陈玉,男,1964年4月生,汉族,辽宁省北镇人,博士,教授,硕士生导师。现任职中国石油大学(北京)克拉玛依校区工学院化工系。1985年6月本科毕业于东北师范大学,2000年12月获德国马堡(Marburg)大学化学系博士学位(Ph.D.)。目前所在学科为化学工程与工艺/物理化学,主要研究方向为催化反应机理理论模拟、理论催化、应用量子化学、分子模拟等。近年来主持国家自然科学基金面上项目3项;在国内外期刊发表论文近60篇,合作翻译德文专著1 本。
办公电话:0990-6633306 E-mail:chenyu@cup.edu.cn
代表性著作:
1、 Huichao Yao, Yu Chen*, Zhen Zhao, Yuechang Wei, Zhichang Liu, Dong Zhai, Baijun Liu,Chunming Xu*, Periodic DFT study on mechanism of selective catalytic reduction of NO via NH3 and O2 over the V2O5 (001) surface: Competitive sites and pathways, Journal of Catalysis, 2013, 305, 67-75
2、Huichao Yao, Yu Chen*, Yuechang Wei, Zhen Zhao, Zhichang Liu, Chunming Xu*, A periodic DFT study of ammonia adsorption on the V2O5 (001), V2O5 (010) and V2O5 (100) surfaces: Lewis versus Brönsted acid sites, Surface Science, 2012, 606(21-22), 1739-1748
3、Yu Chen*, Fuli Zhang, Chunming Xu, Jinsen Gao, Dong Zhai, Zhen Zhao*, Theoretical Investigation of Water-Gas Shift Reaction Catalyzed by Iron Group Carbonyl Complexes M(CO)5 (M = Fe, Ru, Os), J. Phys. Chem. A, 2012, 116(10), 2529-2535
4、Fuli Zhang, Liang Zhao, Chunming Xu, Yu Chen*, Theoretical Revisit of a Fe(CO)5-Catalyzed Water-Gas Shift Reaction, Inorg. Chem., 2010, 49(7), 3278-3281
5、Y. Chen, M. Hartmann, M. Diedenhofen, G. Frenking*, Turning a Transition State into a Minimum - The Nature of the Bonding in Diplumbylene Compounds RPbPbR (R = H, Ar), Angew. Chem. Int. Ed., 2001, 40(11), 2051-2055
6、Y. Chen, W. Petz, G. Frenking*, Is it Possible to Synthesize a Low-Valent Transition Metal Complex with Neutral Carbon Atom as Terminal Ligand? A Theoretical Study of (CO)4FeC, Organometallics, 2000, 19(14), 2698-2706