朱貽安，教授、博士生導(dǎo)師
電話：021-64253072
傳真：021-64253528
電子郵件：yanzhu@ecust.edu.cn
個人網(wǎng)頁：http://www.qcfkv.cn/2016/0419/c1270a10069/page.htm

https://faculty.ecust.edu.cn/hgxy/zya/main.htm

教育背景：
2002/09–2007/06，華東理工大學(xué)，化工學(xué)院，博士

1998/09–2002/06，華東理工大學(xué)，化工學(xué)院，學(xué)士

工作經(jīng)歷：
2017/07– 至今，華東理工大學(xué)，化工學(xué)院，教授、博士生導(dǎo)師

2016/09–2017/06，華東理工大學(xué)，化工學(xué)院，教授、碩士生導(dǎo)師

2013/01–2014/01，美國斯坦福大學(xué)，化工系，SLAC國家實驗室，訪問學(xué)者

2010/04–2016/08，華東理工大學(xué)，化工學(xué)院，副研究員、碩士生導(dǎo)師

2009/09–2010/03，華東理工大學(xué)，化工學(xué)院，副研究員

2008/08–2009/02，挪威科技大學(xué)，化工系，訪問學(xué)者

2007/07–2009/08，華東理工大學(xué)，化工學(xué)院，講師

所獲榮譽：

1.2024年上海市自然科學(xué)獎二等獎，“基于微觀動力學(xué)分析的輕烴轉(zhuǎn)化催化劑構(gòu)效關(guān)系與性能調(diào)控”（排名1）

2.2023年第二批國家級一流本科課程，“化學(xué)工程與工藝專業(yè)實驗”（排名2）

3.2020年首批國家級一流本科課程，“化學(xué)反應(yīng)工程”（排名3）

4.2018年教育部自然科學(xué)獎二等獎，“納米碳纖維微結(jié)構(gòu)及催化性能的動力學(xué)影響機制”（排名4）

5.2009年上海市優(yōu)秀博士論文，“納米碳纖維生長機理的第一性原理研究”

研究方向：

1.多相催化反應(yīng)動力學(xué)。主要包含低碳烴的活化轉(zhuǎn)化（如甲烷重整、丙烷脫氫）、DMO加氫、氨氧化反應(yīng)、新型電解水等化學(xué)工業(yè)中涉及的或具有應(yīng)用前景的催化反應(yīng)過程穩(wěn)態(tài)及非穩(wěn)態(tài)動力學(xué)；

2.催化劑理性設(shè)計。通過密度泛函理論計算、微觀動力學(xué)分析、動力學(xué)蒙特卡羅模擬、機器學(xué)習(xí)和人工智能算法描述復(fù)雜反應(yīng)過程的微觀圖像、解釋反應(yīng)機理，辨識性能描述符并反向設(shè)計催化新材料；

3.新型納米碳材料與復(fù)合氧化物催化劑。主要包含納米碳纖維、碳納米管、鈣鈦礦等新材料的結(jié)構(gòu)化學(xué)研究，以結(jié)構(gòu)可控的催化材料為平臺，研究底質(zhì)結(jié)構(gòu)調(diào)變活性金屬單原子、納米團簇物化性質(zhì)的普遍規(guī)律。

近年來代表性著作（2020-2025）

1.Xiang-Long Hu, Rui Zhang, Ming Lei, Xing-Gui Zhou, De Chen, Yi-An Zhu^*. Universal descriptors of propane dehydrogenation activity at atomically dispersed metal-X sites (X = O, S, C, and N): Machine learning-powered inverse catalyst design. ACS Catalysis, 2025, 15(12): 10561-77.

2.Jing-Peng Zhang, Ning Zhou, Ming Lei, Xing-Gui Zhou, De Chen, Yi-An Zhu^*. On the importance of thermodynamic consistency to DFT-based microkinetic analysis of complex heterogeneous reactions with multiple pathways. Chemical Engineering Science, 2025, 317: 122078.

3.Han-Jie Xiao, Hui-Han Zheng, Ming Lei, Jing-Hong Zhou, De Chen, Xing-Gui Zhou, Yi-An Zhu^*. On the catalytic behaviors of Cu/SiO₂ and Cu/γ-Al₂O₃ for dimethyl oxalate hydrogenation from microkinetic analysis including a plug flow reactor model. Journal of Catalysis, 2024, 440: 115822.

4.Ping Hu,Ming Lei,Zhi-Jun Sui, Xing-Gui Zhou, De Chen,Yi-An Zhu^*.Identifying the active phase on atomically dispersed catalysts for propane dehydrogenation: Positively charged vs metallic transition metals.ACS Catalysis,2024, 14(11): 8602-18.

5.Yu-Ao Huang, Gong Cheng, Ming Lei, Ming-Lei Yang, De Chen, Xing-Gui Zhou,Yi-An Zhu^*.Decoding the kinetic complexity of Pt-catalyzedn-butane dehydrogenation by machine learning and microkinetic analysis.ACS Catalysis,2024, 14(10): 7978-95.

6.Zi-Hua Niu, Jie Yang,Ze-Yi Zhou, Ming Lei, Zhi-Jun Sui, De Chen, Xing-Gui Zhou,Yi-An Zhu^*.ABO₃perovskite catalyst screening for chemical looping methane partial oxidation from microkinetic analysis.Chemical Engineering Science,2024, 292: 119992.

7.Yue-Xin Wang, Min-Hui Li, Ran Cao, Ming Lei, Zhi-Jun Sui, Xing-Gui Zhou, De Chen, Yi-An Zhu^*.A machine learning-assisted study of propylene adsorption behaviors on transition metals and alloys: Beyond the Dewar-Chatt-Duncanson model. Chem Catalysis, 2024, 4: 100875.

8.Ping Hu, Qing-Yu Chang, Wei Zhang, Ming-Lei Yang, Ming Lei, De Chen, Xing-Gui Zhou, Zhi-Jun Sui^*, Yi-An Zhu^*. Dual Pt atoms stabilized by an optimized coordination environment for propane dehydrogenation. Journal of Catalysis, 2024, 429: 115299.

9.Li-Jun Jing, Wei-Qi Yan, Han-Jie Xiao, Ming Lei, Yue-Qiang Cao, Zhi-Jun Sui, Jing-Hong Zhou, Xing-Gui Zhou, De Chen, Yi-An Zhu^*. Interface-enhanced catalytic performance of TiO₂-supported Cu and Au for dimethyl oxalate hydrogenation: A comparative microkinetic analysis. Chemical Engineering Science, 2023, 281: 119176.

10.Rui-Jia Zhou, Wei-Qi Yan, Yue-Qiang Cao, Jing-Hong Zhou^*, Zhi-Jun Sui, Wei Li, De Chen, Xing-Gui Zhou, Yi-An Zhu^*. Probing the structure sensitivity of dimethyl oxalate partial hydrogenation over Ag nanoparticles: A combined experimental and microkinetic study. Chemical Engineering Science, 2022, 259: 117830.

11.Rui Zhang, Qing-Yu Chang, Fang Ma, Muhammad Zeeshan, Ming-Lei Yang^*, Zhi-Jun Sui, De Chen, Xing-Gui Zhou, Yi-An Zhu^*. Enhanced catalytic performance of transition metal-doped Cr₂O₃ catalysts for propane dehydrogenation: A microkinetic modeling study. Chemical Engineering Journal, 2022, 446: 136913.

12.Jie Yang, Erlend Bjorgum, Hui Chang, Ka-Ke Zhu, Zhi-Jun Sui, Xing-Gui Zhou, Anders Holmen, Yi-An Zhu^*, De Chen^*. On the ensemble requirement of fully selective chemical looping methane partial oxidation over La-Fe-based perovskites. Applied Catalysis B: Environmental, 2022, 301: 120788.

13.Ling Xiao, Ping Hu, Zhi-Jun Sui, De Chen, Xing-Gui Zhou,Wei-Kang Yuan, Yi-An Zhu^*. Rational design of intermetallic compound catalysts for propane dehydrogenation from a descriptor-based microkinetic analysis. Journal of Catalysis, 2021, 404: 32-45.

14.Qing-Yu Chang, Kai-Qi Wang, Zhi-Jun Sui, Xing-Gui Zhou, De Chen, Wei-Kang Yuan, Yi-An Zhu^*. Rational design of single-atom-doped Ga₂O₃ catalysts for propane dehydrogenation: Breaking through volcano plot by Lewis acid-base interactions. ACS Catalysis, 2021, 11(9), 5135-47.

15.Ya-Lan Wang, Xiao-Li Yang, Ling Xiao, Yan-Ying Qi, Jia Yang, Yi-An Zhu^*, Anders Holmen, We-De Xiao, De Chen^*. Descriptor-based microkinetic modeling and catalyst screening for CO hydrogenation. ACS Catalysis, 2021, 11(23): 14545-60.

16.Muhammad Zeeshan, Qing-Yu Chang, Jun Zhang, Ping Hu, Zhi-Jun Sui, Xing-Gui Zhou, De Chen, Yi-An Zhu^*. Effects of oxygen vacancy and Pt doping on the catalytic performance of CeO₂ in propane dehydrogenation: A first-principles study. Chinese Journal of Chemistry, 2021, 39(9): 2391-402.

17.Ya-Xin Yu, Jie Yang, Ka-Ke Zhu, Zhi-Jun Sui, De Chen, Yi-An Zhu^*, Xing-Gui Zhou^*. High-throughput screening of alloy catalysts for dry methane reforming. ACS Catalysis, 2021, 11(14): 8881-94.

18.Ya-Lan Wang, Ping Hu, Jia Yang, Yi-An Zhu^*, De Chen^*. C-H bond activation in light alkanes: A theoretical perspective. Chemical Society Reviews, 2021, 50(7): 4299-358.

19.Ling Xiao, Yu-Ling Shan, Zhi-Jun Sui, De Chen, Xing-Gui Zhou, Wei-Kang Yuan, Yi-An Zhu^*. Beyond the reverse Horiuti-Polanyi mechanism in propane dehydrogenation over Pt catalysts. ACS Catalysis, 2020, 10(24): 14887-902.

20.Qing-Yu Chang, Kai-Qi Wang, Ping Hu, Zhi-Jun Sui, Xing-Gui Zhou, De Chen,Wei-Kang Yuan, Yi-An Zhu^*. Dual-function catalysis in propane dehydrogenation over Pt₁-Ga₂O₃ catalyst: Insights from a microkinetic analysis. AIChE Journal, 2020, 66(7): e16232.

21.Hui Chang, Erlend Bjorgum, Oana Mihai, Jie Yang, Hilde Lea Lein, Tor Grande, Steinar Raaen, Yi-An Zhu^*, Anders Holmen, De Chen^*. Effects of oxygen mobility in La-Fe-based perovskites on the catalytic activity and selectivity of methane oxidation. ACS Catalysis, 2020, 10(6): 3707-19.

代表性項目（主持）

1.國家自然科學(xué)基金（面上），“選擇性氨氧化混合高溫電解水蒸氣固體氧化物陽極材料的理性設(shè)計”；

2.國家自然科學(xué)基金（面上），“金屬-氧化物表界面催化草酸二甲酯選擇性加氫反應(yīng)的催化劑理性設(shè)計”；

3.國家自然科學(xué)基金（重大研究計劃培育項目），“金屬/氧化物協(xié)同催化丙烷脫氫反應(yīng)的機理研究及理性催化劑篩選”；

4.國家自然科學(xué)基金（面上），“甲烷部分氧化反應(yīng)中鈣鈦礦氧化物催化劑的理性設(shè)計”；

5.國家自然科學(xué)基金（青年），“丙烷脫氫-氧化耦合工藝中Pt基核殼雙金屬催化劑作用機制的第一性原理研究”；

6.教育部博士點基金（新教師），“納米碳纖維合成反應(yīng)中合金催化劑設(shè)計的第一性原理研究”；

7.上海市教委“晨光學(xué)者”人才計劃項目，“Ni金屬與Ni/Ag合金催化合成納米碳纖維的機理研究”；

8.上海市自然科學(xué)基金，“低碳烷烴脫氫反應(yīng)動力學(xué)及催化劑理性設(shè)計”；

9.上海市自然科學(xué)基金，“Ni/Fe合金催化劑的組成與魚骨式納米碳纖維形貌關(guān)系的第一性原理研究”；

10.國際合作項目（Yara International & NTNU，聯(lián)培項目），“Fast discovery ofnew functional materials for greening industry”。