[1] |
Ning Li, Lina Xu, Guoyong Fang, Yingjin Ma.
Fault-tolerant Coded Quantum Chemical Distributed Calculation
[J]. Acta Chimica Sinica, 2024, 82(2): 138-145.
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[2] |
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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[3] |
Haipeng Wang, Wensheng Cai, Xueguang Shao.
Antifreeze Mechanism of Antifreeze Agents by Near Infrared Spectroscopy and Molecular Simulations★
[J]. Acta Chimica Sinica, 2023, 81(9): 1167-1174.
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[4] |
Wenjie Wei, Wenlong Chen, Xiaobin Dai, Li-Tang Yan.
Theory of Anomalous Diffusion Dynamics in Biomacromolecular Media★
[J]. Acta Chimica Sinica, 2023, 81(8): 967-978.
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[5] |
Zhao Zhenxin, Yao Yikun, Chen Jiajun, Niu Rong, Wang Xiaomin.
A High-entropy Phosphate Cathode Host towards High-stability Lithium-sulfur Batteries
[J]. Acta Chimica Sinica, 2023, 81(5): 496-501.
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[6] |
Jia Yanggang, Chen Shijie, Shao Xia, Cheng Jie, Lin Na, Fang Daolai, Mao Aiqin, Li Canhua.
Preparation and High-performance Lithium-ion Storage of Cobalt-free Perovskite High-entropy Oxide Anode Materials
[J]. Acta Chimica Sinica, 2023, 81(5): 486-495.
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[7] |
Liu Zhenyu, Gan Li-Hua.
Molecular Dynamics Simulation of Acetylene Pyrolysis into Fullerenes
[J]. Acta Chimica Sinica, 2023, 81(5): 502-510.
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[8] |
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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[9] |
Yizhi Han, Jianhui Lan, Xue Liu, Weiqun Shi.
Advances in Molecular Dynamics Studies of Molten Salts Based on Machine Learning
[J]. Acta Chimica Sinica, 2023, 81(11): 1663-1672.
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[10] |
Ke Zhao, Xiayu Cheng, Xuexue Ma, Minghui Geng.
Mechanism of Two-photon Absorption Enhancement for a Piperazine-based Zinc Ion Probe
[J]. Acta Chimica Sinica, 2023, 81(10): 1371-1378.
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[11] |
Panqi Song, Jianqiao Zhang, Yiwen Li, Guangfeng Liu, Na Li.
Solution Small-Angle Scattering in Soft Matter: Application and Prospective※
[J]. Acta Chimica Sinica, 2022, 80(5): 690-702.
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[12] |
Xiandan Chai, Wenfa Chen, Qiunan Yan, Binwen Liu, Xiaoming Jiang, Guocong Guo.
Rb2MGe3S8 (M=Zn, Cd): Non-Centrosymmetry Transformation Led by Structure Change of [MGe3S8]2- Unit※
[J]. Acta Chimica Sinica, 2022, 80(5): 633-639.
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[13] |
Rui Guo, Xing Wei, Moyun Cao, Yan Zhang, Yun Yang, Jibin Fan, Jian Liu, Ye Tian, Zekun Zhao, Li Duan.
Optical and Tunable Electronic Properties of AlAs/InSe Van Der Waals Heterostructures
[J]. Acta Chimica Sinica, 2022, 80(4): 526-534.
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[14] |
Kai Qiu, Mingxia Yan, Shouwang Zhao, Shengli An, Wei Wang, Guixiao Jia.
Theoretical Study on the Structural Stability and Oxygen Ion Oxidation of Al-doped Lithium-ion Battery Layered Cathode Li(Li0.17Ni0.17Al0.04Fe0.13Mn0.49)O2
[J]. Acta Chimica Sinica, 2021, 79(9): 1146-1153.
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[15] |
Chengqiao Li, Yibo Wang.
A Combination Method of Quantum Chemistry and Its Application to the Study of the Effects of Mercury on the Formation of Sulfuric Acid Aerosol
[J]. Acta Chimica Sinica, 2021, 79(8): 1065-1072.
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