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43) Q. Li, W. Chen, H. Xiao, Y. Gong, Z. Li, L. Zheng, X. Zheng, W. Yan, W.‐C. Cheong, R. Shen, N. Fu, L. Gu, Z. Zhuang, C. Chen, D. Wang, Q. Peng, J. Li, Y. Li, "Fe Isolated Single Atoms on S, N Codoped Carbon by Copolymer Pyrolysis Strategy for Highly Efficient Oxygen Reduction Reaction", Adv. Mater. 2018, 30(25), 1800588, DOI: 10.1002/adma.201800588
42) J. Yu, B. Zhang, Y. Zhang, C.-Q. Xu, W. Zhuo, J. Ge, J. Li, N. Gao, Y. Li, M. Yang, "A Binding-Block Ion Selective Mechanism Revealed by a Na/K Selective Channel", Protein Cell 2018, 9(7), 629-639, DOI: 10.1007/s13238-017-0465-8
41) X. Wang, H. Xiao, A. Li, Z. Li, S. Liu, Q. Zhang, Y. Gong, L. Zheng, Y. Zhu, C. Chen, D. Wang, Q. Peng, L. Gu, X. Han, J. Li, Y. Li, “Constructing NiCo/Fe3O4 Heteroparticles within MOF-74 for Efficient Oxygen Evolution Reactions”, J. Am. Chem. Soc. 2018, 140 (45), 15336–15341, DOI: 10.1021/jacs.8b08744
40) G. Xiang, Y. Tang, Z. Liu, W. Zhu, H. Liu, J. Wang, G. Zhong, J. Li, X. Wang, “Probing Ligand-Induced Cooperative Orbital Redistribution That Dominates Nanoscale Molecule-Surface Interactions with One-Unit-Thin TiO2 Nanosheets”, Nano Lett. 2018, 18(12), 7809-7815, DOI: 10.1021/acs.nanolett.8b03572
39) Y.-F. Jiang, X.-L. Ma, J.-B. Lu, J.-Q. Wang, H. Xiao, J. Li, “N2 Reduction on Fe-Based Complexes with Different Supporting Main-Group Elements: Critical Roles of Anchor and Peripheral Ligand”, Small Methods 2018, 1800340, DOI: 10.1002/smtd.201800340
38) W.-L. Li, C. Ertural, D. Bogdanovski, J. Li, R. Dronskowski, “Chemical Bonding of Crystalline LnB6 (Ln=La−Lu) and Its Relationship with Ln2B8 Gas-Phase Complexes”, Inorg. Chem. 2018, 57(20), 12999-13008, DOI: 10.1021/acs.inorgchem.8b02263
37) C. Liu, L.-J. Li, I. A. Popov, R. J. Wilson, C.-Q. Xu, J. Li, A. I. Boldyrev, Z.-M. Sun, “Symmetry Reduction upon Size Mismatch: The Non-Icosahedral Intermetalloid Cluster [Co@Ge12]3− ", Chin. J. Chem. 2018, 36(12), 1165-1168, DOI: 10.1002/cjoc.201800434
36) G.-Q. Ren, Y. Tang, K.-P. Liu, Y. Su, S. Miao, W. Liu, W.-M. Cong, X.-D. Wang, W.-Z. Li, J. Li, T. Zhang, "Exceptional Antisintering Gold Nanocatalyst for Diesel Exhaust Oxidation", Nano Lett. 2018, 18(10), 6489-6493, DOI: 10.1021/acs.nanolett.8b03003
35) J.-C. Liu, Y. Tang, Y.-G. Wang, T. Zhang, J. Li, "Theoretical Understanding of the Stability of Single-Atom Catalysts", Natl. Sci. Rev. 2018, 5(5), 638-641, DOI:10.1093/nsr/nwy094
34) M. Hu, S. Zhao, S. Liu, C. Chen, W. Chen, W. Zhu, C. Liang, W.-C. Cheong, Y. Wang, Y. Yu, Q. Peng, K. Zhou, J. Li, Y. Li, “MOF-Confined Sub-2 nm Atomically Ordered Intermetallic PdZn Nanoparticles as High-Performance Catalysts for Selective Hydrogenation of Acetylene”, Adv. Mater. 2018, 30, 1801878, DOI: 10.1002/adma.201801878
33) J.-B. Liu, X. Chen, J.-B. Lu, H.-Q. Cui, J. Li, “Polarizable Force Field Parameterization and Theoretical Simulations of ThCl4-LiCl Molten Salts”, J. Comp. Chem. 2018, 39(29), 2432-2438, DOI: 10.1002/jcc.25558
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31) W.-L. Li, T.-T. Chen, D.-H. Xing, X. Chen, J. Li, L.-S. Wang, “Observation of Highly Stable and Symmetric Lanthanide Octa-Boron Inverse Sandwich Complexes”, Proc. Natl. Acad. Sci. USA 2018, 115(30), E6972-E6977, DOI: 10.1073/pnas.1806476115
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29) X. Zhang, W. Li, L. Feng, X. Chen, A. Hansen, S. Grimme, S. Fortier, D.-C. Sergentu, T. J. Duignan, J. Autschbach, S. Wang, Y. Wang, G. Velkos, A. A. Popov, N. Aghdassi, S. Duhm, X. Li, J. Li, L. Echegoyen, W.H.E. Schwarz, N. Chen, “A Diuranium Carbide Cluster Stabilized inside a C80 Fullerene Cage”, Nature Commun. 2018, 9, 2753, DOI: 10.1038/s41467-018-05210-8
28) X. Chen, M. S. Jørgensen, J. Li, B. Hammer, "Atomic Energies from a Convolutional Neural Network", J. Chem. Theory Comput. 2018, 14(7), 3933-3942, DOI: 10.1021/acs.jctc.8b00149
27) S. Wei, A. Li , J.-C. Liu , Z. Li , W. Chen , Y. Gong , Q. Zhang , W.-C. Cheong , Y. Wang , L. Zheng , H. Xiao , C. Chen , D. Wang , Q. Peng , L. Gu , X. Han , J. Li, Y. Li, "Direct Observation of Noble Metal Nanoparticles Transforming to Thermal Stable Single Atoms", Nature Nanotech. 2018, 13, 856-861, DOI: 10.1038/s41565-018-0197-9
26) W. Wang, C.-Q. Xu, Y. Fang, Y. Zhao, J. Li, X. Wang, “An Isolable Diphosphene Radical Cation Stablized by Three-Center Three-Election π-Bonding with Chromium: End-on versus Side-on Coordination”, Angew. Chem. Int. Ed. 2018, 57(30), 9419-9424, DOI: 10.1002/anie.201805115 and Angew. Chem. 2018, 130(30), 9563-9568, DOI:10.1002/ange.201805115
25) B. Tang, W.-L. Li, Y. Jiao, J.-B. Lu, J.-F. Xu, Z. Wang, J. Li, X. Zhang, "A Supramolecular Radical Cation: Folding-Enhanced Electrostatic Effect for Promoting Radical-Mediated Oxidation", Chem. Sci. 2018, 9(22), 5015-5020, DOI: 10.1039/c8sc01434e
24) A. Wang, J. Li, T. Zhang, “Heterogeneous Single-Atom Catalysis”, Nature Rev. Chem. 2018, 2, 65-81, DOI: 10.1038/s41570-018-0010-1
23) Y. Dong, Y. Mu, Y. Xie, Y. Zhang, Y. Han, Y. Zhou, W. Wang, Z. Liu, M. Wu, H. Wang, M. Pan, N. Xu, C.-Q. Xu, M. Yang, S. Fan, H. Deng, T. Tan, X. Liu, L. liu, J. Li, J. Wang, X. Fang, Y. Feng, "Structural Basis of Ubiquitin Modification by the Legionella Effector SdeA", Nature 2018, 557, 674-678, DOI:10.1038/s41586-018-0146-7
22) K. Ahmad, C.-R. Chang, J. Li, "Mechanistic Investigations of Co(II)-Catalyzed C-N Coupling Reactions", J. Organomet. Chem. 2018, 868, 144-153, DOI: 10.1016/j.jorganchem.2018.05.013
21) W. Liu, Y. Chen, H. Qi, L. Zhang, W. Yan, X. Liu, X. Yang, S. Miao, W. Wang, C. Liu, A. Wang, J. Li, T. Zhang, “A Durable Nickel Single-Atom Catalyst for Hydrogenation Reactions and Cellulose Valorization under Harsh Conditions”, Angew. Chem. Int. Ed. 2018, 57(24), 7071-7075, DOI: 10.1002/anie.201802231 and Angew. Chem. 2018, 130(24), 7189-7193, DOI: 10.1002/ange.201802231
20) G. Ou, Y. Xu, B. Wen, R. Lin, B. Ge, Y. Tang, Y. Liang, C. Yang, K. Huang, D. Zu, R. Yu, W. Chen, J. Li, H. Wu, L.-M. Liu, Y. Li, "Tuning Defects in Oxides at Room Temperature by Lithium Reduction", Nature Commun. 2018, 9, 1302, DOI: 10.1038/s41467-018-03765-0
19) W.-L. Li, J.-B. Lu, Z.-L. Wang, H.-S. Hu, J. Li, "Relativity−Induced Bonding Pattern Change in Coinage Metal Dimers M2 (M = Cu, Ag, Au, Rg)", Inorg. Chem. 2018, 57(9), 5499-5506, DOI: 10.1021/acs.inorgchem.8b00438
18) J.-C. Liu, X.-L. Ma, Y. Li, Y.-G. Wang, H. Xiao, J. Li, "Heterogeneous Fe3 Single-Cluster Catalyst for Ammonia Synthesis via An Associative Mechanism", Nature Commun. 2018, 9, 1610, DOI: 10.1038/s41467-018-03795-8
17) T. Li, F. Liu, Y. Tang, L. Li, S. Miao, Y. Su, J. Zhang, J. Huang, H. Sun, M. Haruta, A. Wang, B. Qiao, J. Li, T. Zhang, "Maximizing the Number of Interfacial Sites in Single-Atom Catalyst for the Highly Selective, Solvent-Free Oxidation of Primary Alcohol", Angew. Chem. Int. Ed. 2018, 57(26), 7795-7799, DOI: 10.1002/anie.201803272 and Angew. Chem. 2018, 130(26), 7921-7925, DOI: 10.1002/ange.201803272
16) Y. Yi, B. Adrjan, J. Wlodarz, J. Li, K. Jackowski, S. Roszak, "NMR Measurements and DFT Studies of Nuclear Magnetic Shielding in Emodin and Chuanxiongzine Molecules", J. Mol. Struct. 2018, 1166, 304-310, DOI: 10.1016/j.molstruc.2018.04.053
15) Y. Wang, H. Zhuo, X. Zhang, X. Dai, K. Yu, C. Luan, L. Yu, Y. Xiao, J. Li, M. Wang, F. Gao, "Synergistic Effect between Undercoordinated Platinum Atoms and Defective Nickel Hydroxide on Enhanced Hydrogen Evolution Reaction in Alkaline Solution", Nano Energy 2018, 48, 590-599, DOI: 10.1016/j.nanoen.2018.03.080
14) J.-B. Lu, X.-L. Ma, J.-Q. Wang, J.-C. Liu, H. Xiao, J. Li, "Efficient Nitrogen Fixation via a Redox-Flexible Single-Fe-Site With Reverse-Dative Fe→B σ Bonding", J. Phys. Chem. A 2018, 122(18), 4530-4537, DOI: 10.1021/acs.jpca.8b02089
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3) X.-L. Ma, J.-C. Liu, H. Xiao, J. Li, "Surface Single-Cluster Catalyst for N2-to-NH3 Thermal Conversion", J. Am. Chem. Soc. 2018, 140(1), 46-49, DOI: 10.1021/jacs.7b10354
2) S. Zhang, Y. Tang, L. Nguyen, Y.-F. Zhao, Z. Wu, T.-W. Goh, J. J. Liu, Y. Li, T. Zhu, W. Huang, A. I. Frenkel, J. Li, F. F. Tao,"Catalysis on Singly Dispersed Rh Atoms Anchored on an Inert Support" , ACS Catal. 2018, 8(1), 110-121, DOI: 10.1021/acscatal.7b01788
1) J.-Q. Wang, C. Chi, H.-S. Hu, L. Meng, M. Luo, J. Li, M. Zhou, "Triple Bonds Between Iron and Heavier Group 15 Elements in AFe(CO)3- (A = As, Sb, Bi) Complexes", Angew. Chem. Int. Ed. 2018, 57(2), 542-546, DOI: 10.1002/anie.201709875 and Angew. Chem. 2018, 130(2), 551-555, DOI: 10.1002/ange.201709875
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