MOF材料的设计合成及其在催化与分离过程中的应用，工业气体中微量杂质的脱除

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天津市可再生能源学会理事

主持国家自然科学基金项目和教育部留学回国启动基金项目各一项，作为主要参加人参与国家重点研发计划和国家自然科学基金重点项目共2项。注重从应用基础研究到实际工程技术的转化，作为子项负责人承担工程项目3项。多次参加国际和国内学术交流活动，多次指导学生参加IChemE设计和课外学术竞赛。在ACS Applied Materials & Interfaces等期刊上发表论文70余篇。

一、MOF材料在低温SCR脱硝反应中的应用

确定了含不饱和金属位的MOF材料的优异的低温脱硝活性，初步探索活化及反应机理。选择了具有配位不饱和金属位的M-MOF-74作为低温SCR反应的催化剂进行探索性研究。研究了M-MOF-74中的配位不饱和金属位作为催化活性中心的特殊性质，考察了MOF催化材料对低温SCR过程的影响。获得国家自然科学基金一项。

二、MOF材料在醋酸体系中痕量碘脱除的应用，

研究了碘分子在不同结构的MOF材料的吸附作用规律，为工业上碘分离材料的设计提供科学依据。基于碘的毒性以及其较强的挥

1. Jiang, Haoxi; Wang, Qianyun; Wang, Huiqin; Chen, Yifei*; Zhang, Minhua*. MOF-74 as an Efficient Catalyst for the Low-Temperature Selective Catalytic Reduction of NOx with NH3, ACS Applied Materials & Interfaces, 2016, 8(40): 26817~26826.

2. Minhua Zhang, Rui Yao, Haoxi Jiang, Yifei Chen*. Insights into the mechanism of acetic acid hydrogenation to ethanol on Cu(111) surface. Applied Surface Science, 2017, 412: 342-349

3. Minhua Zhang, Wenyi Wang, Yifei Chen*. Insight of DFT and ab initio atomistic thermodynamics on the surface stability and morphology of In2O3, Applied Surface Science, 2018, 434, 1344-1352

4. Yifei Chen#, Ziwei Zhai#, Jiatao Liu, Jia Zhang, Zhongfeng Geng*, Huisheng Lyu. The synergistic effects of Cu clusters and In2O3 on ethanol synthesis from acetic acid hydrogenation, Physical Chemistry Chemical Physics, 2019, 21(43): 23906-23915 (2019 hot paper)

5. Minhua Zhang, Song Yin, Yifei Chen*, A DFT study for CO2 hydrogenation on W(111) and Ni-doped W(111) surfaces, Physical Chemistry Chemical Physics, 2020,22 17106-17116 (2020 hot paper)

6. Yifei Chen, Yang Gao, Lingtao Wang, Hao Gong*, The mechanism of MOF as a heterogeneous catalyst for propene hydroformylation: a DFT study, Reaction Chemistry & Engineering, 2022, 7, 1156

7. Yiduo Wang, Cheng Liu, He Dong, Yifei Chen*, Insight into the mechanism of the key step for the production of 1,4-butanediol on Ni(111) surface: A DFT study, Molecular Catalysis, 2022, 524: 112335

8. Xiuqin Dong, Chen Xin, Lingtao Wang, Hao Gong, Yifei Chen*, The role of metal nodes on Rh coordinated MOFs for Hydroformylation of n-butene, Applied Catalysis A, General, 2022, 118848

9. Minhua Zhang, Lin Liu, Qinghua Li, Hao Gong, Yifei Chen*, Theoretical Design of MOFs and PSA Process for Efficient Separation of CF4/NF3, Industrial & Engineering Chemistry Research, 2023, 62, 7103−7113

10. Yifei Chen，Yongru You, Chen Xin, Xiuqin Dong, Hao Gong*, Rational design of ligand-immobilized Rh/IRMOFs catalysts for 1-butene hydroformylation with high regioselectivity, Journal of Environmental Chemical Engineering, 2024, 12，114163

11. 龚奇菡， 陈毅飞， 崔佳，姜浩锡，吕雉，董秀芹，耿中峰，张上，李兆飞，马安，一种高稳定性的金属有机骨架材料、其制备方法及应用，中国CN202010248149.7