余英哲
- 教师名称：余英哲
- 教师拼音名称：Yu Yingzhe
- 性别：女
- 职务：博导
- 职称：教授
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基本信息
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论文成果
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Yingzhe Yu is currently an Professor at R&D Center for Petrochemical Technology, Tianjin University. Her research interests focus on simulation and design of chemical processes using multi-scale methods.
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- Y. Yu, X. Sun, M. Zhang, Insight into carbon formation from acetic acid decomposition over Pd(100) via density functional theory calculations, Surf. Sci., 664 (2017) 226-232..2019
- M. Zhang, X. Wu, X. Huang, B. Yang, Y. Yu, DFT investigations on the conversion of acetylene to undesired vinyl acetylene during vinyl acetate synthesis, Comput. Theoret. Chem., 1115 (2017) 253-260..2019
- K. Yang, M. Zhang, Y. Yu, Theoretical insights into the effect of terrace width and step edge coverage on CO adsorption and dissociation over stepped Ni surfaces, Phys. Chem. Chem. Phys., 19 (2017) 17918-17927..2019
- K. Yang, M. Zhang, Y. Yu, Methane formation from successive hydrogenation of C over stepped Ni and Ni3Fe surfaces: Effect of surface composition, Int. J. Hydrogen Energy, 42 (2017) 914-927..2019
- K. Yang, M. Zhang, Y. Yu, Effect of transition metal-doped Ni(211) for CO dissociation: Insights from DFT calculations, Appl. Surf. Sci., 399 (2017) 255-264..2019
- B. Ren, X. Dong, Y. Yu, M. Zhang, A density functional theory study on the acetylene cyclotrimerization on Pd-modified Au(111) surface, Surf. Sci., 664 (2017) 147-154..2019
- B. Ren, X. Dong, Y. Yu, G. Wen, M. Zhang, A density functional theory study on the carbon chain growth of ethanol formation on Cu-Co (111) and (211) surfaces, Appl. Surf. Sci., 412 (2017) 374-384..2019
- J. Lu, X. Dong, Y. Yu, M. Zhang, Comparison of the conversion of ethylene to ethylidyne on Pd-Au(100): A density functional study, Appl. Surf. Sci., 423 (2017) 762-770..2019
- Y. Huang, X. Dong, Y. Yu, M. Zhang, Kinetic Monte Carlo study of vinyl acetate synthesis from ethylene acetoxylation on Pd(100) and Pd/Au(100), Appl. Surf. Sci., 423 (2017) 793-799..2019
- Y. Wang, X. Dong, Y. Yu, M. Zhang, Ethylene decomposition over Pt(100): A mechanism study from first principle calculation, Appl. Surf. Sci., 390 (2016) 984-992..2019
- Y. Wang, X. Dong, Y. Yu, M. Zhang, Investigation on the conversion of ethylene to ethylidyne on Pt(100) and Pd(100) using density functional theory, Phys. Chem. Chem. Phys., 18 (2016) 26949-26955..2019
- Y. Huang, X. Dong, Y. Yu, M. Zhang, The influence of surface oxygen and hydroxyl groups on the dehydrogenation of ethylene, acetic acid and hydrogenated vinyl acetate on pure Pd(1 0 0): A DFT study, Appl. Surf. Sci., 388, Part A (2016) 455-460..2019
- Y. Huang, X. Dong, Y. Yu, M. Zhang, A comprehensive comparative DFT study on adsorption and reactions involved in vinyl acetate synthesis from acetoxylation of ethylene on pure Pd(100) and Pd-Au(100): Elucidating the role of Au, Appl. Surf. Sci., 387 (2016) 1021-1028..2019
- Y. Huang, X. Dong, Y. Yu, The Influence of Surface Oxygen and Hydroxyl Groups on the Dehydrogenation of Ethylene, Acetic Acid and Hydrogenated Vinyl Acetate on Pd/Au(100): A DFT Study, Catal. Lett., 146 (2016) 2516-2533..2019
- Y. Huang, X. Dong, Y. Yu, Surface carbon species formation from ethylene decomposition on Pd(100): a first-principles-based kinetic Monte Carlo study, RSC Adv., 6 (2016) 65349-65354..2019
- Y. Huang, X. Dong, Q. Hao, Y. Yu, M. Zhang, Comparison of the coupling of ethylene with acetate species and ethylene dehydrogenation on Pd-Au(100): a density functional study, Catal. Sci. Technol., 6 (2016) 555-568..2019
- M. Gao, M. Zhang, Y. Yu, Study on the Reaction Species of 1, 3-Butadiene Formation from Bio-ethanol on ZrO2, Catal. Lett., 146 (2016) 2450-2457..2019
- M. Zhang, K. Yang, Y. Yu, Insight into carbon formation from ethylene decomposition over Pd(1 0 0) via density functional theory calculations, Appl. Surf. Sci., 328 (2015) 583-590..2019
- M. Zhang, K. Yang, N. Wang, Y. Yu, Combined DFT and experimental studies of properties of TiO2 modified USY zeolite, J. Porous Mater., 22 (2015) 595-602..2019
- M. Zhang, B. Yang, Y. Yu, A density functional theory study on the conversion of ethylene to carbon monomer on PdAu(1 0 0) surface, Appl. Surf. Sci., 356 (2015) 1252-1261..2019
- M. Zhang, Z. Geng, Y. Yu, Density Functional Theory (DFT) study on the pyrolysis of cellulose: The pyran ring breaking mechanism, Comput. Theoret. Chem., 1067 (2015) 13-23..2019
- M. Zhang, M. Gao, J. Chen, Y. Yu, Study on key step of 1,3-butadiene formation from ethanol on MgO/SiO2, RSC Adv., 5 (2015) 25959-25966..2019
- K. Yang, M. Zhang, Y. Yu, Direct versus hydrogen-assisted CO dissociation over stepped Ni and Ni3Fe surfaces: a computational investigation, Phys. Chem. Chem. Phys., 17 (2015) 29616-29627..2019
- Y. Huang, X. Dong, M. Li, Y. Yu, A density functional theory study on ethylene formation and conversion over P modified ZSM-5, Catal. Sci. Technol., 5 (2015) 1093-1105..2019
- Y. Huang, X. Dong, Y. Dong, Y. Yu, A Molecular Dynamics simulation study on nitrobenzene and OH radical in supercritical water, J. Mol. Liq., 206 (2015) 278-284..2019
- X. Dong, Z. Gan, X. Lu, W. Jin, Y. Yu, M. Zhang, Study on catalytic and non-catalytic supercritical water oxidation of p-nitrophenol wastewater, Chem. Eng. J., 277 (2015) 30-39..2019
- M. Zhang, K. Yang, X. Zhang, Y. Yu, Effect of Ni(111) surface alloying by Pt on partial oxidation of methane to syngas: A DFT study, Surf. Sci., 630 (2014) 236-243..2019
- M. Zhang, Y. Huang, R. Li, G. Li, Y. Yu, A DFT Study of Ethanol Adsorption and Dehydrogenation on Cu/Cr2O3 Catalyst, Catal. Lett., 144 (2014) 1978-1986..2019
- M. Zhang, M. Gao, Q. Li, M. Tao, Y. Yu, DFT study on effect of CO on the system of acetoxylation of ethylene to vinyl acetate, RSC Adv., 4 (2014) 17709-17716..2019
- N. Wang, M. Zhang, Y. Yu, Density functional calculations on the distribution of Ti in a Y zeolite and its influence on acidity, RSC Adv., 4 (2014) 4324-4329..2019
- J. Ma, X. Dong, Y. Yu, B. Zheng, M. Zhang, The effects of alkalis on the dechlorination of o-chlorophenol in supercritical water: Molecular dynamics simulation and experiment, Chem. Eng. J., 241 (2014) 268-272..2019
- J. Li, K. Fan, X. Guan, Y. Yu, J. Song, Self-Assembly Mechanism of 1,3:2,4-Di(3,4-dichlorobenzylidene)-d-sorbitol and Control of the Supramolecular Chirality, Langmuir, 30 (2014) 13422-13429..2019
- Y. Huang, X. Dong, M. Li, M. Zhang, Y. Yu, Density Functional Theory study of the structural and electronic properties of H3PO4/ZSM-5, RSC Adv., 4 (2014) 14573-14581..2019
- X. Dong, Y. Wang, X. Li, Y. Yu, M. Zhang, Process Simulation of Laboratory Wastewater Treatment via Supercritical Water Oxidation, Ind. Eng. Chem. Res., 53 (2014) 7723-7729..2019
- X. Dong, Q. Liu, L. Cui, Y. Yu, M. Zhang, Molecular simulation and experimental study on propylene dehumidification through a PVA-PAA blend membrane, J. Mater. Chem. A, 2 (2014) 16687-16696..2019
- M. Zhang, Y. Yu, Y. Zhang, DFT research of methane preliminary dissociation on aluminum catalyst, Appl. Surf. Sci., 280 (2013) 15-24..2019
- M. Zhang, Y. Yu, Dehydration of Ethanol to Ethylene, Ind. Eng. Chem. Res., 52 (2013) 9505-9514..2019
- M. Zhang, Q. Hao, Y. Yu, Pd/Au(1 0 0) alloy for vinyl acetate synthesis: Effects of surface properties on reagents adsorption, Comput. Theoret. Chem., 1019 (2013) 33-38..2019
- M. Zhang, J. Chen, Y. Yu, Y. Zhang, DFT study on the structure of Ni/α-Al2O3 catalysts, Appl. Surf. Sci., 287 (2013) 97-107..2019
- N. Wang, M. Zhang, Y. Yu, Distribution of aluminum and its influence on the acid strength of Y zeolite, Microporous Mesoporous Mater., 169 (2013) 47-53..2019
- M. Zhang, R. Li, Y. Yu, A DFT Study on the Structure and Properties of Cu/Cr2O3 Catalyst, Chin. J. Chem . 30 (2012) 771-778..2019
- R. Li, M. Zhang, Y. Yu, A DFT study on the Cu (1 1 1) surface for ethyl acetate synthesis from ethanol dehydrogenation, Appl. Surf. Sci., 258 (2012) 6777-6784..2019
- Z. Geng, M. Zhang, Y. Yu, Theoretical investigation on pyrolysis mechanism of glycerol, Fuel, 93 (2012) 92-98..2019
- M. Zhang, Z. Geng, Y. Yu, Density Functional Theory (DFT) Study on the Dehydration of Cellulose, Energy & Fuels, 25 (2011) 2664-2670..2019
教育经历
- 2003.9-2006.3 Tianjin University Chemical Technology Master of Engineering
- 2007.9-2012.6 Tianjin University Chemical Technology Doctor of Engineering
- 1998.9-2002.6 Tianjin University Chemical Engineering and Technology Bachelor of Engineering
工作经历
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2022.7 - 至今
|R&D Center for Petrochemical Technology|Professor
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2014.6 -2019.12
|R&D Center for Petrochemical Technology|Associate Professor
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2009.7 -2014.6
|R&D Center for Petrochemical Technology|Assistant Professor