基本信息Personal Information
副教授硕士生导师
主要任职：无
性别：男
毕业院校：清华大学
学位：博士
在职信息：在职
所在单位：化工学院
学科：化学工程
办公地点：西部校区化工实验楼D408
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个人简介Personal Profile
张磊 博士 副教授 硕士生导师Email: keleiz@dlut.edu.cn
专业：化学工程
地址：辽宁省大连市大连理工大学西部校区化工实验楼D408室
Research Gate: https://www.researchgate.net/profile/Lei_Zhang329
https://orcid.org/0000-0002-7519-2858
近期新闻
· 大连理工大学张磊获得首届过程系统工程青年科技奖
· 硕士生王璐获得第十七届中国化工学会信息技术应用专业委员会年会优秀论文
·硕士生毛海涛在第五届SCPPE国际会议中获得最佳学生报告
·大连理工大学张磊副教授荣获Computers & Chemical Engineering杂志2017年最佳论文奖
· 张磊受邀参加ICFMCE2018国际会议并进行主旨报告
· [more]
研究团队
博士生：
（1）刘奇磊；（2）柴士阳
硕士生：
（1）毛海涛；（2）庞俊卿；（3）仪桐辛；（4）赵红庆；（5）王璐；（6）郭雯静；（7）覃渫兰
已毕业：
（1）梁馨元（硕士，2019，P&G）；
教育科研经历
· 2005.9~2009.7 清华大学化学工程系 本科
· 2009.9~2014.7 清华大学化学工程系 博士（导师：陈丙珍 院士 [link]）
· 2013.8~2014.2 卡内基梅隆大学化工系 访问学者（导师：Prof. Ignacio E. Grossmann [link]）
· 2014.9~2015.12 丹麦技术大学化工系 博士后（导师：Prof. Rafiqul Gani [link]）
· 2016.1~2017.2 香港科技大学化工系 博士后（导师：吴嘉名 教授 [link]）
· 2017.3~至今 大连理工大学化工学院 副教授
研究方向
· 化工过程与产品设计
· 化工过程优化
· 多尺度模型建模与求解
· 能量系统优化
科研情况
张磊，大连理工大学化工系统工程研究所副教授，硕士生导师。获得首届过程系统工程青年科技奖；获得2017年Computers & Chemical Engineering Best Paper Award；入选大连理工大学第五批“星海骨干”计划。主要从事化工产品—过程设计相关研究工作。目前，发表与化工产品设计、过程设计与优化等相关的学术论文总计75篇（SCI、EI、CPCI收录），总计被引用477次，H-index为12（Google学术数据）。
科研项目
· 基于晶体生长机理模型的制药过程结晶溶剂设计方法研究(**), 2019.1~2021.12, 国家自然科学基金青年科学基金项目, 主持, 在研
· 功能性化工产品设计方法研究(DUT17RC(3)008), 2017.3~2018.12, 中央高校基本科研业务费, 主持, 已结题
· 万吨级促进剂MBT连续化生产精制溶剂选择与过程设计, 2018.4~2019.1, 企业合作项目, 主持, 在研
·促进剂MBT连续化精制溶剂优化选择与分离过程设计, 2018.12~2019.4, 企业合作项目, 主持, 在研
· 《化工过程分析与合成》数字课程（ISBN：978-7-89510-343-6）, 2018.7~2018.12, 大连理工大学教材建设出版基金项目, 主持, 在研
获得奖励
· 2019 “全国石油和化工教育优秀教学团队”成员
· 2019 过程系统工程青年科技奖
· 2019 2019年中国过程系统工程年会（PSE2019）优秀论文二等奖
· 2019 第十七届中国化工学会信息技术应用专业委员会年会优秀论文
· 2019 Best Student Presentation in SCPPE 2019 International Conference (Supervisor)
· 2017 Best Paper Award of Journal Computers & Chemical Engineering
· 2017 第十六届中国化工学会信息技术应用专业委员会年会优秀论文
· 2015 Outstanding reviewer of Journal Computers & Chemical Engineering
社会兼职
· Guest editor of Journal Current Opinion of Chemical Engineering
· Member of the scientific committee for ESCAPE-30 conference [link]
· 2019年中国过程系统工程年会分会场主席
·Member of the scientific committee and session chair for ICFMCE 2019 conference[link]
·第十七届中国化工学会信息技术应用专业委员会年会组委会成员
· 2018年中国过程系统工程年会分会场主席
· International expert of PSE for SPEED Company[link]
· 中国化工学会信息技术应用专业委员会青年委员
· 中国系统工程学会会员
· Member of the scientific committee for ESCAPE-29conference[link]
· Member of the scientific committee and session chair for ICFMCE 2018 conference[link]
· Member of the scientific committee for ESCAPE-28 conference [link]
· Reviewer ofChemical Engineering Science,Industrial & Engineering Chemistry Research,Computers & Chemical Engineering,Reviews in Chemical Engineering, Current Opinion in Chemical Engineering, Applied Mathematical Modelling,International Journal of Chemical Kinetics,Chinese Journal of Chemical Engineering
· 计算机与应用化学、高校化工学报期刊审稿人
口头报告
· Zhang, L., ProCAPD - A Smart Tool for Computer-Aided Chemical Product Design. ICFMCE 2019 Conference. Bangkok, Thailand. Dec. 15-17, 2019. (Keynote presentation)
· Mao, H., Zhang, L.*, Liu, L., Du, J., Gani, R. COSMO-based inverse neural network: A novel machine learning approach towards mixture product design. 5th International Conference on Sustainable Chemical Product and Process Engineering. Tianjin, China. Jul. 1-3, 2019. (Oral presentation, Best student presentation)
·Zhang, L., A GC+-COSMO Model for Computer-Aided Molecular Design: Framework and Applications. 2nd Process System Engineering (PSE) – State of the Art Workshop. Nuevo Vallarta, Mexico. Jan. 26-30, 2019. (Keynote presentation)
·Zhang, L., An Optimization-Based Computer-Aided Molecular and Mixture Design Framework. ICFMCE 2018 Conference. Abu Dhabi, UAE. Nov. 20-22, 2018. (Keynote presentation)[link]
· 梁馨元, 张磊*, 刘琳琳, 都健. 基于分子动力学的橡胶聚合物计算机辅助设计方法. 2018年中国过程系统工程年会. 青海,西宁. 2018年8月22-24日. (主旨报告)
· 刘奇磊, 冯锟, 刘琳琳, 都健, 孟庆伟, 张磊*. 基于Dragon描述符与改进的决策树—遗传算法的反应溶剂设计方法. 2018年中国过程系统工程年会. 青海,西宁. 2018年8月22-24日. (主旨报告)
· Zhang, L.*, Mao, H., Liu, L., Du, J., Gani, R. Fragrance Product Design/Screening Methods Using an Integrated Machine Learning and CAMD Model. 2018 AIChE Annual Meeting. Pittsburgh, PA, USA. Oct. 26-Nov. 2. (Oral presentation) [link]
·Liu, Q., Zhang, L.*, Liu, L., Du, J., Meng, Q. Computer-Aided Reaction Solvent Design Integrated with New Reaction Mechanism Model. 2018 AIChE Annual Meeting. Pittsburgh, PA, USA. Oct. 26-Nov. 2. (Oral presentation) [link]
· Liu, Q., Zhang, L.*, Liu, L., Du, J., Liang, X., Mao, H., Meng, Q. GC-COSMO based Reaction Solvent Design with New Kinetic Model using CAMD. Proceedings of the 13th International Symposium on Process Systems Engineering – PSE 2018. San Diego, California, USA. July 1-5, 2018. (Oral presentation)
发表论文
2020:
[75] Liu, L., Wu, C., Zhuang, Y.,Zhang, L., Du, J.* Interplant Heat Integration Method Involving Multiple Intermediate Fluid Circles and Agents: Single-Period and Multiperiod Designs.Industrial & Engineering Chemistry Research, 2020, 59, 10, 4698-4711. (SCI) [link]
[74] Sheng, Y., Liu, L.*, Zhuang, Y.,Zhang, L., Du, J.Simultaneous Synthesis of Heat Exchanger Network and Utility System Considering Various Locations of Steam Heaters.Energies, 2020, 13(6), 1467. (SCI) [link]
[73] Zhuang, Y.,Zhang, L., Liu, L., Du, J.*, Shen, S. An Upgraded Superstructure-based Model for Simultaneous Synthesis of Direct Work and Heat Exchanger Networks. Chemical Engineering Research and Design, 2020. (Accepted, SCI)
[72] Zhuang, Y., Yang, R.,Zhang, L., Du, J.*, Shen, S. Simultaneous Synthesis of Sub and Above-ambient Heat Exchanger Networks including Expansion Process Based on an Enhanced Superstructure Model.Chinese Journal of Chemical Engineering, 2020, doi: 10.1016/j.cjche.2020.02.026. (In press, SCI) [link]
[71] Zhou, C., Zhuang Y.*,Zhang, L., Liu, L., Du, J., Shen, S. A novel pinch-based method for process integration and optimization of Kalina Cycle. Energy Conversion and Management, 2020, 209, 112630. (SCI) [link]
[70] Wang, C., Zhuang, Y., Liu, L., Zhang, L., Du, J.* Control of energy-efficient extractive distillation configurations for separating the methanol/toluene azeotrope with intermediate-boiling entrainer, Chemical Engineering and Processing - Process Intensification, 2020, 149, 107862. (SCI) [link]
[69] Sun, X., Liu, L.*, Zhuang, Y., Zhang, L., Du, J. Heat Exchanger Network Synthesis Integrated with Compression-Absorption Cascade Refrigeration System, Processes, 2020, 8(2), 210.(SCI) [link]
[68] Chai, S., Liu, Q., Liang, X., Guo, Y., Zhang, S., Xu, C., Du, J., Yuan, Z., Zhang, L.*, Gani, R.* A Grand Product Design Model for Crystallization Solvent Design, Computers & Chemical Engineering, 2020, 135, 106764. (SCI) [link]
[67] Wang, C., Zhuang, Y., Liu, L., Zhang, L., Du, J.*, Zhang, Z. Design and control of a novel side-stream extractive distillation column for separating methanol-toluene binary azeotrope with intermediate boiling entrainer, Separation and Purification Technology, 2020, 239, 116581. (SCI) [link]
[66] Zhang, X., Zhang, L., Fung, K. Y., Bakshi, B. R., Ng, K. M.* Sustainable Product Design: A Life-Cycle Approach, Chemical Engineering Science,2020, 217, 115508. (SCI) [link]
[65]Zhang, L.*, Mao, H., Liu, Q., Gani, R.* Chemical Product Design – Recent Advances and Perspectives,Current Opinion in Chemical Engineering, 2020, 27, 22-34. (SCI) [link]
[64] Yang, R., Zhuang, Y.,Zhang, L., Du, J.*, Shen, S. A Thermo-economic Multi-objective Optimization Model for Simultaneous Synthesis of Heat Exchanger Networks Including Compressors,Chemical Engineering Research and Design, 2020, 153, 120-135. (SCI) [link]
2019:
[63] Pang, J., Zhang, L.*, Liu, L., Du, J., Zhuang, Y. Integrated Process-Product Design based on COSMO-SAC model: Application to the Production of 2,2,4-Trimethyl-1,2-H-Dihydroquinoline (TMQ), Chemical Engineering Transactions, 2019, 76, 1183-1188. (CPCI) [link]
[62] Li, C., Liu, L., Zhang, L., Gu, S., Du, J.* Simultaneous Synthesis of Controllable Heat Exchanger Networks, Chemical Engineering Transactions, 2019, 76, 739-744. (CPCI) [link]
[61] Li, W., Zhuang, Y., Liu, L., Zhang, L., Du, J.* Economic, Exergy, Environmental (3E) Analysis of Methanol Production from Shale Gas, Chemical Engineering Transactions, 2019, 76, 655-660. (CPCI) [link]
[60] Zhuang, Y., Liu, L., Zhang, L., Du, J.*, Shen, S. An Efficient Sequential Approach for Work-Heat Exchange Networks Synthesis Combined with Meta-Heuristic Strategies, Chemical Engineering Transactions, 76, 583-588. (CPCI) [link]
[59] Sun, X., Liu, L., Sheng, Y., Zhang, L., Du, J.* Heat Exchanger Network Synthesis with Absorption Refrigeration Cycle Integrated Considering the Optimization of Operating Condition, Chemical Engineering Transactions, 2019, 76, 301-306. (CPCI) [link]
[58] Sheng, Y., Liu, L.*, Zhang, L., Du, J. Simultaneous Synthesis of Heat Exchanger Network and Utility System Considering Inter- and Inner-stage Heaters, Chemical Engineering Transactions, 2019, 76, 295-300. (CPCI) [link]
[57] Yang, R., Zhuang, Y., Zhang, L., Liu, L., Du, J.* Enhanced Superstructure-based Model for Synthesis of Sub-ambient Heat Exchanger Networks with Expansion Process, Chemical Engineering Transactions, 2019, 76, 289-294. (CPCI) [link]
[56] Zhang, S., Tao, R., Liu, L.*, Zhang, L., Du, J. Economic and Environmental Optimisation Framework for Carbon Capture Utilisation and Storage Supply Chain, Chemical Engineering Transactions, 2019, 76, 1-6. (CPCI) [link]
[55] 王璐, 毛海涛, 张磊*, 刘琳琳, 都健. 基于反向机器学习的调香设计方法. 化工学报, 2019, 70(12), 4722-4729. (EI, 第十七届中国化工学会信息技术应用专业委员会年会优秀论文) [link]
[54] Liu, Q., Zhang, L., Tang, K., Feng, Y., Zhang, J., Zhuang, Y., Liu, L., Du, J.* Computer-aided reaction solvent design considering inertness using group contribution-based reaction thermodynamic model, Chemical Engineering Research and Design, 2019, 152, 123-133. (SCI) [link]
[53] Zhang, X., Zhou, T., Zhang, L., Feng, K. Y., Ng, K. M.* Food product design: A hybrid machine learning and mechanistic modeling approach, Industrial & Engineering Chemistry Research, 2019, 58(36), 16743-16752. (SCI) [link]
[52] Liang, X., Zhang, X., Zhang, L.*, Liu, L., Du, J., Zhu, X., Ng, K. M. Computer-aided polymer design: Integrating group contribution and molecular dynamics, Industrial & Engineering Chemistry Research, 2019, 58(34), 15542-15552. (SCI)[link]
[51] Zhang, S., Zhuang, Y., Liu, L.*, Zhang, L., Du, J. Risk management optimization framework for the optimal development of carbon capture and storage system under uncertainty. Renewable and Sustainable Energy Reviews, 2019, 113, 109280. (SCI) [link]
[50]Liu, L., Bai, Y., Zhang, L., Gu, S., Du, J.* Synthesis of flexible heat exchanger networks considering gradually accumulated deposit and cleaning management. Industrial & Engineering Chemistry Research, 2019, 58(27), 12124-12136. (SCI, Supplementary Cover) [link]
[49] Li, W., Zhuang, Y., Zhang, L., Liu, L., Du, J.* Economic evaluation and environmental assessment of shale gas dehydration process. Journal of Cleaner Production, 2019, 232, 487-498. (SCI) [link]
[48] Zhang, X., Zhang, L., Fung, K. Y., Ng, K. M.* Product Design: Incorporating Make-or-buy Analysis and Supplier Selection. Chemical Engineering Science, 2019, 202, 357-372. (SCI) [link]
[47] 杨蕊, 庄钰, 刘琳琳, 张磊, 都健*. 功热交换网络综合的研究进展, 化工进展, 2019, 38(6), 2550-2557. (EI)[link]
[46] Liu, Q., Zhang, L.*, Liu, L., Du, J., Meng, Q., Gani, R. Computer-aided reaction solvent design based on transition state theory and COSMO-SAC. Chemical Engineering Science, 2019, 202, 300-317. (SCI)[link]
[45] Zhuang, Y., Liu, L., Zhang, L., Du, J.*, Shen, S. An Extended Superstructure Modeling Method for Simultaneous Synthesis of Direct Work Exchanger Networks. Chemical Engineering Research and Design, 2019, 144, 258-271. (SCI) [link]
[44] 刘奇磊, 冯锟, 刘琳琳, 都健, 孟庆伟, 张磊*. 基于Dragon描述符与改进的决策树-遗传算法的反应溶剂设计方法. 化工学报, 2019, 70(2), 535-540. (EI) [link]
[43] 梁馨元, 张磊*, 刘琳琳, 都健. 基于分子动力学的橡胶聚合物计算机辅助设计方法. 化工学报, 2019, 70(2), 525-532. (EI) [link]
[42] 王少靖, 刘琳琳, 张磊, 都健*, 吴恺艺. 集成NGL回收的新型天然气液化系统(AP-XTM)的概念设计与分析. 化工学报, 2019, 70(2), 508-515. (EI) [link]
[41] 吴长昊, 刘琳琳*, 张磊, 都健. 采用两种中间介质的工业园区厂际余热集成. 化工学报, 2019, 70(2), 431-439. (EI, 封面文章) [link]
[40] 郭孝正, 刘琳琳*, 张磊, 都健. 基于截断器半连续操作的间歇过程性质集成. 化工学报, 2019, 70(2), 516-524. (EI) [link]
[39] Li, W., Zhuang, Y., Liu, L., Zhang, L., Du, J.*Economic Evaluation and Environmental Assessment of Shale Gas Sweetening Process, Chemical Engineering & Technology, 2019, 42(4), 753-760. (SCI) [link]
[38] Gu, S., Liu, L., Zhang, L., Bai, Y., Du, J.* Optimization-based Framework for Designing Dynamic Flexible Heat Exchanger Networks, Industrial & Engineering Chemistry Research, 2019, 58(15), 6026-6041. (SCI, Supplementary Cover) [link]
[37] Liu, Q. Zhang, L.*, Liu, L., Du, J., Tula, A. K., Eden, M., Gani, R. OptCAMD: An Optimization-Based Framework and Tool for Molecular and Mixture Product Design, Computers & Chemical Engineering, 2019,124, 285-301. (SCI) [link]
2018:
[36] Zhang, S., Liu, L.*, Zhang, L., Zhuang, Y., Du, J.* (2018). An optimization model for carbon capture utilization and storage supply chain: A case study in Northeastern China, Applied Energy, 231, 194-206. (SCI) [link]
[35] Li, W., Liu, L., Zhang, L., Meng, Q., Du, J.* (2018). Optimization of Shale Gas Sweeting Process Coupling with Claus Process Based on Energy Synthesis, Chemical Engineering Transactions, 70, 1027-1032. (EI) [link]
[34] San, H., Meng, Q., Liu, L., Zhang, L., Du, J.* (2018). Creative Optimization and Industrial Research of Freeze Drying Process of the Cardiomyopeptidin for Injection, Chemical Engineering Transactions, 70, 1201-1206. (EI) [link]
[33] Zhang, S., Liu, L., Zhang, L., Meng, Q., Du, J.* (2018). Optimal Planning for Regional Carbon Capture and Storage Systems under Uncertainty, Chemical Engineering Transactions, 70, 1207-1212. (EI) [link]
[32] Liu, Q., Zhang, L.*, Liu, L., Du, J., Liang, X., Mao, H., Meng, Q. (2018). GC-COSMO based Reaction Solvent Design with New Kinetic Model using CAMD. In Computer Aided Chemical Engineering (Vol. 44, pp. 235-240). Elsevier. (CPCI) [link]
[31] Kalakul, S., Zhang, L., Choudhury H., Elbashir, N. O., Eden M.*, Gani, R. (2018). ProCAPD – A Computer-Aided Model-Based Tool for Chemical Product Design and Analysis. In Computer Aided Chemical Engineering (Vol. 44, pp. 469-474). Elsevier. (CPCI) [link]
[30] Zhuang, Y., Zhang, L., Liu, L., Meng, Q., Du, J.* (2018). Simultaneous Synthesis of WHEN Based on Superstructure Modelling Considering Thermodynamic and Economic Factors. In Computer Aided Chemical Engineering (Vol. 44, pp. 1033-1038). Elsevier. (CPCI) [link]
[29] Liu, L., Sheng, Y., Zhang, L., Du, J.*, Meng, Q. (2018). Water networks synthesis for industrial parks respecting to unpredictable scenarios. In Computer Aided Chemical Engineering (Vol. 44, pp. 1021-1026). Elsevier. (CPCI) [link]
[28] Gu, S., Liu, L., Zhang, L., Bai, Y., Wang, S., Du, J.* (2018). Heat exchanger networks synthesis integrated with flexibility and controllability, Chinese Journal of Chemical Engineering, 27(7), 1474-1484. (SCI) [link]
[27] Zhang, X., Zhang, L., Fung, K. Y., Rangaiah, G. P., Ng, K. M.* (2018). Product Design: Impact of Government Policy and Consumer Preference on Company Profit and Corporate Social Responsibility, Computers & Chemical Engineering, 118, 118-131. (SCI) [link]
[26] Zhang, L.*, Kalakul, S., Liu, L., Elbashir, N. O., Du, J., & Gani, R. (2018). A Computer-Aided Methodology for Mixture-Blend Design. Applications to Tailor-Made Design of Surrogate Fuels, Industrial & Engineering Chemistry Research, 57 (20), pp 7008–7020. (SCI) [link]
[25] Zhang, L.*, Mao, H., Liu, L., Du, J., & Gani, R. (2018). A machine learning based computer-aided molecular design/screening methodology for fragrance molecules, Computers & Chemical Engineering, 115, 295-308. (SCI) [link]
[24] Kalakul, S., Zhang, L., Fang, Z., Choudhury, H. A., Intikhab, S., Elbashir, N., Eden, M. R., & Gani, R.* (2018). Computer aided chemical product design - ProCAPD and tailor-made blended products, Computers & Chemical Engineering, 116, 37-55. (SCI) [link]
[23] Zhang, L., Fung, K. Y., Wibowo, C., & Gani, R.* (2018). Advances in Chemical Product Design. Reviews in Chemical Engineering, 34(3), 319-340 (SCI) [link]
[22] Liu, L., Song, H., Zhang, L., & Du, J.* (2018). Heat-integrated water allocation network synthesis for industrial parks with sequential and simultaneous design. Computers & Chemical Engineering, 108, 408-424. (SCI, Most downloaded article) [link]
[21] 李伟达, 刘琳琳, 张磊, 王少靖, 都健.* (2018). 基于灵敏度分析的页岩气净化流程的模拟与优化,化工学报, 69(3), 1008-1013. (EI, 第十六届中国化工学会信息技术应用专业委员会年会优秀论文) [link]
[20] 张磊*, 刘琳琳, 都健. (2018). 替代燃油的计算机辅助设计方法, 化工进展, 37(6), 2437-2443. (EI)[link]
2017:
[19] Zhuang, Y., Liu, L., Zhang, L., & Du, J.* (2017). Synthesis of indirect work exchange networks considering both isothermal and adiabatic process together with exergy analysis. Chinese Journal of Chemical Engineering, 26(8), 1644-1652. (SCI) [link]
[18] Zhang, L.*, Fung, K. Y., Zhang, X., Fung, H. K., & Ng, K. M. (2017). An integrated framework for designing formulated products. Computers & Chemical Engineering, 107, 61-76. (SCI, 2017 Best Paper Award) [link]
[17] Zhuang, Y., Liu, L., Zhang, L., & Du, J.* (2017). Direct work exchanger network synthesis of isothermal process based on improved transshipment model. Journal of the Taiwan Institute of Chemical Engineers, 81, 295-304. (SCI) [link]
[16] Zhuang, Y., Liu, L., Zhang, L., & Du, J.* (2017). Upgraded Graphical Method for the Synthesis of Direct Work Exchanger Networks. Industrial & Engineering Chemistry Research, 56(48), 14304-14315. (SCI) [link]
[15] Bertran, M. O., Frauzem, R., Sanchez-Arcilla, A. S., Zhang, L., Woodley, J. M., & Gani, R.* (2017). A generic methodology for processing route synthesis and design based on superstructure optimization. Computers & Chemical Engineering, 106, 892-910. (SCI, Most Cited Computers & Chemical Engineering Article) [link]
2016:
[14] Gani, R.*, Zhang, L., Kalakul, S., & Cignitti, S. (2016). Chapter 6 - Computer-Aided Molecular Design and Property Prediction. In Computer Aided Chemical Engineering (Vol. 39, pp. 153-196). Elsevier. (CPCI) [link]
[13] Fung, K. Y., Ng, K. M.*, Zhang, L., & Gani, R. (2016). A grand model for chemical product design. Computers & Chemical Engineering, 91, 15-27. (SCI) [link]
[12] Zhang, L., Babi, D. K., & Gani, R.* (2016). New vistas in chemical product and process design. Annual review of chemical and biomolecular engineering, 7, 557-582. (SCI) [link]
[11] Garcia-Herreros, P., Zhang, L., Misra, P., Arslan, E., Mehta, S., & Grossmann, I. E.* (2016). Mixed-integer bilevel optimization for capacity planning with rational markets. Computers & Chemical Engineering, 86, 33-47. (SCI) [link]
[10] Kalakul, S., Cignitti, S., Zhang, L., & Gani, R.* (2016). Chapter 3 - VPPD-Lab: the chemical product simulator. In Computer Aided Chemical Engineering (Vol. 39, pp. 61-94). Elsevier. (CPCI) [link]
[9] Kalakul, S., Cignitti, S., Zhang, L., & Gani, R.* (2016). Integrated computer-aided framework for sustainable chemical product design and evaluation. In Computer Aided Chemical Engineering (Vol. 38, pp. 2343-2348). Elsevier. (CPCI) [link]
[8] Bertran, M. O., Frauzem, R., Zhang, L., & Gani, R.* (2016). A generic methodology for superstructure optimization of different processing networks. In Computer Aided Chemical Engineering (Vol. 38, pp. 685-690). Elsevier. (CPCI) [link]
Before 2016:
[7] Zhang, L., Cignitti, S., & Gani, R.* (2015). Generic mathematical programming formulation and solution for computer-aided molecular design. Computers & Chemical Engineering, 78, 79-84. (SCI) [link]
[6] Cignitti, S., Zhang, L., & Gani, R.* (2015). Computer-aided framework for design of pure, mixed and blended products. In Computer Aided Chemical Engineering (Vol. 37, pp. 2093-2098). Elsevier. (CPCI) [link]
[5] Zhang, L., Wang, H., Qiu, T., & Chen, B.* (2015). Simulation and Optimization of Multi-period Steam Cracking Process. In Advances in Petrochemicals. InTech. [link]
[4] Zhang, L., & Chen, B.* (2012). Applications of Shannon's entropy theory to naphtha pyrolysis simulation. Chemical Engineering & Technology, 35(2), 281-286. (SCI) [link]
[3] Zhang, L., Chen, B.*, & Qiu, T. (2012). A multi-scale model of naphtha pyrolysis process. In Computer Aided Chemical Engineering (Vol. 31, pp. 120-124). Elsevier. (CPCI) [link]
[2] 彭辉, 张磊, 邱彤*, 陈丙珍. (2011). 乙烯裂解原料等效分子组成的预测方法. 化工学报, 62(12), 3447-3451. (EI) [link]
[1] 张磊, 陈丙珍*, 邱彤. (2011). 基于PCA的反应网络简化策略. 化工学报, 62(1), 137-141. (EI) [link]
软件著作权
[1] OptCAMD基于数学优化模型的高通量化工分子产品设计软件(2019SR**), 2019.01.08.
计算机辅助分子/混合物设计(Computer-Aided Molecular/Mixture Design, CAM2D)
结合化学、数学、物理、计算机等方法，对化工产品的机理进行研究，建立产品分子结构与宏观性质之间定量结构—性质关系(Quantitative Structure-Property Relationship, QSPR)，对已知结构的分子进行性质预测；在此基础上，通过给出期望产品的目标性质，利用分子结构与宏观性质之间的定量关系建立数学模型，来设计符合目标性质要求的产品。
· 制药过程反应与结晶单元操作的有机小分子溶剂设计
研究溶剂对液—液均相有机合成过程与溶液结晶过程的溶剂化效应，考察溶剂化自由能与晶面—溶剂吸附能分别对反应速率常数与晶体形貌的作用机制，进而耦合计算机辅助分子设计方法进行溶剂设计，实现反应溶剂催化剂与结晶溶剂的高通量与定向化的设计工作。
· 基于分子动力学的橡胶高分子设计方法研究
利用CAMD方法，逆向从高分子产品需求的性质出发，设计求得满足性质要求的分子结构。首先通过基团贡献法设计出满足性质要求的橡胶聚合物结构；并基于分子动力学模拟技术，探究橡胶高分子分子量、支链结构与特定性质之间的定量关系。
· 耦合机器学习的计算机辅助气味分子设计
解析气味产品特点，分别确定产品的物理化学性质与气味性质。建立机器学习模型来关联分子的描述符及其气味。再运用CAMD方法建立其它性质的模型并求解。得到满足条件的分子结构之后，计算其描述符并代入机器学习预测模型，通过预测是否满足条件来得到产品。
· 考虑过程设计的萃取剂分子设计
针对反应过程，设计一种萃取剂，使得加入的萃取剂可以把反应产物转移到萃取相，与原有的反应相分离，增加反应的最大转化率，提高产品收率。通过建立相平衡与反应平衡的数学模型，将产物在萃取相的浓度最大化作为约束条件来进行CAMD设计萃取剂。
教育经历Education Background
工作经历Work Experience
2009.92014.7
清华大学
化学工程与技术
博士
2005.92009.7
清华大学
化学工程与工业生物工程
学士
2002.92005.7
吉林市江城中学
2017.3至今
大连理工大学化工学院
副教授
2016.12017.3
香港科技大学化工系
博士后
2014.92015.12
丹麦技术大学化工系
博士后
研究方向Research Focus
社会兼职Social Affiliations
团队成员Research Group
化工产品设计王璐
覃渫兰
郭雯静
刘奇磊
柴士阳
梁馨元
毛海涛
庞俊卿
仪桐辛
赵红庆
基本信息Personal Information
副教授硕士生导师
主要任职：无
性别：男
毕业院校：清华大学
学位：博士
在职信息：在职
所在单位：化工学院
学科：化学工程
办公地点：西部校区化工实验楼D408
电子邮箱：
扫描关注
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当前位置: 中文主页 >> 科学研究
研究领域
计算机辅助分子/混合物设计(Computer-Aided Molecular/Mixture Design, CAM2D)
结合化学、数学、物理、计算机等方法，对化工产品的机理进行研究，建立产品分子结构与宏观性质之间定量结构—性质关系(Quantitative Structure-Property Relationship, QSPR)，对已知结构的分子进行性质预测；在此基础上，通过给出期望产品的目标性质，利用分子结构与宏观性质之间的定量关系建立数学模型，来设计符合目标性质要求的产品。
· 制药过程反应与结晶单元操作的有机小分子溶剂设计
研究溶剂对液—液均相有机合成过程与溶液结晶过程的溶剂化效应，考察溶剂化自由能与晶面—溶剂吸附能分别对反应速率常数与晶体形貌的作用机制，进而耦合计算机辅助分子设计方法进行溶剂设计，实现反应溶剂催化剂与结晶溶剂的高通量与定向化的设计工作。
· 基于分子动力学的橡胶高分子设计方法研究
利用CAMD方法，逆向从高分子产品需求的性质出发，设计求得满足性质要求的分子结构。首先通过基团贡献法设计出满足性质要求的橡胶聚合物结构；并基于分子动力学模拟技术，探究橡胶高分子分子量、支链结构与特定性质之间的定量关系。
· 耦合机器学习的计算机辅助气味分子设计
解析气味产品特点，分别确定产品的物理化学性质与气味性质。建立机器学习模型来关联分子的描述符及其气味。再运用CAMD方法建立其它性质的模型并求解。得到满足条件的分子结构之后，计算其描述符并代入机器学习预测模型，通过预测是否满足条件来得到产品。
· 考虑过程设计的萃取剂分子设计
针对反应过程，设计一种萃取剂，使得加入的萃取剂可以把反应产物转移到萃取相，与原有的反应相分离，增加反应的最大转化率，提高产品收率。通过建立相平衡与反应平衡的数学模型，将产物在萃取相的浓度最大化作为约束条件来进行CAMD设计萃取剂。
论文成果 More>>
Yang, Rui,Zhuang, Yu,Zhang, Lei,Du, Jian,Shen, Shengqiang.A thermo-economic multi-objective optimization model for simultaneous synthesis of heat exchanger networks including compressors[J],CHEMICAL ENGINEERING RESEARCH & DESIGN,2020,153:120-135
Liu, Qilei,Zhang, Lei,Tang, Kun,Feng, Yixuan,Zhang, Jinyuan,Zhuang, Yu,Liu, Linlin,Du, Jian.Computer-aided reaction solvent design considering inertness using group contribution-based reaction thermodynamic model[J],CHEMICAL ENGINEERING RESEARCH & DESIGN,2019,152:123-133
杨蕊,庄钰,刘琳琳,张磊,都健.功热交换网络综合的研究进展[J],化工进展,2019,38(6):2550-2558
滕佳志,庄钰,杨蕊,武杨,刘琳琳,张磊,都健.基于超结构法的间接式功交换网络综合[J],大连理工大学学报,2019,59(5):441-448
Zhang, Xiang,Zhou, Teng,Zhang, Lei,Fung, Ka Yip,Ng, Ka Ming.Food Product Design: A Hybrid Machine Learning and Mechanistic Modeling Approach[J],INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH,2019,58(36):16743-16752
Liang, Xinyuan,Zhang, Xiang,Zhang, Lei,Liu, Linlin,Du, Jian,Zhu, Xiuling,Ng, Ka Ming.Computer-Aided Polymer Design: Integrating Group Contribution and Molecular Dynamics[J],INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH,2019,58(34):15542-15552
专利
暂无内容
著作成果
化工过程分析与综合
科研项目
促进剂MBT连续化精制溶剂优化选择与分离过程设计, 企事业单位委托科技项目, 2019/03/30-2019/07/01, 进行
万吨级促进剂MBT连续化生产精制溶剂选择与过程设计, 企事业单位委托科技项目, 2018/04/30-2019/01/30, 进行
基于晶体生长机理模型的制药过程结晶溶剂设计方法研究, 国家自然科学基金项目, 2018/08/16, 进行
玉米淀粉加工厂能耗分析及能量优化利用策略, 企事业单位委托科技项目, 2018/08/01-2019/08/01, 进行
南通天泽化工有限公司、大连理工大学合作建天泽化工-大连理工技术研发中心, 企事业单位委托科技项目, 2017/05/23-2021/05/31, 进行
科研团队
暂无内容
基本信息Personal Information
副教授硕士生导师
主要任职：无
性别：男
毕业院校：清华大学
学位：博士
在职信息：在职
所在单位：化工学院
学科：化学工程
办公地点：西部校区化工实验楼D408
电子邮箱：
扫描关注
同专业硕导个人学术主页
研究领域
当前位置: 中文主页 >> 科学研究 >> 研究领域计算机辅助分子/混合物设计(Computer-Aided Molecular/Mixture Design, CAM2D)
结合化学、数学、物理、计算机等方法，对化工产品的机理进行研究，建立产品分子结构与宏观性质之间定量结构—性质关系(Quantitative Structure-Property Relationship, QSPR)，对已知结构的分子进行性质预测；在此基础上，通过给出期望产品的目标性质，利用分子结构与宏观性质之间的定量关系建立数学模型，来设计符合目标性质要求的产品。
· 制药过程反应与结晶单元操作的有机小分子溶剂设计
研究溶剂对液—液均相有机合成过程与溶液结晶过程的溶剂化效应，考察溶剂化自由能与晶面—溶剂吸附能分别对反应速率常数与晶体形貌的作用机制，进而耦合计算机辅助分子设计方法进行溶剂设计，实现反应溶剂催化剂与结晶溶剂的高通量与定向化的设计工作。
· 基于分子动力学的橡胶高分子设计方法研究
利用CAMD方法，逆向从高分子产品需求的性质出发，设计求得满足性质要求的分子结构。首先通过基团贡献法设计出满足性质要求的橡胶聚合物结构；并基于分子动力学模拟技术，探究橡胶高分子分子量、支链结构与特定性质之间的定量关系。
· 耦合机器学习的计算机辅助气味分子设计
解析气味产品特点，分别确定产品的物理化学性质与气味性质。建立机器学习模型来关联分子的描述符及其气味。再运用CAMD方法建立其它性质的模型并求解。得到满足条件的分子结构之后，计算其描述符并代入机器学习预测模型，通过预测是否满足条件来得到产品。
· 考虑过程设计的萃取剂分子设计
针对反应过程，设计一种萃取剂，使得加入的萃取剂可以把反应产物转移到萃取相，与原有的反应相分离，增加反应的最大转化率，提高产品收率。通过建立相平衡与反应平衡的数学模型，将产物在萃取相的浓度最大化作为约束条件来进行CAMD设计萃取剂。
基本信息Personal Information
副教授硕士生导师
主要任职：无
性别：男
毕业院校：清华大学
学位：博士
在职信息：在职
所在单位：化工学院
学科：化学工程
办公地点：西部校区化工实验楼D408
电子邮箱：
扫描关注
同专业硕导个人学术主页
论文成果
当前位置: 中文主页 >> 科学研究 >> 论文成果[1]Yang, Rui,Zhuang, Yu,Zhang, Lei,Du, Jian,Shen, Shengqiang.A thermo-economic multi-objective optimization model for simultaneous synthesis of heat exchanger networks including compressors[J],CHEMICAL ENGINEERING RESEARCH & DESIGN,2020,153:120-135
[2]Liu, Qilei,Zhang, Lei,Tang, Kun,Feng, Yixuan,Zhang, Jinyuan,Zhuang, Yu,Liu, Linlin,Du, Jian.Computer-aided reaction solvent design considering inertness using group contribution-based reaction thermodynamic model[J],CHEMICAL ENGINEERING RESEARCH & DESIGN,2019,152:123-133
[3]杨蕊,庄钰,刘琳琳,张磊,都健.功热交换网络综合的研究进展[J],化工进展,2019,38(6):2550-2558
[4]滕佳志,庄钰,杨蕊,武杨,刘琳琳,张磊,都健.基于超结构法的间接式功交换网络综合[J],大连理工大学学报,2019,59(5):441-448
[5]Zhang, Xiang,Zhou, Teng,Zhang, Lei,Fung, Ka Yip,Ng, Ka Ming.Food Product Design: A Hybrid Machine Learning and Mechanistic Modeling Approach[J],INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH,2019,58(36):16743-16752
[6]Liang, Xinyuan,Zhang, Xiang,Zhang, Lei,Liu, Linlin,Du, Jian,Zhu, Xiuling,Ng, Ka Ming.Computer-Aided Polymer Design: Integrating Group Contribution and Molecular Dynamics[J],INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH,2019,58(34):15542-15552
[7]Li, Weida,Zhuang, Yu,Zhang, Lei,Liu, Linlin,Du, Jian.Economic evaluation and environmental assessment of shale gas dehydration process[J],JOURNAL OF CLEANER PRODUCTION,2019,232:487-498
[8]Zhang, Xiang,Zhang, Lei,Fung, Ka Yip,Ng, Ka Ming.Product design: Incorporating make-or-buy analysis and supplier selection[J],CHEMICAL ENGINEERING SCIENCE,2019,202:357-372
[9]Liu, Qilei,Zhang, Lei,Liu, Linlin,Du, Jian,Meng, Qingwei,Gani, Rafiqul.Computer-aided reaction solvent design based on transition state theory and COSMO-SAC[J],CHEMICAL ENGINEERING SCIENCE,2019,202:300-317
[10]Li, Weida,Zhuang, Yu,Liu, Linlin,Zhang, Lei,Du, Jian.Economic Evaluation and Environmental Assessment of the Shale Gas Sweetening Process[J],CHEMICAL ENGINEERING & TECHNOLOGY,2019,42(4,SI):753-760
[11]Liu, Qilei,Zhang, Lei,Liu, Linlin,Du, Jian,Tula, Anjan Kumar,Eden, Mario,Gani, Rafiqul.OptCAMD: An optimization-based framework and tool for molecular and mixture product design[J],COMPUTERS & CHEMICAL ENGINEERING,2019,124:285-301
[12]Zhuang, Yu,Liu, Linlin,Zhang, Lei,Du, Jian,Shen, Shengqiang.An extended superstructure modeling method for simultaneous synthesis of direct work exchanger networks[J],CHEMICAL ENGINEERING RESEARCH & DESIGN,2019,144:258-271
[13]Zhang, Shuai,Liu, Linlin,Zhang, Lei,Meng, Qingwei,Du, Jian.Optimal planning for regional carbon capture and storage systems under uncertainty[J],Chemical Engineering Transactions,2018,70:1207-1212
[14]San, Hongyu,Meng, Qingwei,Liu, Linlin,Zhang, Lei,Du, Jian.Creative optimization and industrial research of freeze drying process of the cardiomyopeptidin for injection[J],Chemical Engineering Transactions,2018,70:1201-1206
[15]Liu, Linlin,Song, Haodong,Zhang, Lei,Du, Jian.Heat-integrated water allocation network synthesis for industrial parks with sequential and simultaneous design[J],COMPUTERS & CHEMICAL ENGINEERING,2017,108:408-424
[16]刘奇磊,冯锟,刘琳琳,都健,孟庆伟,张磊.基于Dragon描述符与改进的决策树-遗传算法的反应溶剂设计方法[J],化工学报,2018,70(2):533-540
[17]梁馨元,张磊,刘琳琳,都健.基于分子动力学的橡胶聚合物计算机辅助设计方法[J],化工学报,2018,70(2):525-532
[18]郭孝正,刘琳琳,张磊,都健.基于截断器半连续操作的间歇过程性质集成[J],化工学报,2018,70(2):516-524
[19]吴长昊,刘琳琳,张磊,都健.采用两种中间介质的工业园区厂际余热集成[J],化工学报,2018,70(2):431-439,封1
[20]王少靖,刘琳琳,张磊,都健,吴恺艺.集成NGL回收的新型天然气液化系统AP-XTM的概念设计与模拟分析[J],化工学报,2018,70(2):508-515
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副教授硕士生导师
主要任职：无
性别：男
毕业院校：清华大学
学位：博士
在职信息：在职
所在单位：化工学院
学科：化学工程
办公地点：西部校区化工实验楼D408
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当前位置: 中文主页 >> 科学研究 >> 专利共0条0/0
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副教授硕士生导师
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毕业院校：清华大学
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在职信息：在职
所在单位：化工学院
学科：化学工程
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当前位置: 中文主页 >> 科学研究 >> 著作成果化工过程分析与综合
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副教授硕士生导师
主要任职：无
性别：男
毕业院校：清华大学
学位：博士
在职信息：在职
所在单位：化工学院
学科：化学工程
办公地点：西部校区化工实验楼D408
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科研项目
当前位置: 中文主页 >> 科学研究 >> 科研项目促进剂MBT连续化精制溶剂优化选择与分离过程设计, 2019/03/30-2019/07/01, 进行
万吨级促进剂MBT连续化生产精制溶剂选择与过程设计, 2018/04/30-2019/01/30, 进行
基于晶体生长机理模型的制药过程结晶溶剂设计方法研究, 国家自然科学基金, 2018/08/16, 进行
玉米淀粉加工厂能耗分析及能量优化利用策略, 2018/08/01-2019/08/01, 进行
南通天泽化工有限公司、大连理工大学合作建天泽化工-大连理工技术研发中心, 2017/05/23-2021/05/31, 进行
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