Acta Chimica Sinica 2022, 80(6)

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- About the Cover:
  
  On the cover: In-depth understanding of the complexation behavior of functional groups with uranyl ion is essential for development of high-efficient seawater uranium adsorbents. Density functional theory (DFT) calculations demonstrated that owing to the high proton rearrangement energy and dissociation energy of the glutarimidedioxime group (H₂A), the pyridine-2,6-dicarboxylic acid group (H₂DPA) is more prone to substitution reactions with [UO₂(CO₃)₃]^4-, and H₂DPA is a potential effective ligand for uranium extraction from seawater. [Shi, Weiqun et al. on page 708-713.]
- About the Cover:
  
  On the back cover: We developed an ensemble machine learning method by integrating three heterogeneous models: ANN (artificial neural networks) based on interpretable descriptors, ANN based on correlated descriptors, and SVM (support vector machines) based on hybrid molecular fingerprints, and realized the boiling point prediction of high accuracy in wide structure space. This multi-component heterogeneous learning model can also be well generalized to the prediction of many physical chemical properties beyond boiling point. [Yu, Xi et al. on page 714-723.]
2022, 80(6)

15 June 2022
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Communication Article Account Review

Communication

Porous Bismuth Nanoflowers Enriched with Lattice Dislocations for Highly Efficient Electrocatalytic Reduction of Carbon Dioxide to Formate^※

Yinlong Jiang, Guochao Li, Qingsong Chen, Zhongning Xu, Shanshan Lin, Guocong Guo

Acta Chimica Sinica 2022, 80 (6), pp 703-707 DOI: 10.6023/A22010012

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Article

Theoretical Studies on the Interaction of Uranyl with Carboxylic Acids and Oxime Ligands

Xuefei Luan, Congzhi Wang, Liangshu Xia, Weiqun Shi

Acta Chimica Sinica 2022, 80 (6), pp 708-713 DOI: 10.6023/A22010054

Abstract( 647) HTML( 32) PDF(1244KB)( 886 )

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Accurate Prediction of the Boiling Point of Organic Molecules by Multi-Component Heterogeneous Learning Model

Yuze Liu, Kunhua Li, Jiaxing Huang, Xi Yu, Wenping Hu

Acta Chimica Sinica 2022, 80 (6), pp 714-723 DOI: 10.6023/A22010017

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Rationally Tuning Blend Miscibility of Polymer Donor and Nonfullerene Acceptor for Constructing Efficient Organic Solar Cells^※

Wenyuan Lin, Qingzhe Zhu, Yunlong Ma, Peng Wang, Shuo Wan, Qingdong Zheng

Acta Chimica Sinica 2022, 80 (6), pp 724-733 DOI: 10.6023/A21120620

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Conversion Process of Perhydropolysilazane to Silica^※

Dan Wang, Xiang Guo, Pengfei Li, Yulin Zhang, Caihong Xu, Zongbo Zhang

Acta Chimica Sinica 2022, 80 (6), pp 734-740 DOI: 10.6023/A21120621

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Enhancement on Nickel-Mediated Ethylene Polymerization by Concerted Steric Hindrance and Fluorine Effect

Yuyin Wang, Xiaoqiang Hu, Hongliang Mu, Yan Xia, Yue Chi, Zhongbao Jian

Acta Chimica Sinica 2022, 80 (6), pp 741-747 DOI: 10.6023/A22020066

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Preparation of Bimetallic Conductive Metal-organic Framework Material Ni/Co-CAT for Electrocatalytic Oxygen Reduction

Yuanhao Geng, Xiaoqiu Lin, Yaxin Sun, Huiyu Li, Yue Qin, Congju Li

Acta Chimica Sinica 2022, 80 (6), pp 748-755 DOI: 10.6023/A21120617

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Lithiation Mechanism and Performance of Monoclinic ZnP₂ Anode Materials

Wenchao Bi, Linfeng Zhang, Jian Chen, Ruixue Tian, Hao Huang, Man Yao

Acta Chimica Sinica 2022, 80 (6), pp 756-764 DOI: 10.6023/A21120552

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pH-Responsive Pickering Emulsions Synergistically Stabilized by Maleopimaric Acid and Alumina Nanoparticles

Xufa He, Kangle Jia, Longfei Yu, Mingjie Liu, Xiaoshan Zheng, Huanling Li, Jinlan Xin, Linjia Huang

Acta Chimica Sinica 2022, 80 (6), pp 765-771 DOI: 10.6023/A21120567

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Nitrogen-doped Carbon Pyrolyzed from ZIF-8 for Electrocatalytic Oxygen Reduction to Hydrogen Peroxide

Dan Wang, Bo Feng, Xiaoxin Zhang, Yanan Liu, Yan Pei, Minghua Qiao, Baoning Zong

Acta Chimica Sinica 2022, 80 (6), pp 772-780 DOI: 10.6023/A22010030

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Theoretical Study on the Isomerization Mechanism of Azobenzene Derivatives under Electric Field

Luocong Wang, Zhewei Li, Caiwei Yue, Peihuan Zhang, Ming Lei, Min Pu

Acta Chimica Sinica 2022, 80 (6), pp 781-787 DOI: 10.6023/A22010056

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Chemical Looping Ammonia Synthesis with High Performance Supported Molybdenum-based Nitrogen Carrier

Tan Zhang, Zhongliang Yu, Jiaqi Yu, Huining Wan, Chengyu Bao, Wenqiang Tu, Song Yang

Acta Chimica Sinica 2022, 80 (6), pp 788-796 DOI: 10.6023/A22010057

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Account

Recent Progress in GeSe Thin-Film Solar Cells^※

Bin Yan, Ding-Jiang Xue, Jin-Song Hu

Acta Chimica Sinica 2022, 80 (6), pp 797-804 DOI: 10.6023/A21120605

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Review

Nanoprobes for Visualization of Cancer Pathology in Vivo^※

Peisen Zhang, Lihong Jing

Acta Chimica Sinica 2022, 80 (6), pp 805-816 DOI: 10.6023/A21120609

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Research Progress of Protein-Protein Interaction Based on Liquid Chromatography Mass Spectrometry^※

Yuwan Chen, Wen Zhou, Xinwei Li, Kaiguang Yang, Zhen Liang, Lihua Zhang, Yukui Zhang

Acta Chimica Sinica 2022, 80 (6), pp 817-826 DOI: 10.6023/A22010055

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Photocatalytic Water Splitting for Hydrogen Production^※

Yu Qi, Fuxiang Zhang

Acta Chimica Sinica 2022, 80 (6), pp 827-838 DOI: 10.6023/A21120607

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Heat Conduction Behavior of Two-Dimensional Nanomaterials and Their Interface Regulation^※

Ruilin Yuan, Long Chen, Changzheng Wu

Acta Chimica Sinica 2022, 80 (6), pp 839-847 DOI: 10.6023/A21120616

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Construction and Application of Porous Ionic Liquids

Xiaoqian Li, Jing Zhang, Fangfang Su, Dechao Wang, Dongdong Yao, Yaping Zheng

Acta Chimica Sinica 2022, 80 (6), pp 848-860 DOI: 10.6023/A22010053

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