近期论文

F. Huang, G. Lu, L. Zhao, H. Li, Z.-X. Wang*, “The catalytic role of N-heterocyclic carbene in a metal-free conversion of carbon dioxide intomethanol: a computational mechanism study”, J. Am. Chem. Soc., 132, 12388-12396, 2010.
L.Zhao, F. Huang, G. Lu, Z.-X. Wang*, P. v. R.Schleyer*, “Why the mechanisms of digermyne and distannyne reactions with H2differ so greatly”, J. Am. Chem. Soc., 134, 8856-8868,2012.
F. Huang, C.-G. Zhang, J.-L.Jiang, Z.-X. Wang*, H.-R. Guan, “How Does the Nickel Pincer Complex Catalyzethe Conversion of CO2 to A Methanol Derivative? A ComputationalMechanistic Study”, Inorg. Chem.,50(8), 3816-3825, 2011.
M. Wen, F. Huang, G. Lu, and Z.-X. Wang*, “Density Functional Theory MechanisticStudy of the Reduction of CO2 to CH4 Catalyzedby an Ammonium Hydridoborate Ion Pair: CO2 Activation viaFormation of a Formic Acid Entity”, Inorg. Chem., 52 (20), 12098–12107, 2013.
F. Huang, J. Jiang, W. Ming, Z.-X.Wang*, “Assessing the Performance of Commonly Used DFT Functionals in Studyingthe Chemistry of Frustrated Lewis Pairs”, J.Theor. Comput. Chem., 13, 1350074-1350089,2014.
W. Gong, F.Huang, C. Sun, X. Zhao, D. Chen*, “Mechanism and Diastereoselectivity ofthe Prebiotic Synthesis of Deoxyribonucleotide Precursors C5-thiazoline:A DFT study” Comput. Theor. Chem.,1033, 1-5, 2014.
X. Gao, F.Huang, J. Feng, X. Chen, H. Zhang, Z.-X. Wang, Q. Wu and D. Zhu*, “Engineeringthe meso-Diaminopimelate Dehydrogenase from Symbiobacterium thermophilum by Site Saturation Mutagenesisfor D-Phenylalanine Synthesis”, Appl. Environ. Microbiol., 79(16),5078-5081, 2013.