1.Chun-Fang Huo,Yong-Wang Li, Jianguo Wang, Haijun Jiao, Insight into CH4 Formation in Iron-Catalyzed Fischer-Tropsch Synthesis, J. AM. CHEM. SOC., 2009,131:14713-14721 2.Zhi-Yong Zeng, Yuan-Yuan Xu, Yong-Wang Li, Calculation of solubility parameter using perturbed-chain SAFT and cubic-plus-association equations of state, Ind. Eng. Chem. Res., 2008,47:9663-9669 3.Dong-Bo Cao, Yong-Wang Li, Jianguo Wang, Haijun Jiao, Adsorption and reaction of surface carbon species on Fe5C2(001), J. Phys. Chem. C 2008, 112(38):14883-14890 4.Chun-Fang Huo, Yong-wang Li, Jianguo Wang, Haijun Jiao, Formation of CHx species from CO dissociation on double-stepped Co(0001):exploring Fischer-Tropsch mechanism, J. Phys. Chem. C, 2008, 112:14108-14116 5.Chun-Fang Huo, Yong-wang Li, Jianguo Wang, Haijun Jiao,Adsorption and dissociation of CO as well as CHx coupling and hydrogenation on the clean and oxygen pre-covered Co(0001) surfaces, J. Phys. Chem. C, 2008,112:3840-3848 6.Tao Yang, Xiao-dong Wen, Chun-Fang Huo, Yong-Wang Li, Jianguo Wang, Haijun Jiao, Carburization of the Fe3O4(111) surface, J. Phys. Chem. C, 2008,112:6372-6379 7.Ma, Z.-Y.; Huo, C.-F.; Liao, X.-Y.; Li, Y.-W.; Wang, J.; Jiao, H, Density Functional Theory Study of CO and Hydrogen Co-adsorption on the Fe(111) Surface, J. Phys. Chem. C., 2007, 111(11); 4305-4314. 8.Wang, S.-G.; Liao, X.-Y.; Cao, D.-B.; Li, Y.-W.; Wang, J.; Jiao, H., Formation of Carbon Species on Ni(111): Structure and Stability, J. Phys. Chem. C.; 2007; 111(29): 10894-10903. 9.Shengguang Wang, Xiaoyuan Liao, Dongbo Cao, Chunfang Huo, Yongwang Li, Jianguo Wang, Haijun Jiao, Factors controlling the interaction of CO2 with transition metal surfaces, J. Phys. Chem. C., 2007, 111(45):16934-16940 10.Zhang F Q, Zhang X M, Wu H S, Li Y W, Jiao H, Inversed stability order in Keggin polyoxothiometalate isomers: A DFT study of 12-electron reduced and [(MoO4)Mo12O12S12(OH)12]2- anions, J. Phys. Chem.A, 2007, 111(9):1683-1687 11.Zhang J, Jiang T, Han B, Zhu A, Ma X, Zhou Y, Bai L,Xiang H, Li Y, Effect pressure on the selectivity for the esterification of ethylene glycol with propionic acid in supercritical CO2, J.Phys. Chem. B, 2007,111(19):5322-5325 12.Cheng-Hua Zhang, Yong Yang, Bo-Tao Teng, Ting-Zhen Li, Hong-Yan Zheng, Hong-Wei Xiang, Yong-Wang Li, Study of an iron-manganese Fischer-Tropsch synthesis catalyst promoted with copper, J. Catal.,2006,237(2):405-415 13.Bo-Tao Teng, Jie Chang, Cheng-Hua Zhang, Dong-Bo Cao, Jun Yang, Ying Liu, Xiao-Hui Guo, Hong-Wei Xiang, Yong-Wang Li, A comprehensive kinetics model of Fischer-Tropsch synthesis over an industrial Fe-Mn catalyst, Appl. Catal. A,2006,301(1):39-50 14.Hong-Yan Zheng, Yu-Lei Zhu, Zong-Qing Bai, Long Huang, Hong-Wei Xiang, Yong-Wang Li, An environmentally benign process for the efficient synthesis of cyclohexanone and 2-methylfuran, Green Chemistry, 2006, 8(1):107-109 15.Sheng-Guang Wang; Dong-Bo Cao; Yong-Wang Li; Jianguo Wang; Haijun Jiao,CO2 Reforming of CH4 on Ni(111): A Density Functional Theory Calculation, J. Phy. Chem. B, 2006,110 (20),9976-9983 16.Xiao-dong Wen, Yong-Wang Li;Jianguo Wang; Haijun Jiao, NO Adsorption on MoSx Clusters: A Density Functional Theory Study, J. Phys. Chem. B, 2006,110(42), 21060-21068 17.Xiao-dong Wen, Zhi Cao, Yong-Wang Li; Jianguo Wang; Haijun Jiao,Structure and Energy of Mo27SxCy Clusters: A Density Functional Theory Study, J. Phy. Chem. B, 2006,110 (47),23860-23869 18.Jun Ren; Chun-Fang Huo;Xiao-dong Wen; Zhi Cao Jianguo Wang;Yong-Wang Li;Haijun Jiao, Thiophene Adsorption and Activation on MoP(001), γ-Mo2N(100), and Ni2P(001): Density Functional Theory Studies, J. Phy. Chem. B, 2006,110 (45), 22563-22569 19.Yong Yang, Hongwei Xiang, Rongle Zhang, Bing Zhong,Yongwang Li, A highly active and stable Fe-Mn catalyst for slurry Fischer-Tropsch synthesis, Catal. Today, 2005,106,170-175 20.Huo C.-F.; Li Y.-W.; Beller M.; Jiao H., Hydroformylation and isomerization of allene and propyne: A density functional theory study, Chem. Eur. J., 2005,11, 889-902 21.Huo C.-F.; Li Y.-W.; Beller M.; Jiao H., Regioselective hydroformylation of butadiene: Density functional Studies, Organometallics, 2005,24, 3634-3643 22.Cao D.-B.; Zhang F.-Q.; Li Y.-W., Wang J. G.; Jiao H., Density functional theory study of hydrogen adsorption on Fe5C2(001), Fe5C2(110), and Fe5C2(100), J. Phys. Chem. B, 2005,109, 833-844 23.Zeng T.; Wen X.-D.; Wu G.-S.; Li Y.-W.; Jiao H., Density functional theory study of CO adsorption on molybdenum sulfide, J. Phys. Chem. B, 2005,109, 2846-2854 24.Cao D.-B.; Zhang F.-Q.; Li Y.-W.,Wang J. G.; Jiao H., Structures and energies of coadsorbed CO and H2 on Fe5C2(001), Fe5C2(110), and Fe5C2(100), J. Phys. Chem. B, 2005,109, 10922-10935 25.Chun-Fang Huo, Yong-Wang Li, Matthias Beller, Haijun Jiao, Acetylene Hydroformylation with HCo(CO)3 as Catalyst. A Density Functional Study, Organometallics, 2004,23(4), 765-773 26.Yong Yang, Hong-Wei Xiang, Yuan-Yuan Xu, Liang Bai, Yong-Wang Li, Effect of potassium promoter on precipitated iron-manganese catalyst for Fischer-Tropsch synthesis, Appl. Catal. A, 2004,266,181-194 27.Chun-Fang Huo, Yong-Wang Li, Matthias Beller, and Haijun Jiao, Co(CO)3 -Catalyzed Propene Hydroformylation Insight into Detailed Mechanism, Organometallics, 2003,22, 4665-4677 28.Jun Yang, Ying Liu, Jie Chang, Yi-Ning Wang, Liang Bai, Yuan-Yuan Xu, Hong-Wei Xiang, Yong-Wang Li, Bing Zhong, Detailed kinetics of Fischer-Tropsch synthesis on an industrial Fe-Mn ultrafine particle iron catalyst, Ind. Eng. Chem. Res., 2003,42(21), 5066-5090 29.Yi-Ning Wang, Yuan-Yuan Xu, Yong-Wang Li, Yu-Long Zhao, Bi-Jiang Zhang, Heterogeneous Modeling for Fixed Bed Fischer-Tropsch Synthesis: reactor model and its applications, Chem. Eng. Sci., 2003,58, 867-875 30.Yulei Zhu, Hongwei Xiang, Guisheng Wu, Liang Bai, Yongwang Li, A novel route for synthesis of gamma-butyrolactone through the coupling of hydrogenation and dehydrogenation, Chem. Comm. 2002,3:254-255 |