[1] |
Guanglong Huang, Xiao-Song Xue.
Computational Study on the Mechanism of Chen’s Reagent as Trifluoromethyl Source
[J]. Acta Chimica Sinica, 2024, 82(2): 132-137.
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[2] |
Yuying Zhang, Xiao Cai, Weigang Hu, Guangjun Li, Yan Zhu.
Pd and Hg Atoms Co-doped HgPdAu23(PET)18 Nanocluster★
[J]. Acta Chimica Sinica, 2023, 81(7): 703-708.
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[3] |
Xuefeng Liang, Jian Jing, Xin Feng, Yongze Zhao, Xinyuan Tang, Yan He, Lisheng Zhang, Huifang Li.
Electronic Structure of Covalent Organic Frameworks COF66 and COF366: from Monomers to Two-Dimensional Framework
[J]. Acta Chimica Sinica, 2023, 81(7): 717-724.
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[4] |
Lei Yang, Jiaoyang Ge, Fangli Wang, Wangyang Wu, Zongxiang Zheng, Hongtao Cao, Zhou Wang, Xueqin Ran, Linhai Xie.
A Theoretical Study on the Effective Reduction of Internal Reorganization Energy Based on the Macrocyclic Structure of Fluorene
[J]. Acta Chimica Sinica, 2023, 81(6): 613-619.
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[5] |
Jie Yang, Lin Ling, Yuxue Li, Long Lu.
Density Functional Theory Study on Thermal Decomposition Mechanisms of Ammonium Perchlorate
[J]. Acta Chimica Sinica, 2023, 81(4): 328-337.
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[6] |
Jiangmin Jiang, Xinran Zheng, Yating Meng, Wenjie He, Yaxin Chen, Quanchao Zhuang, Jiaren Yuan, Zhicheng Ju, Xiaogang Zhang.
Research on the Preparation and Potassium Storage Performance of F, N Co-doped Porous Carbon Nanosheets
[J]. Acta Chimica Sinica, 2023, 81(4): 319-327.
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[7] |
Shaoqin Zhang, Meiqing Li, Zhongjun Zhou, Zexing Qu.
Theoretical Study on the Multiple Resonance Thermally Activated Delayed Fluorescence Process
[J]. Acta Chimica Sinica, 2023, 81(2): 124-130.
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[8] |
Yalan Zhang, Zhixiang Yuan, Hao Zhang, Jianjun Zhang, Guanglei Cui.
Research Progress of High-energy-density Solid-state Lithium Ion Batteries Employing Ni-rich Ternary Cathodes
[J]. Acta Chimica Sinica, 2023, 81(12): 1724-1738.
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[9] |
Juan Wang, Huamin Xiao, Ding Xie, Yuanru Guo, Qingjiang Pan.
Density Functional Theory Study of Structures of Copper-doped and Graphitic Carbon Nitride-combined Zinc Oxides and Their Boosted Nitrogen Dioxide-sensing Performance
[J]. Acta Chimica Sinica, 2023, 81(11): 1493-1499.
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[10] |
Jinjing Liu, Na Yang, Li Li, Zidong Wei.
Theoretical Study on the Regulation of Oxygen Reduction Mechanism by Modulating the Spatial Structure of Active Sites on Platinum★
[J]. Acta Chimica Sinica, 2023, 81(11): 1478-1485.
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[11] |
Rui Liu, Bin Meng, Junli Hu, Jun Liu.
Polycyclic Aromatic Hydrocarbon Molecule with Ultra-low LUMO/HOMO Energy Levels★
[J]. Acta Chimica Sinica, 2023, 81(10): 1295-1300.
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[12] |
Guoqiang Zhang, Jinghao Huo, Xin Wang, Shouwu Guo.
P-doped TiO2/C Nanotubes as Anodes for High-performance Li-ion Capacitors
[J]. Acta Chimica Sinica, 2023, 81(1): 6-13.
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[13] |
Xuefei Luan, Congzhi Wang, Liangshu Xia, Weiqun Shi.
Theoretical Studies on the Interaction of Uranyl with Carboxylic Acids and Oxime Ligands
[J]. Acta Chimica Sinica, 2022, 80(6): 708-713.
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[14] |
Luocong Wang, Zhewei Li, Caiwei Yue, Peihuan Zhang, Ming Lei, Min Pu.
Theoretical Study on the Isomerization Mechanism of Azobenzene Derivatives under Electric Field
[J]. Acta Chimica Sinica, 2022, 80(6): 781-787.
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[15] |
Wenchao Bi, Linfeng Zhang, Jian Chen, Ruixue Tian, Hao Huang, Man Yao.
Lithiation Mechanism and Performance of Monoclinic ZnP2 Anode Materials
[J]. Acta Chimica Sinica, 2022, 80(6): 756-764.
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