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Fangjia Fu,Kang Liao,Jing Ma, Zheng Cheng,Dong Zheng,Liuzhou Gao,Chungen Liu*,Shuhua Li and Wei Li*, "How intermolecular interactions influence electronic absorption spectra: insights from the molecular packing of uracil in condensed phases", Phys. Chem. Chem. Phys. 2019,40,1130 PDF
Qingchun Wang,Jingxiang Zou,Enhua Xu,Peter Pulay* and Shuhua Li* "Automatic Construction of the Initial Orbitals for Efficient Generalized Valence Bond Calculations of Large Systems ", J. Chem. Theory Comput. 2019,15,141 learn more PDF
Guoqiang Wang, Liuzhou Gao, Hui Chen, Xueting Liu, Jia Cao, Shengda Chen, Xu Cheng, and Shuhua Li*, "Chemoselective Borane-Catalyzed Hydroarylation of 1,3-Dienes with Phenols ", Angew. Chem. Int. Ed.
,2019,58,1694 learn more PDF
Jia Cao, Guoqiang Wang, Liuzhou Gao, Hui Chen, Xueting Liu, Xu Cheng and Shuhua Li* , "Perfluoroalkylative pyridylation of alkenes via 4-cyanopyridine-boryl radicals ", Chem. Sci.
,2019,10, 2767 learn more PDF
Weipeng Li,Dandan Yuan, Guoqiang Wang,Yue Zhao,Jin Xie*, Shuhua Li*, and Chengjian Zhu* , "Cooperative Au/Ag Dual-Catalyzed Cross-Dehydrogenative Biaryl Coupling: Reaction Development and Mechanistic Insight ", J. Am. Chem. Soc.
,2019, 141, 3187 PDF
Yuqi Wang, Zhigang Ni, Wei Li* and Shuhua Li*, "Cluster-in-Molecule Local Correlation Approach for Periodic Systems ", J. Chem. Theory Comput., 2019,15,2933 PDF
Zhigang Ni, Yuqi Wang, Wei Li, Peter Pulay, and Shuhua Li "Analytical Energy Gradients for the Cluster-in-Molecule MP2 Method and its Application to Geometry Optimizations of Large Systems ", J. Chem. Theory Comput., 2019，15，3623 PDF
Pan Gao，Guoqiang Wang，Longlong Xi，Minyan Wang， Shuhua Li* and Zhuangzhi Shi*, "Transition‐Metal‐Free Defluorosilylation of Fluoroalkenes with Silylboronates ", Chin. J. Chem., 2019, 37, 1009. PDF
Manyi Yang, Guoqiang Wang, Jingxiang Zou and Shuhua Li*, "Mechanistic Insight Into the AuCN Catalyzed Annulation Reaction of Salicylaldehyde and Aryl Acetylene: Cyanide Ion Promoted Umpolung Hydroacylation/Intramolecular Oxa-Michael Addition Mechanism ", Front. Chem., 2019，7:557. PDF
Liuzhou Gao, Guoqiang Wang, Jia Cao, Hui Chen, Yuming
Gu, Xueting Liu, Xu Cheng, Jing Ma, and Shuhua Li*, "Lewis Acid-Catalyzed Selective Reductive Decarboxylative
Pyridylation of N-Hydroxyphthalimide Esters: Synthesis of
Congested Pyridine-Substituted Quaternary Carbons ", ACS Catal., 2019，9，10142. PDF
Wei Li*, Mingzhou Duan, Kang Liao, Benkun Hong,
Zhigang Ni, Jing Ma and Shuhua Li*, "Improved generalized energy-based fragmentation approach
and its applications to the binding energies of supramolecular
complexes", Electron. Struct. , 2019, 1, 044003. PDF
