主要从事燃料的分子结构、热转化过程中反应机理等方面的研究工作

   

081701-化学工程
070304-物理化学（含：化学物理）

固体燃料热转化过程中的反应机理
能源转化过程的流动传递与反应工程

2004-08--2009-07   吉林大学   博士
2000-09--2004-07   沈阳药科大学   学士

   

2014-08~现在, 中国科学院过程工程研究所, 副研究员
2012-02~2014-08,中国科学院过程工程研究所, 助理研究员
2009-11~2012-02,北京大学, 博士后

[1] Xiaoyu Lv, Jingyuan Guo, Jin-Hui Zhan, Guojun Kang, Xiaoxing Liu. Catalytic mechanism of sulfur-nitrogen doping metal single-atom graphene-based catalysts for the conversion of CO2 to CH4: A computational study. Materials Today Communications[J]. 2024, 第 3 作者  通讯作者  38: 
[2] Yu, Mingyue, Zhan, JinHui, Li, Xiang, He, Wen, Liu, Xiaoxing. Effect of methanol on the pyrolysis behaviour of kerogen by ReaxFF molecular dynamics simulations. MOLECULAR SIMULATION. 2023, 第 2 作者  通讯作者  http://dx.doi.org/10.1080/08927022.2023.2271080.
[3] 李想, 战金辉, 许光文. 基于分子动力学模拟研究蒙脱石对油页岩干酪根热解产物分布的影响. 过程工程学报[J]. 2023, 第 2 作者  通讯作者  23(5): 724-733, http://lib.cqvip.com/Qikan/Article/Detail?id=7109935292.
[4] Qian, Yanan, Chen, Mengmeng, Zhan, JinHui, Zhao, Jingchong, Zhang, Guangyu, Sun, Feng, Sun, Bing, Xu, Wei. Thermal runaway mechanisms and kinetics of benzene nitrification system based on microcalorimetry experiments and ReaxFF molecular dynamics simulation. THERMOCHIMICA ACTA[J]. 2023, 第 3 作者725: http://dx.doi.org/10.1016/j.tca.2023.179522.
[5] 贺文, 战金辉, 孙怀宇, 刘晓星. 蓝宝石在冲击载荷下的力-热响应行为研究进展. 江西化工. 2023, 第 2 作者39(3): 26-29, http://lib.cqvip.com/Qikan/Article/Detail?id=7109945570.
[6] 张亚卓, 战金辉. CH3Cl在ZnO（001）和ZnO（100）表面吸附的第一性原理计算. 过程工程学报[J]. 2022, 第 2 作者  通讯作者  22(2): 240-248, http://lib.cqvip.com/Qikan/Article/Detail?id=7106729035.
[7] Hanyu Zhang, Menatalla Ahmed, JinHui Zhan. Recent advances in molecular simulation of oil shale kerogen. FUEL[J]. 2022, 第 3 作者  通讯作者  316: http://dx.doi.org/10.1016/j.fuel.2022.123392.
[8] Hu, Jiyun, Mehrabi, Hamed, Meng, YinShan, Taylor, Maddison, Zhan, JinHui, Yan, Qigeng, Benamara, Mourad, Coridan, Robert H, Beyzavi, Hudson. Probe metal binding mode of imine covalent organic frameworks: cycloiridation for (photo)catalytic hydrogen evolution from formate. CHEMICAL SCIENCE[J]. 2021, 第 5 作者  通讯作者  12(22): 7930-7936, https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8188469/.
[9] Liu, Zhutao, Zhan, JinHui, Lai, Dengguo, Zuo, Minghui, Liu, Xiaoxing. Effects of different temperature chars on distribution of pyrolysates for Naomaohu coal. JOURNAL OF THERMAL ANALYSIS AND CALORIMETRY[J]. 2021, 第 2 作者  通讯作者  146(1): 287-296, 
[10] Qian, Yanan, Xu, Wei, Zhan, JinHui, Jia, Xuewu, Zhang, Fan. Atomic insights into the thermal runaway process of hydrogen peroxide and 1,3,5-trimethybenzene mixture: Combining ReaxFF MD and DFT methods. PROCESS SAFETY AND ENVIRONMENTAL PROTECTION[J]. 2021, 第 3 作者147: 578-588, http://dx.doi.org/10.1016/j.psep.2020.12.036.
[11] Chen, Zhaohui, Tian, Yong, Lai, Dengguo, Zhan, Jinhui, Han, Zhennan, Xu, Guangwen, Gao, Shiqiu. Oil shale pyrolysis in a moving bed with internals enhanced by rapid preheating in a heated drop tube. Energy Conversion and Management[J]. 2020, 第 4 作者224: 113358, http://dx.doi.org/10.1016/j.enconman.2020.113358.
[12] Zhang, Zhijun, Guo, Liting, Zhang, Hanyu, Zhan, JinHui. Comparing product distribution and desulfurization during direct pyrolysis and hydropyrolysis of Longkou oil shale kerogen using reactive MD simulations. INTERNATIONAL JOURNAL OF HYDROGEN ENERGY[J]. 2019, 第 4 作者  通讯作者  44(47): 25335-25346, http://dx.doi.org/10.1016/j.ijhydene.2019.08.036.
[13] Zhang, Zhijun, Chai, Jun, Zhang, Hanyu, Guo, Liting, Zhan, JinHui. Structural model of Longkou oil shale kerogen and the evolution process under steam pyrolysis based on ReaxFF molecular dynamics simulation. ENERGY SOURCES PART A-RECOVERY UTILIZATION AND ENVIRONMENTAL EFFECTS. 2019, 第 5 作者  通讯作者  
[14] Qian, Yanan, Zhan, Jinhui, Yu, Yin, Xu, Guangwen, Liv, Xiaoxing. CFD model of coal pyrolysis in fixed bed reactor. CHEMICAL ENGINEERING SCIENCE[J]. 2019, 第 2 作者200: 1-11, http://dx.doi.org/10.1016/j.ces.2018.12.064.
[15] Somprasong Siramard, JinHui Zhan, Zhennan Han, Shipei Xu, Ondej Maek, Guangwen Xu. Secondary cracking of volatile and its avoidance in infrared-heating pyrolysis reactor. Carbon Resources Conversion[J]. 2018, 第 2 作者  通讯作者  1(3): 202-208, http://lib.cqvip.com/Qikan/Article/Detail?id=7105698984.
[16] Qian, Yanan, Han, Zhennan, Zhan, JinHui, Liu, Xiaoxing, Xu, Guangwen. Comparative evaluation of heat conduction and radiation models for CFD simulation of heat transfer in packed beds. INTERNATIONAL JOURNAL OF HEAT AND MASS TRANSFER[J]. 2018, 第 3 作者127: 573-584, http://dx.doi.org/10.1016/j.ijheatmasstransfer.2018.06.127.
[17] Tian, Tian, Su, Jinglin, Zhan, Jinhui, Geng, Shujun, Xu, Guangwen, Liu, Xiaoxing. Discrete and continuum modeling of granular flow in silo discharge. PARTICUOLOGY[J]. 2018, 第 3 作者36: 127-138, http://dx.doi.org/10.1016/j.partic.2017.04.001.
[18] 姚梅琴, 岳君容, 战金辉, 许光文, 刘晓星. 内循环微型流化床流动特性. 化工学报[J]. 2017, 第 3 作者68(10): 3717-3724, http://lib.cqvip.com/Qikan/Article/Detail?id=673329308.
[19] 赖登国, 战金辉, 陈兆辉, 韩振南, 武荣成, 许光文. 内构件移动床固体热载体油页岩热解技术. 化工学报[J]. 2017, 第 2 作者68(10): 3647-3657, http://lib.cqvip.com/Qikan/Article/Detail?id=673329302.
[20] Geng, Shujun, Qian, Yanan, Zhan, Jinhui, Zhang, Hongling, Xu, Guangwen, Liu, Xiaoxing. Prediction of solids residence time distribution in cross-flow bubbling fluidized bed. POWDER TECHNOLOGY[J]. 2017, 第 3 作者320: 555-564, http://dx.doi.org/10.1016/j.powtec.2017.07.085.
[21] Li, Mengya, Zhan, JinHui, Lai, Dengguo, Tian, Yong, Liu, Xiaoxing, Xu, Guangwen. Study on the evolution characteristic of intermediate during the pyrolysis of oil shale. JOURNAL OF THERMAL ANALYSIS AND CALORIMETRY[J]. 2017, 第 2 作者  通讯作者  130(3): 2227-2238, https://www.webofscience.com/wos/woscc/full-record/WOS:000415619800097.
[22] 李梦雅, 战金辉, 田勇, 赖登国, 刘晓星, 许光文. 油页岩热解中间产物的反应特性. 过程工程学报[J]. 2017, 第 2 作者  通讯作者  17(6): 1316-1321, http://lib.cqvip.com/Qikan/Article/Detail?id=674000225.
[23] 周国江, 刘竹涛, 战金辉, 赖登国, 刘晓星. 温度梯度与产物流动对先锋褐煤热解产物分布的影响. 化工学报[J]. 2017, 第 3 作者  通讯作者  69(6): 2672-2680, http://ir.ipe.ac.cn/handle/122111/28795.
[24] 刘强, 苏景林, 战金辉, 许光文, 刘晓星. 内构件对移动床内颗粒物料流动特性影响的离散模拟. 过程工程学报[J]. 2017, 第 3 作者17(6): 1163-1169, http://lib.cqvip.com/Qikan/Article/Detail?id=674000203.
[25] Lai, Dengguo, Zhan, JinHui, Tian, Yong, Gao, Shiqiu, Xu, Guangwen. Mechanism of kerogen pyrolysis in terms of chemical structure transformation. FUEL[J]. 2017, 第 2 作者  通讯作者  199: 504-511, http://dx.doi.org/10.1016/j.fuel.2017.03.013.
[26] Qian, Yanan, Zhan, JinHui, Lai, Dengguo, Li, Mengya, Liu, Xiaoxing, Xu, Guangwen. Primary understanding of non-isothermal pyrolysis behavior for oil shale kerogen using reactive molecular dynamics simulation. INTERNATIONAL JOURNAL OF HYDROGEN ENERGY[J]. 2016, 第 2 作者  通讯作者  41(28): 12093-12100, http://dx.doi.org/10.1016/j.ijhydene.2016.05.106.
[27] Geng, Shujun, Jia, Zhengrui, Zhan, Jinhui, Liu, Xiaoxing, Xu, Guangwen. CFD modeling the hydrodynamics of binary particle mixture in pseudo-2D bubbling fluidized bed: Effect of model parameters. POWDER TECHNOLOGY[J]. 2016, 第 3 作者302(NOV): 384-395, http://dx.doi.org/10.1016/j.powtec.2016.09.001.
[28] Lai, Dengguo, Shi, Yong, Geng, Sulong, Chen, Zhaohui, Gao, Shiqiu, Zhan, JinHui, Xu, Guangwen. Secondary reactions in oil shale pyrolysis by solid heat carrier in a moving bed with internals. Fuel[J]. 2016, 第 6 作者  通讯作者  173(JUNE): 138-145, http://dx.doi.org/10.1016/j.fuel.2016.01.052.
[29] Xiaoxing Liu, Chuanqiang Zhu, Shujun Geng, Meiqin Yao, Jinhui Zhan, Guangwen Xu. Two-fluid modeling of Geldart A particles in gas-solid micro-fluidized beds. 中国颗粒学报：英文版[J]. 2015, 第 5 作者118-127, http://lib.cqvip.com/Qikan/Article/Detail?id=665689525.
[30] Lai, Dengguo, Chen, Zhaohui, Shi, Yong, Lin, Lanxin, Zhan, Jinhui, Gao, Shiqiu, Xu, Guangwen. Pyrolysis of oil shale by solid heat carrier in an innovative moving bed with internals. Fuel[J]. 2015, 第 5 作者159(NOV): 943-951, http://dx.doi.org/10.1016/j.fuel.2015.07.068.
[31] Liu, Xiaoxing, Zhu, Chuanqiang, Geng, Shujun, Yao, Meiqin, Zhan, Jinhui, Xu, Guangwen. Two-fluid modeling of Geldart A particles in gas-solid micro-fluidized beds. PARTICUOLOGY[J]. 2015, 第 5 作者21(AUG): 118-127, http://dx.doi.org/10.1016/j.partic.2014.05.012.
[32] Liu, Xiaoping, Zhan, JinHui, Lai, Dengguo, Liu, Xiaoxing, Zhang, Zhanjun, Xu, Guangwen. Initial Pyrolysis Mechanism of Oil Shale Kerogen with Reactive Molecular Dynamics Simulation. ENERGY & FUELS[J]. 2015, 第 2 作者29(5): 2987-2997, http://www.irgrid.ac.cn/handle/1471x/975440.
[33] Zhan, JinHui, Wu, Rongcheng, Liu, Xiaoxing, Gao, Shiqiu, Xu, Guangwen. Preliminary understanding of initial reaction process for subbituminous coal pyrolysis with molecular dynamics simulation. FUEL[J]. 2014, 第 1 作者134(OCT.): 283-292, http://dx.doi.org/10.1016/j.fuel.2014.06.005.
[34] Zhan, JinHui, Lv, Hongbin, Yu, Yi, Zhang, JunLong. Catalytic C-F Bond Activation of Perfluoroarenes by Tricoordinated Gold(I) Complexes. ADVANCED SYNTHESIS & CATALYSIS[J]. 2012, 第 1 作者354(8): 1529-1541, https://www.webofscience.com/wos/woscc/full-record/WOS:000304345100018.
[35] Cai, YuanBo, Zhan, Jinhui, Hai, Yang, Zhang, JunLong. Molecular Assembly Directed by Metal-Aromatic Interactions: Control of the Aggregation and Photophysical Properties of Zn-Salen Complexes by Aromatic Mercuration. CHEMISTRY-A EUROPEAN JOURNAL[J]. 2012, 第 2 作者18(14): 4242-4249, http://dx.doi.org/10.1002/chem.201103332.
[36] Lv, Hongbin, Zhan, JinHui, Cai, YuanBo, Yu, Yi, Wang, Bingwu, Zhang, JunLong. pi-pi Interaction Assisted Hydrodefluorination of Perfluoroarenes by Gold Hydride: A Case of Synergistic Effect on C-F Bond Activation. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY[J]. 2012, 第 2 作者134(39): 16216-16227, https://www.webofscience.com/wos/woscc/full-record/WOS:000309335000026.
[37] Jing, Jing, Chen, JuanJuan, Hai, Yang, Zhan, Jinhui, Xu, Pingyong, Zhang, JunLong. Rational design of ZnSalen as a single and two photon activatable fluorophore in living cells. CHEMICAL SCIENCE[J]. 2012, 第 4 作者3(11): 3315-3320, http://dx.doi.org/10.1039/c2sc20764h.

   

（ 1 ） 次烟煤热解的分子动力学模拟及反应机理研究, 主持, 国家级, 2014-01--2016-12
（ 2 ） 油页岩有机质初次热解的分子动力学模拟及反应机理研究, 主持, 国家级, 2014-01--2015-12
（ 3 ） 油页岩有机质热解反应机理研究, 主持, 国家级, 2016-01--2018-08
（ 4 ） 低变质煤热解制高品质油气的定向调控机制和方法, 参与, 国家级, 2016-07--2021-06
（ 5 ） 基于热解中间体结构识别的油页岩有机质热转化基础研究, 主持, 国家级, 2019-01--2022-12

已指导学生

李梦雅  硕士研究生  085216-化学工程  

尹府尹  硕士研究生  085216-化学工程