optimal recovery efficiency of CBM in sub-bituminous coal through molecular simulation, Fuel, 266 (2020) 117137-117154. （IF= 5.578，一区，Top期刊，被引用2次）
[5] Y. Zhou, X. Liu（共同一作）, W. Jiang, Y. Shu, Theoretical insight into reaction mechanisms of 2,4-dinitroanisole with hydroxyl radicals for advanced oxidation processes, Journal of molecular modeling, 24 (2018) 44. （IF= 1.346，四区，被引用14次）
[6] X.-Q. Liu*, X. He, N.-X. Qiu, X. Yang, Z.-Y. Tian, M.-J. Li, Y. Xue, Molecular simulation of CH4, CO2, H2O and N2 molecules adsorption on heterogeneous surface models of coal, Applied Surface Science, 389 (2016) 894-905. （IF= 6.182，二区，Top期刊，被引用60次）
[7] X.-Q. Liu, Z.-Y. Tian, W. Chu, Y. Xue, CH4, CO2 and H2O Adsorption on Nonmetallic Atom-Decorated Graphene Surfaces, Acta Physico-Chimica Sinica, 2 (2014) 251-256. （IF= 1.379，三区，被引用14次）
[8] X.-Q. Liu, Y. Xue, Z.-Y. Tian, J.-J. Mo, N.-X. Qiu, W. Chu, H.-P. Xie, Adsorption of CH4 on nitrogen- and boron-containing carbon models of coal predicted by density-functional theory, Applied Surface Science, 285 (2013) 190-197. （IF= 6.182，二区，Top期刊，被引用55次）
[9] X.-Q. Liu, L. Jin, C.K. Kim, Y. Xue, Role of bifunctional catalyst 2-pyridone in the aminolysis of p-nitrophenyl acetate with n-butylamine: A computational study, Journal of Molecular Catalysis A: Chemical, 355 (2012) 102-112. （IF= 5.008，二区，被引用12次）
[10] X. Liu, C. Zhou, H. Xia, Y. Zhou, W. Jiang, Dissipative particle dynamics simulation on the self-assembly of linear ABC triblock copolymers under rigid spherical confinements, e-Polymers, 17 (2017) 321-331. （IF= 3.790，四区，被引用3次）
[11] X. Zhang, Q. Zhang, B. Xu, X. Liu, K. Zhang, G. Fan, W. Jiang, Efficient Hydrogen Generation from the NaBH4 Hydrolysis by Cobalt-Based Catalysts: Positive Roles of Sulfur-Containing Salts, ACS Applied Materials & Interfaces, 12 (2020) 9376-9386.
[12] W.-Y. Mou, T. Li, B. Xie, D.-L. Zhang, C. Lai, C.-L. Deng, J.-X. Cao, X.-X. Bai, X.-Q. Liu, Neutral heteroleptic nickel complexes incorporating maleonitriledithiolate and bis(diphenylphosphanyl)amine as robust molecular electrocatalysts for hydrogen evolution, Inorganica Chimica Acta, 507 (2020) 119587.
[13] Q. Han, M. Li, X. Liu, W. Jiang, S. Shi, Y. Tang, D. He, Fractionation of alkylated carbazoles in petroleum during subsurface migration: Evidence from molecular simulation and application in sandstone reservoirs, Journal of Petroleum Science and Engineering, (2020) 107308.
[14] Z. Zhu, M. Li, Y. Tang, L. Qi, J. Leng, X. Liu, H. Xiao, Identification of phenyldibenzothiophenes in coals and the effects of thermal maturity on their distributions based on geochemical data and theoretical calculations, Organic Geochemistry, (2019) 103910.
[15] Y. Zhou, X. Liu, W. Jiang, Y. Shu, G. Xu, A theoretical insight into the reaction mechanisms of a 2,4,6-trinitrotoluene nitroso metabolite with thiols for toxic effects, Toxicology Research, 8 (2019) 270-276.
[16] F. Zhang, X. Liu, X. He, J. Zhao, W. Chu, Y. Xue, A periodic density functional theory study of adsorption of CO2 on anorthite (001) surface and effect of water, Journal of Theoretical and Computational Chemistry, 18 (2019) 1950010.
[17] S. Yang, M. Li, X. Liu, Q. Han, J. Wu, N. Zhong, Thermodynamic stability of methyldibenzothiophenes in sedimentary rock extracts: Based on molecular simulation and geochemical data, Organic Geochemistry, 129 (2019) 24-41.
[18] H. Xiao, M. Li, W. Wang, B. You, X. Liu, Z. Yang, J. Liu, Q. Chen, M. Uwiringiyimana, Identification, distribution and geochemical significance of four rearranged hopane series in crude oil, Organic Geochemistry, (2019) 103929.
[19] M. Li, X. Liu, T.G. Wang, W. Jiang, R. Fang, L. Yang, Y. Tang, Fractionation of dibenzofurans during subsurface petroleum migration: Based on molecular dynamics simulation and reservoir geochemistry, Organic Geochemistry, 115 (2018) 220-232.
[20] W. Jiang, B. Xu, G. Fan, K. Zhang, Z. Xiang, X. Liu, UV Light-Assisted Synthesis of Highly Efficient Pd-Based Catalyst over NiO for Hydrogenation of o-Chloronitrobenzene, Nanomaterials, 8 (2018) 240.
[21] S. Geng, X. Sang, X. Liu, Y. Ren, Y. Xue, A theoretical study of UV-Vis spectrum and antioxidant activity of chryso-obtusin, Journal of Theoretical and Computational Chemistry, 17 (2018) 1850015.
[22] Y. Zhou, Z. Yang, H. Yang, C. Zhang, X. Liu, Reaction mechanisms of DNT with hydroxyl radicals for advanced oxidation processes-a DFT study, Journal of molecular modeling, 23 (2017) 139.
[23] L. Yang, M. Li, T.G. Wang, X. Liu, W. Jiang, R. Fang, H. Lai, Phenyldibenzofurans and Methyldibenzofurans in Source Rocks and Crude Oils, and Their Implications for Maturity and Depositional Environment, Energy & Fuels, 31 (2017) 2513-2523.
[24] L. Yang, M. Li, X. Liu, W. Jiang, C. Yang, H. Lai, P. Kang, Using Connolly surface to characterize the adsorption of methyldibenzothiophenes, and their chemical mechanism as molecular tracer for oil filling pathways, Geochimica, 46 (2017) 367-372.
[25] B. Xu, W. Jiang, X. Liu, F. Liu, Z. Xiang, Remarkable reactivity of alkoxide/acetato-bridged binuclear copper(II) complex as artificial carboxylesterase, Journal of Biological Inorganic Chemistry, 22 (2017) 625-635.
[26] Y. Liu, K. Zhang, W. Jiang, Y. Yang, Y. Jiang, X. Liu, Y. Xie, J. Wu, J. Cai, X.-H. Xu, Synthesis of 1-Difluoroalkylated Isoquinolines via Palladium-Catalyzed Radical Cascade Difluoroalkylation-Cyclization of Vinyl Isocyanides with Bromodifluoroacetic Derivatives, Chemistry-an Asian Journal, 12 (2017) 568-576.
[27] R. Fang, M. Li, T.G. Wang, X. Liu, Y. Yuan, W. Jiang, D. Wang, S. Shi, Trimethyldibenzothiophenes: Molecular tracers for filling pathways in oil reservoir, Journal of Petroleum Science and Engineering, 159 (2017) 451-460.
[28] Y. Zhou, W. Sun, W. Chu, X. Liu, F. Jing, Y. Xue, Theoretical insight into the enhanced CH4 desorption via H2O adsorption on different rank coal surfaces, Journal of Energy Chemistry, 25 (2016) 677-682.
[29] Y. Yang, L. Xu, S. Yu, X. Liu, Y. Zhang, D.A. Vicic, Triphenylphosphine-Mediated Deoxygenative Reduction of CF3SO2Na and Its Application for Trifluoromethylthiolation of Aryl Iodides, Chemistry – A European Journal, 22 (2016) 858-863.
[30] Y. Liu, K. Zhang, Y. Huang, S. Pan, X.-Q. Liu, Y. Yang, Y. Jiang, X.-H. Xu, Synthesis of 3-fluoroalkenyl-3-trifluoromethyl-2-oxindoles by the reaction of indoline-2,3-diones with difluoromethylene phosphabetaine, Chemical Communications, 52 (2016) 5969-5972.
[31] B. Lempert David, M. Dorofeenko Ekaterina, Y. Shu, W. Jiang, Z. Wu, K. Wang, X. Liu, Energetic Opportunities of Solid Composite Propellants Containing Some Hypothetic Furazano-[3,4-d]-pyridazine-based Derivatives, Chinese Journal of Explosives & Propellants, 39 (2016) 28-34.
[32] W. Jiang, B. Xu, Z. Xiang, X. Liu, F. Liu, Preparation and reactivity of UV light-reduced Pd/α-Fe2O3 catalyst towards the hydrogenation of o-chloronitrobenzene, Applied Catalysis A: General, 520 (2016) 65-72.
[33] 何旭, 刘晓强, 何冰, 王晗光, 刘旭东, 田之悦, 储伟, 薛英, 煤层气在含 Al, Si, P 和 S 煤结构模型上吸附的密度泛函理论研究, 高等学校化学学报, 36 (2015) 1786-1793.
[34] D. Wu, W. Jiang, X. Liu, N. Qiu, Y. Xue, Theoretical study about effects of H2O and Na+ on adsorption of CO2 on kaolinite surfaces, Chemical Research in Chinese Universities, 32 (2015) 118-126.
[35] W. Zhu, X.-Q. Liu, X. Hou, J. Chen, C.K. Kim, K. Xu, Modelling of catalytically oxidative decomposition of carbon tetrachloride on a ZnS nanocluster using density functional theory, Catalysis Science & Technology, 4 (2014) 1038-1046.
[36] Z.-q. Chen, X.-Q. Liu, Y. Xue, Stimulation of N−glycoside transfer in deoxythymidine glycol: mechanism of the initial step in base excision repair, Journal of molecular modeling, 20 (2014) 1-11.
[37] J.J. Mo, Y. Xue, X.Q. Liu, N.X. Qiu, W. Chu, H.P. Xie, Quantum chemical studies on adsorption of CO2 on nitrogen-containing molecular segment models of coal, Surface Science, 616 (2013) 85-92.
[38] C. Zhang, X. Liu, Y. Xue, A general acid–general base reaction mechanism for human brain aspartoacylase: A QM/MM study, Computational and Theoretical Chemistry, 980 (2012) 85-91.
- 学术报告
[1] 刘晓强, 李美俊，钟宁宁，蒋维东，不同P-T条件下次烟煤中煤层气最佳采收率的分子动力学模拟，第十七届全国有机地球化学学术会议，2019，福州，荣获优秀青年论文口头报告奖。
[2] Xiaoqiang Liu, Hong Xiao, Meijun Li, Molecular modelling insight into the intramolecular methyl transfer of methyl dibenzofuran isomers in oil migration orientation and filling pathways. Goldschmidt, 2018，美国波士顿.
[3] 刘晓强, 李美俊，分子动力学模拟在石油运移示踪指标研究中的初步应用，第十六届全国有机地球化学学术会议，2017，重庆.（受邀作口头报告）
[4] 刘晓强, 李美俊, 陈旭阳, 煤层气吸附于湘西亚烟煤中的分子模拟及在页岩气和石油体系中的应用，第十六届全国有机地球化学学术会议，2017，重庆.
[5] Xiao-Qiang Liu, Ding-Lu Wu, Wen Jiang, Ying Xue, Molecular simulation of small-molecule gas adsorption on heterogeneous surface models of coal. 第12届全国量子化学会议. 太原, 2014, 794.