[1] |
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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[2] |
Min Cheng, Shihui Wang, Lei Luo, Li Zhou, Kexin Bi, Yiyang Dai, Xu Ji.
Large-Scale Computational Screening of Metal-Organic Framework Membranes for Ethane/Ethylene Separation
[J]. Acta Chimica Sinica, 2022, 80(9): 1277-1288.
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[3] |
Hairu Li, Ceng Zhang, Sidian Li.
Study on the Regulation of Alkali-earth Metal Ben (n=1~3) on the Structure of B12 Clusters
[J]. Acta Chimica Sinica, 2022, 80(7): 888-895.
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[4] |
Shihui Wang, Xiaoyu Xue, Min Cheng, Shaochen Chen, Chong Liu, Li Zhou, Kexin Bi, Xu Ji.
High-Throughput Computational Screening of Metal-Organic Frameworks for CH4/H2 Separation by Synergizing Machine Learning and Molecular Simulation
[J]. Acta Chimica Sinica, 2022, 80(5): 614-624.
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[5] |
Yaru Wei, Jing Ma, Tingting Yuan, Jiawei Jiang, Yinli Duan, Juanqin Xue.
Preparation and Adsorption Properties of Lithium Chloride Intercalation Carbon Nitride
[J]. Acta Chimica Sinica, 2022, 80(4): 494-502.
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[6] |
Yingzhe Du, Heng Zhang, Shiling Yuan.
Molecular Dynamics Simulation of Thermal Conductivity of Al2O3/PDMS Composites
[J]. Acta Chimica Sinica, 2021, 79(6): 787-793.
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[7] |
Lei Yang, Yujing Wu, Xuanjun Wu, Weiquan Cai.
High-throughput Screening of Real Metal-organic Frameworks for Adsorption Separation of C4 Olefins
[J]. Acta Chimica Sinica, 2021, 79(4): 520-529.
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[8] |
Zhang Pengcheng, Guo Jia, Zhu Gen, Fang Wenyu, Tang Qianyuan, Bao Lei, Kang Wenbin.
Monte Carlo Simulations of Composition-Related Structural Transition of Disordered Peptides: The Case Study of Random Peptides Composed of Lysine, Glutamic Acids and Isoleucine
[J]. Acta Chimica Sinica, 2020, 78(9): 994-1000.
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[9] |
Zhang Lan, Ma Suqian, Wang Hanbing, Liang Yunhong, Zhang Zhihui.
Research Progress of Shape Memory Polymer Deformation Mode
[J]. Acta Chimica Sinica, 2020, 78(9): 865-876.
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[10] |
Cai Chengzhi, Li Lifeng, Deng Xiaomei, Li Shuhua, Liang Hong, Qiao Zhiwei.
Machine Learning and High-throughput Computational Screening of Metal-organic Framework for Separation of Methane/ethane/propane
[J]. Acta Chimica Sinica, 2020, 78(5): 427-436.
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[11] |
Liu Zhilu, Li Wei, Liu Hao, Zhuang Xudong, Li Song.
Research Progress of High-throughput Computational Screening of Metal-Organic Frameworks
[J]. Acta Chim. Sinica, 2019, 77(4): 323-339.
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[12] |
Xu Jie, Wei Yuchen, Wu Zhiwei, Yi Zhongsheng.
Spectral and Computational Simulations of HSA and BDE154 Based on Acidity Induction
[J]. Acta Chim. Sinica, 2018, 76(5): 408-414.
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[13] |
Bian Lei, Li Wei, Wei Zhenzhen, Liu Xiaowei, Li Song.
Formaldehyde Adsorption Performance of Selected Metal-Organic Frameworks from High-throughput Computational Screening
[J]. Acta Chim. Sinica, 2018, 76(4): 303-310.
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[14] |
Duan Yu, Chen Xin, Shao Zhengzhong.
Preparation and Properties of Antheraea pernyi/Bombyx mori Silk Fibroin Blending Scaffold
[J]. Acta Chim. Sinica, 2018, 76(3): 190-195.
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[15] |
Yang Wenyuan, Liang Hong, Qiao Zhiwei.
High-Throughput Screening of Metal-Organic Frameworks for the Separation of Hydrogen Sulfide and Carbon Dioxide from Natural Gas
[J]. Acta Chim. Sinica, 2018, 76(10): 785-792.
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