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Graphdiyne with Enhanced Ability for Electron Transfer 期刊论文
ACTA PHYSICO-CHIMICA SINICA, 2018, 卷号: 34, 期号: 9, 页码: 1048-1060
Authors:  Zhao Yasong;  Zhang Lijuan;  Qi Jian;  Jin Quan;  Lin Kaifeng;  Wang Dan
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Graphdiyne  Gd-based Composites  Electron-transfer Enhancement  Pi-conjugated Skeleton  
Reaction Mechanisms in the Thermal Decomposition of CL-20 Revealed by ReaxFF Molecular Dynamics Simulations 期刊论文
ACTA PHYSICO-CHIMICA SINICA, 2018, 卷号: 34, 期号: 10, 页码: 1151-1162
Authors:  Ren Chunxing;  Li Xiaoxia;  Guo Li
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Cl-20  Thermal Decomposition  Reaction Mechanism  Reaxff Md  Evolution Of Ring Structure  
Molecular Dynamics Simulation of Ozonation of p-Nitrophenol at Room Temperature with ReaxFF Force Field 期刊论文
ACTA PHYSICO-CHIMICA SINICA, 2017, 卷号: 33, 期号: 7, 页码: 1399-1410
Authors:  Wang Zi-Min;  Zheng Mo;  Xie Yong-Bing;  Li Xiao-Xia;  Zeng Ming;  Cao Hong-Bin;  Guo Li
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P-nitrophenol  Ozonation  Reaxff Md  Radical Behavior  Reaction Mechanism  
Initial Reaction Mechanism of RP-3 High Temperature Oxidation Simulated with ReaxFF MD 期刊论文
ACTA PHYSICO-CHIMICA SINICA, 2016, 卷号: 32, 期号: 6, 页码: 1424-1433
Authors:  Liu Xiao-Long;  Li Xiao-Xia;  Han Song;  Qiao Xian-Jie;  Zhong Bei-Jing;  Guo Li
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Rp-3  Reaction Mechanism  Reaxff Md  Oxidation  Molecular Simulation  
Solubility of NH4VO3 in NH4H2PO4-H2O and (NH4)(3)PO4-H2O Systems 期刊论文
ACTA PHYSICO-CHIMICA SINICA, 2016, 卷号: 32, 期号: 5, 页码: 1134-1142
Authors:  Gong Xu-Li;  Zhang Chang-Qiao;  Ning Peng-Ge;  Cao Hong-Bin;  Zhang Yi
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Nh4vo3  Solubility  Nh4h2po4 Solution  (Nh4)(3)Po4 Solution  
Structure and Diffusivity of Oxygen in Concentrated Alkali-Metal Hydroxide Solutions: A Molecular Dynamics Simulation Study 期刊论文
ACTA PHYSICO-CHIMICA SINICA, 2015, 卷号: 31, 期号: 6, 页码: 1045-1053
Authors:  Lu Ye-Qing;  Zheng Shi-Li;  Wang Shao-Na;  Du Hao;  Zhang Yi
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Molecular Dynamics Simulation  Oxygen  Naoh  Koh  Diffusion Coefficient  
Enhanced Effect of O/N Groups on the Hg-0 Removal Efficiency over the HNO3-Modified Activated Carbon 期刊论文
ACTA PHYSICO-CHIMICA SINICA, 2015, 卷号: 31, 期号: 3, 页码: 512-518
Authors:  Tong Li;  Xu Wen-Qing;  Qi Hao;  Zhou Xuan;  Liu Rui-Hui;  Zhu Ting-Yu
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Elemental Mercury  Activated Carbon  Hno3-  Oxygen Functional Group  Nitrogen Functional Group  
Effect of Alkali Concentration, Oxygen Partial Pressure and Temperature on Oxygen Reduction Reaction on Pt Electrode in NaOH Solution 期刊论文
ACTA PHYSICO-CHIMICA SINICA, 2014, 卷号: 30, 期号: 1, 页码: 67-74
Authors:  Peng Zhong;  Yan Wen-Yi;  Wang Shao-Na;  Zheng Shi-Li;  Du Hao;  Zhang Yi
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Cyclic Voltammetry  Linear Sweep Voltammetry  Oxygen Reduction Reaction  Henry's Constant  Reactivity  Solubility  Diffusion Coefficient  
Catalytic Oxidation Activity of NO on TiO2-Supported Mn-Co Composite Oxide Catalysts 期刊论文
ACTA PHYSICO-CHIMICA SINICA, 2013, 卷号: 29, 期号: 2, 页码: 385-390
Authors:  Xu Wen-Qing;  Zhao Jun;  Wang Hai-Rui;  Zhu Ting-Yu;  Li Peng;  Jing Peng-Fei
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Nitric Oxide  Catalytic Oxidation  Manganese  Cobalt  Nitrogen Dioxide  
Equilibrium Solubility Modeling of CO2 in Na2Cr2O7 Solutions 期刊论文
ACTA PHYSICO-CHIMICA SINICA, 2012, 卷号: 28, 期号: 11, 页码: 2567-2573
Authors:  Zhou En-Nian;  Yu Zhi-Hui;  Qu Jing-Kui;  Qi Tao;  Han Xiao-Ying;  Zhang Guo-Qing;  Yu, ZH
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Co2 Solubility  Na2cr2o7 Solution  Thermodynamic Model  Setschenow Equation  Peng-robinson-pitzer Equation  Henry Constant