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ISSN 1000-6818CN 11-1892/O6CODEN WHXUEU
Acta Phys Chim Sin >> 2014,Vol.30>> Issue(9)>> 1616-1624     doi: 10.3866/PKU.WHXB201406182         中文摘要
THEORETICAL AND COMPUTATIONAL CHEMISTRY
Quantitative Structure-Property Relationship Studies on the Adsorption of Aromatic Contaminants by Carbon Nanotubes
LIU Fen1,2, ZOU Jian-Wei1, HU Gui-Xiang1, JIANG Yong-Jun1
1. College of Biological and Chemical Engineering, Ningbo Institute of Technology, Zhejiang University, Ningbo 315100, Zhejiang Province, P. R. China;
2. Department of Chemical Engineering and Biological Engineering, Zhejiang University, Hangzhou 310027, P. R. China
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Ab initio calculations have been performed for a group of 59 aromatic compounds at the HF/6-31G* level of theory. Electrostatic potentials (ESPs) and the statistically based structural descriptors derived from ESPs on the molecular surface have been obtained. The linear relationships between the adsorption equilibrium constants of organic contaminants by carbon nanotubes and the theoretical descriptors have been established by multiple linear regression. It is shown that the quantities derived from electrostatic potentials, Vmin, σ+2 and ΣVind+ together with the molecular surface area (S) and the energy level of lowest occupied molecular orbital (εLUMO) can be used to express the quantitative structure-property relationship (QSPR) of this sample set. All of the descriptors introduced in the QSPR models have definite physical meanings and their reasonability can be explained in terms of intermolecular interactions between the aromatic pollutants and carbon nanotubes or water. The stabilities and predictive powers of the models have been validated by "leave-one-out" and Monte Carlo cross-validation methods. Three nonlinear modeling techniques, namely supported vector machine (SVM), least-square supported vector machine (LSSVM), as well as Gaussian process (GP), have also been used to construct the predictive models. Though the SVM and LSSVM models exhibit strong fitting abilities, their predictive powers are inferior to the other models tested. The GP model yields the best fit and predictive ability among all of the models. Its advantage over the linear model, however, is not as remarkable as expected, which means that the relationship between the molecular structure and the adsorption property for the present system is primarily linear.



Keywords: Carbon nanotube   Organic contaminant   Electrostatic potentials on molecular surface   Quantitative structure-property relationship   Gaussian process  
Received: 2014-04-30 Accepted: 2014-06-17 Publication Date (Web): 2014-06-18
Corresponding Authors: ZOU Jian-Wei Email: jwzou@nit.zju.edu.cn

Fund: The project was supported by the National Natural Science Foundation of China (21272211) and Program of Science and Technology of Ningbo, China (2011A610021, 2013D1003).

Cite this article: LIU Fen, ZOU Jian-Wei, HU Gui-Xiang, JIANG Yong-Jun. Quantitative Structure-Property Relationship Studies on the Adsorption of Aromatic Contaminants by Carbon Nanotubes[J]. Acta Phys. -Chim. Sin., 2014,30 (9): 1616-1624.    doi: 10.3866/PKU.WHXB201406182

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65. WANG Luo-Xin, XU Jie, ZOU Han-Tao, YI Chang-Hai.Effect of Chirality and Size on the Thermal Decomposition of Nitromethane Confined inside Single-Walled Carbon Nanotube[J]. Acta Phys. -Chim. Sin., 2010,26(03): 721-726
66. WANG Hong-Jie, HU Fan, LI Shen-Min.Mixed Quantum-Classical Dynamics Simulations on the Vibrational Spectral Probe in a SWCT Confined Solvent[J]. Acta Phys. -Chim. Sin., 2010,26(03): 714-720
67. WU Yan-Ni, LIAO Shi-Jun.Shortened Carbon Nanotubes as Supports to Prepare High-Performance Pt/SCNT and PtRu/SCNT Catalysts for Fuel Cells[J]. Acta Phys. -Chim. Sin., 2010,26(03): 669-674
68. WU Ying-Lei, YANG Jun, WANG Jiu-Lin, YIN Li-Chao, NULI Yan-Na.Composite Cathode Structure and Binder for High Performance Lithium-Sulfur Battery[J]. Acta Phys. -Chim. Sin., 2010,26(02): 283-290
69. ZANG Yang, HAO Xiao-Gang, WANG Zhong-De, ZHANG Zhong-Lin, LIU Shi-Bin.Copolymerization and Capacitive Performance of Composite Carbon Nanotubes/Polyaniline/Nickel Hexacyanoferrate Films[J]. Acta Phys. -Chim. Sin., 2010,26(02): 291-298
70. WANG Luo-Xin, YI Chang-Hai, ZOU Han-Tao, XU Jie, XU Wei-Lin.cis-trans Isomerization of Azobenzene Confined inside an Armchair (8,8) Single-Walled Carbon Nanotube[J]. Acta Phys. -Chim. Sin., 2010,26(01): 149-154
71. FU Qing-Bin, GAO Bo, SU Ling-Hao, YUAN Chang-Zhou, LU Xiang-Jun, ZHANG Xiao-Gang.Preparation of Polypyrrole/Benzenesulfonic Functionalized Multi-Walled Carbon Nanotubes Induced by Hydrogen Bonding and Their Electrochemical Behavior[J]. Acta Phys. -Chim. Sin., 2009,25(11): 2199-2204
72. LI Zhen-Hua, JIANG Yuan, ZHAO Pei, SHANG Xue-Fu, YANG Hui, WANG Miao.Synthesis of Single-Walled Carbon Nanotube Films with Large Area and High Purity by Arc-Discharge[J]. Acta Phys. -Chim. Sin., 2009,25(11): 2395-2398
73. CAO Yong, JIAO Qing-Ze, ZHAO Yun.Synthesis of N-doped and Undoped Carbon Nanotubes on Fe/MgO Catalysts[J]. Acta Phys. -Chim. Sin., 2009,25(11): 2380-2384
74. ZHENG Wei-Ling, XIAO Tan, ZHU Meng-Qi, WU Ping.Preparation and Dispersivity of Multiwalled Carbon Nanotubes Coated by Poly(phenylacetylene)[J]. Acta Phys. -Chim. Sin., 2009,25(11): 2373-2379
75. LU Yue-Mei, GONG Qian-Ming, LIANG Ji.Preparation of Carbon Nanotubes/Activated Carbon Composite Microspheres and Their Application to Adsorption of VB12[J]. Acta Phys. -Chim. Sin., 2009,25(08): 1697-1702
76. WU Bin, BAI Lu, GONG Qian-Ming, LIANG Ji.Effect of Non-Ionic Surfactants on the Dispersion of Multiwalled Carbon Nanotubes at High Loading in Ethanol[J]. Acta Phys. -Chim. Sin., 2009,25(06): 1065-1069
77. CAO You-Ming, WANG Zhi-Yong, SHI Zu-Jin, GU Zhen-Nan.Preparation and Catalytic Properties of SWNTs-Supported Pd Catalyst[J]. Acta Phys. -Chim. Sin., 2009,25(05): 825-828
78. MA Ruo-Biao, FU Yan-Bao, MA Xiao-Hua.Preparation and Electrochemical Performance of Tin-Dioxide Filled Multi-Walled Carbon Nanotubes[J]. Acta Phys. -Chim. Sin., 2009,25(03): 441-445
79. DOU Wen-Ling; XIN Xia; XU Gui-Ying.Dispersion of Carbon Nanotubes by Amphiphilic Molecules[J]. Acta Phys. -Chim. Sin., 2009,25(02): 382-388
80. ZHU Yu-Zhen; WANG Sheng; WEI Xian-Long; DING Li; ZHANG Zhi-Yong; LIANG Xue-Lei; CHEN Qing; PENG Lian-Mao.Frequency Response of SWCNT Field-Effect Transistors with MWCNT Interconnects[J]. Acta Phys. -Chim. Sin., 2008,24(11): 2122-2127
81. CHEN Xi-Liang; MA Ming-Wang; YANG Xiao-Min; YANG Kang; JI Te; WU Sheng-Wei; ZHU Zhi-Yong.Electrical and Optical Properties of MWNTs/HDPE Composites in THz Region[J]. Acta Phys. -Chim. Sin., 2008,24(11): 1969-1974
82. ZHANG Wei; CUI Xiao-Li; JIANG Zhi-Yu.Effect of Composite Modes on Photoelectrochemical Properties of MWCNTs/TiO2 Nanocomposite Films[J]. Acta Phys. -Chim. Sin., 2008,24(11): 1975-1980
83. LEE Shih-Fong, CHANG Yung-Ping, LEE Li-Ying.Enhancement of Field Emission Characteristics for Multi-Walled Carbon Nanotubes Treated with a Mixed Solution of Chromic Trioxide and Nitric Acid[J]. Acta Phys. -Chim. Sin., 2008,24(08): 1411-1416
84. ZHANG Xu-Zhi; JIAO Kui.Single-Walled Carbon Nanotubes and RoomTemperature Ionic Liquid Composite Film Modified Electrode[J]. Acta Phys. -Chim. Sin., 2008,24(08): 1439-1444
85. CAO Ling-Chao; LIU Yun-Qi; WANG Yu; WEI Da-Cheng; FU Lei; HU Ping-An; ZHANG Hong-Liang; HUANG Li-Ping; YU Gui.Wet Purification of Aligned Carbon Nanotube Arrays and Its Impact on the Morphology of the Carbon Nanotube Arrays[J]. Acta Phys. -Chim. Sin., 2008,24(06): 951-954
86. FENG Chang-Jun; MU Lai-Long; YNAG Wei-Hua; CAI Ke-Ying.A Mathematical Model between Bioconcentration Factors and Topological Indices of Organic Pollutants[J]. Acta Phys. -Chim. Sin., 2008,24(06): 1053-1057
87. CHEN Dai-Wu; XIE Qing-Ji; JIANG Xue-Qin; YAO Shou-Zhuo.Interactions of Quercetin with Casein and Bovine Serum Albumin as well as Effects of Coexisting Carbon Nanotubes[J]. Acta Phys. -Chim. Sin., 2008,24(03): 379-387
88. CHEN Yu-Ting; ZHANG Hai-Yan; ZHANG Guo-Qing; CHEN Yi-Ming; ZHU Qing-Feng.Influence of Addition of Carbon Nanotubes in the Hydrogen Storage Alloy Electrode on the Performance of SC High Power Batteries[J]. Acta Phys. -Chim. Sin., 2008,24(03): 527-532
89. ZHI Shao-Feng; ZHANG Zhen-Hua; QIU Ming; PENG Jing-Cui.Electronic Velocity and Effective Mass of the Single-walled Carbon Nanotubes[J]. Acta Phys. -Chim. Sin., 2008,24(02): 275-280
90. WU Yu-Cheng; LIU Xiao-Lu; YE Min; XIE Ting; HUANG Xin-Min.Preparation and Properties of Carbon Nanotube-TiO2 Nanocomposites[J]. Acta Phys. -Chim. Sin., 2008,24(01): 97-102
91. XU Xing-Zhong; YANG Jian-Feng; LI Xiao-Nian; YAN Xin-Huan.Hydrogenation of o-chloronitrobenzene over CNTs Supported Pt Catalyst Obtained by Laser Vaporization of Bulk Metal[J]. Acta Phys. -Chim. Sin., 2008,24(01): 121-126
92. YE Chao; GONG Qian-Ming; LU Fang-Ping; LIANG Ji.Adsorption of Middle Molecular Weight Toxins on Carbon Nanotubes[J]. Acta Phys. -Chim. Sin., 2007,23(09): 1321-1324
93. QIU Han-Xun; WANG Zhi-Yong; SHI Zu-Jin; GU Zhen-Nan; QIU Jie-Shan.Synthesis and Infrared Spectroscopy Characterization of Ferrocene-filled Double-walled Carbon Nanotubes[J]. Acta Phys. -Chim. Sin., 2007,23(09): 1451-1453
94. LI Guo-Hua; TIAN Wei; TANG Jun-Yan; MA Chun-An.Preparation and Electrocatalytic Property for Methanol Oxidation of WC/CNT Nanocomposite[J]. Acta Phys. -Chim. Sin., 2007,23(09): 1370-1374
95. FU Jian-Liang; ZHANG Xing-Wang; LEI Le-Cheng.Fe-modified Multi-walled Carbon Nanotube Electrode for Production of Hydrogen Peroxide[J]. Acta Phys. -Chim. Sin., 2007,23(08): 1157-1162
96. CHEN Xin; ZHANG Yi-Li; SU Yu-Hua; MENG Wen-Hua; XIE Qing-Ji; YAO Shou-Zhuo.EQCM Studies on Enzymatic Specific Activities of Glucose Oxidase Adsorbed on Au-electroplated and Carbon Nanotubes-modified Au Electrodes[J]. Acta Phys. -Chim. Sin., 2007,23(08): 1201-1206
97. ZHENG Hai-Tao; LI Yong-Liang; LIANG Jian-Ying; SHEN Pei-Kang.Methanol Oxidation on Pd-based Electrocatalysts[J]. Acta Phys. -Chim. Sin., 2007,23(07): 993-996
98. Yuan Jian-Hui; Cheng Yu-Min.Effects of the Grafted Carboxyl on the Elastic Properties of Single-walled Carbon Nanotubes[J]. Acta Phys. -Chim. Sin., 2007,23(06): 889-894
99. WANG Rui; XU Hua-Ming; LI Dan; LIANG Ji.Growth of Single-walled Carbon Nanotubes on the Given Locations for AFM Tips[J]. Acta Phys. -Chim. Sin., 2007,23(04): 565-568
100. ZHONG Qi-Ling;ZHANG Bing;DING Yue-Min;RAO Gui-Shi;WANG Guo-Fu;JIANG Yu-Xiong;REN Bin;TIAN Zhong-Qun.Microwave Radiation-Assisted Synthesis of Pt-CNTs[J]. Acta Phys. -Chim. Sin., 2007,23(03): 429-432
101. YANG Min-Hao;LIANG Tao;PENG Yu-Cai;CHEN Qing.Synthesis and Characterization of a Nanocomplex of ZnO Nanoparticles Attached to Carbon Nanotubes[J]. Acta Phys. -Chim. Sin., 2007,23(02): 145-151
102. LÜ Ya-Fen;YIN Ya-Jing;WU Ping;CAI Chen-Xin.Direct Electrochemistry and Bioelectrocatalysis of Myoglobin at a Carbon Nanotube-Modified Electrode[J]. Acta Phys. -Chim. Sin., 2007,23(01): 5-11
103. QIU Kai-Dong;LI Wei-Bin.Adsorption of Hexavalent Chromium Ions on Multi-wall Carbon Nanotubes in Aqueous Solution[J]. Acta Phys. -Chim. Sin., 2006,22(12): 1542-1546
104. LI Rui-Fang;SHANG Zhen-Feng;XU Xiu-Fang;WANG Gui-Chang .Theoretical Studies on the Growth Mechanism of Armchair Single-walled Carbon Nanotube[J]. Acta Phys. -Chim. Sin., 2006,22(11): 1388-1392
105. CHU Dao-Bao;YIN Xiao-Juan;FENG De-Xiang;LIN Hua-Shui;TIAN Zhao-Wu.Electrocatalytic Oxidation of Ethanol on Pt/nanoTiO2-CNT Complex Catalysts[J]. Acta Phys. -Chim. Sin., 2006,22(10): 1238-1242
106. BIAN Cheng-Xiang;XU Xue-Cheng;YU Wei;CHEN Yi-Wei;CHENG Rong-Ming;SHI Yan;LI Xiang-Mei;JIN Sheng-Song.Study on Conductive Mechanism of Composites―Sulfonated Polyphenylacetylene / Multiwalled Carbon Nanotubes[J]. Acta Phys. -Chim. Sin., 2006,22(10): 1185-1190
107. ZHANG Hua;CHEN Xiao-Hua;ZHANG Zhen-Hua;QIU Ming.Effect of Grafted Hydroxyl on the Electronic Structure of Finite-length Carbon Nanotubes[J]. Acta Phys. -Chim. Sin., 2006,22(09): 1101-1105
108. ZHOU Long-Mei;LIU Hong-Ying; LI Feng-Sheng.Y2O3 Nanoparticle/Carbon Nanotube Composite: Preparation and Catalytic Performance for Decomposition of Ammonium Perchlorate[J]. Acta Phys. -Chim. Sin., 2006,22(05): 627-630
109. YI Shuang-Ping;ZHANG Hai-Yan;PEI Lei;HU Shou-Le;ZENG Guo-Xun;CHEN Jin.Effect of CNTs Treated at Different Temperatures in Nitrogen Ambient on the Electrochemical Properties of CNTs-LaNi5 Electrodes[J]. Acta Phys. -Chim. Sin., 2006,22(04): 436-440
110. CHU Dao-Bao; ZHANG Li-Yan; ZHANG Jin-Hua; ZHANG Xiu-Mei; YIN Xiao-Juan.Heterogeneous Electrocatalytic Reduction of Furfural on Nanocrystalline TiO2-CNT Complex Film Electrode in DMF Solution[J]. Acta Phys. -Chim. Sin., 2006,22(03): 373-377
111. LI Zhi; GONG Qian-Ming; LIANG Ji; HUANG Qi-Zhong; HUANG Bai-Yun.Study on Oxidation Properties of New ACNT/C Nanocomposites[J]. Acta Phys. -Chim. Sin., 2006,22(03): 316-321
112. ZHANG Zeng-Fu; LUO Guo-Hua; FAN Zhuang-Jun; XIANG Rong; ZHOU Li; WEI Fei.Complex Permittivity and Permeability Spectra of Different Kinds of Carbon Nanotubes[J]. Acta Phys. -Chim. Sin., 2006,22(03): 296-300
113. JIANG Qi; LU Xiao-ying; ZHAO Yong; ZHU Xiao-tong; CAI Yu-dong; QIAN Lan.Effects of Activation Conditions on the Specific Surface Area of Activated Carbon Nanotubes[J]. Acta Phys. -Chim. Sin., 2006,22(01): 43-47
114. CHEN Yu; TANG Ya-wen; Kong Ling-yong; LIU Chang-peng; XING Wei; LU Tianhong.Effect of Surface Modification Extent of Carbon Nanotubes on Electrocatalytic Performance of Carbon Nanotubes Supported Pt catalyst[J]. Acta Phys. -Chim. Sin., 2006,22(01): 119-123
115. LI Juan; FANG Zheng-ping; WANG Jian-guo; GU Aijuan; TONG Li-fang; LIU Fu.Microstructure Transformation of Multi-walled Carbon Nanotubes during Diamine Grafting Process[J]. Acta Phys. -Chim. Sin., 2005,21(11): 1244-1248
116. XU Bin; WU Feng; CHEN Ren-jie; CHEN Shi; WANG Guo-qing.Capacitance Characteristics of Carbon Nanotubes in Room Temperature Molten Salt Electrolyte[J]. Acta Phys. -Chim. Sin., 2005,21(10): 1164-1168
117. ZHOU Xiao-long; CHAI Yang; LI Ping-jian; PAN Guang-hu; SUN Hui; SHEN Ziyong; ZHANG Qi-feng; WU Jin-lei.Fabrication of Nitrogen-doped Multi-walled Carbon Nanotube and Their Field Effect Transistor Properties[J]. Acta Phys. -Chim. Sin., 2005,21(10): 1127-1131
118. CHEN Can-hui; LI Hong; ZHU Wei; ZHANG Quan-xin.The Electrochemical Behavior of Ferrocene and Its Complex with DNA[J]. Acta Phys. -Chim. Sin., 2005,21(10): 1067-1072
119. LIU Wan-qiang; WANG Xue-ye; LI Xin-fang; LONG Qing-ping; WEN Xiao-hong; LI Jianjun.Quantum Chemistry-ANN Methods Study on Tg of Polyacrylates[J]. Acta Phys. -Chim. Sin., 2005,21(06): 596-601
120. ZOU Jian-Wei; JIANG Yong-Jun; HU Gui-Xiang; ZENG Min; ZHUANG Shu-Lin; YU Qing-Sen.QSPR/QSAR Studies on the Physicochemical Properties and Biological Activities of Polychlorinated Biphenyls[J]. Acta Phys. -Chim. Sin., 2005,21(03): 267-272
121. WANG Xiao-Feng; WANG Da-Zhi; LIANG Ji.Pseudo-capacitance of Ultrafine Nickel Hydroxide Prepared by Sol-gel Method[J]. Acta Phys. -Chim. Sin., 2005,21(02): 117-122
122. LI Yu-Ping;CAO Hong-Bin;ZHANG Yi.Direct Electrochemistry of Hemoglobin Immobilized on Carbon Paste Electrode Modified by Carbon Nanotubes[J]. Acta Phys. -Chim. Sin., 2005,21(02): 187-181
123. Zhu Su-Bing;Sun Si-Xiu;Wei-Wei;Xu Jun-Jian;Li Yan.The Preparation of Nitrogen-doped Carbon Nanotubes from Pyridine[J]. Acta Phys. -Chim. Sin., 2004,20(11): 1320-1323
124. Huang Xiang-Ping;Lü Hai-Feng;Huang Xin-Tang.A Simple Chemical Method of Opening and Decorating Carbon Nanotubes by Polyvinyl Alcohol[J]. Acta Phys. -Chim. Sin., 2004,20(10): 1242-1244
125. Wang Hai-Fang;Deng Xiao-Yong;Wang Jing;Gao Xing-Fa;Xing Geng-Mei;Shi Zu-Jin;Gu Zhen-Nan;Liu Yuan-Fang;Zhao Yu-Liang.XPS Study of C-I Covalent Bond on Single-walled Carbon Nanotubes (SWNTs)[J]. Acta Phys. -Chim. Sin., 2004,20(07): 673-675
126. Jiang Qi;Lu Xiao-Ying;Zhao Yong;Yu Zuo-Long.Effect of Microstructure’s Change on Electrochemical Capacitance of Carbon Nanotubes[J]. Acta Phys. -Chim. Sin., 2004,20(05): 546-549
127. Zhang Qi-Feng;Yu Jie;Song Jiao-Hua;Zhang Geng-Min;Zhang Zhao-Xiang;Xue Zeng-Quan;Wu Jin-Lei.Fabrication of Aligned Carbon Nanotubes by a Vapor-phase Deposition Technique and Their Field Emission Properties[J]. Acta Phys. -Chim. Sin., 2004,20(04): 409-413
128. Li Huan-Jun;Guan Lun-Hui;Shi Zu-Jin;Gu Zhen-Nan.Synthesis and Characterization of C60@SWNTs[J]. Acta Phys. -Chim. Sin., 2004,20(04): 373-376
129. Deng Mei-Gen;Zhang Zhi-An;Hu Yong-Da;Wang Bin-Hua;Yang Bang-Chao.Effect of Activation and Surface Modification on the Properties of Carbon Nanotubes Supercapacitors[J]. Acta Phys. -Chim. Sin., 2004,20(04): 432-435
130. Wei Jin-Quan;Jiang Bin;Li Yan-Hui;Wu De-Hai.Preparation and Structure of Boron Carbide Nanowires[J]. Acta Phys. -Chim. Sin., 2004,20(03): 256-259
131. Zhu Hai-Bin;Li Zhen-Hua;Liu Zi-Yang;Wang Feng-Fei;Wang Xin-Qing;Wang-Miao.Synthesis of Carbon Nanotubes by Decomposing Alcohol[J]. Acta Phys. -Chim. Sin., 2004,20(02): 191-193
132. Niu Jia-Li;Zou Hong-Ling;Zhang Jin;Liu Zhong-Fan.Tracing the Chemical Oxidation Process of Single-walled Carbon Nanotubes by Silver Nanoparticles[J]. Acta Phys. -Chim. Sin., 2004,20(01): 1-4
133. Liu Ji-Xin;Xie You-Chang.Single-wall Carbon Nanotubes Produced by Decomposition of CH4 on W-Fe-MgO Catalysts[J]. Acta Phys. -Chim. Sin., 2003,19(11): 1093-1096
134. Wang Xiao-Feng;Wang Da-Zhi;Liang Ji.Carbon Nanotube Capacitor Materials Loaded with Different Amounts of Ruthenium Oxide[J]. Acta Phys. -Chim. Sin., 2003,19(06): 509-513
135. Guo Ming;Zou Jian-Wei;Zhao Wen-Na;Shang Zhi-Cai;Yu Qing-Sen.Relationships between Solvent Molecule Tridimensional Electrostatic Potentials and Solubilities of Fullerene(C60) in Organic Solvents[J]. Acta Phys. -Chim. Sin., 2003,19(05): 432-435
136. Piao Ling-Yu;Li Yong-Dan.Structure of Carbon Nanotubes from Decomposition of Methane on an Aerogel Catalyst[J]. Acta Phys. -Chim. Sin., 2003,19(04): 347-351
137. Wang Yao;Wu Jun;Wei Fei;Jin Yong.Breaking and Flocculating Purification of Thin-long Carbon Nanotubes from Carbon Fibers[J]. Acta Phys. -Chim. Sin., 2003,19(04): 376-379
138. Li Yue-Xiang;Lu Gong-Xuan;Li Shu-Ben;Dong Lu-Hu.Photocatalytic Production of Hydrogen with Degrading Pollutants and Characterization by in situ Infrared Spectroscopy[J]. Acta Phys. -Chim. Sin., 2003,19(04): 329-333
139. Liu Sai-Jin;Shen Zi-Yong;Hou Shi-Min;Gu Zhen-Nan;Xue Zeng-Quan.Study on the Manipulation of Carbon Nanotubes with Atomic Force Microscopy[J]. Acta Phys. -Chim. Sin., 2003,19(03): 233-236
140. Zheng Qing-Rong;Gu An-Zhong;Lin Wen-Sheng;Li Ming;Lu Xue-Sheng.Theoretical Study on the Adsorbed Hydrogen Molecules on Multi-Walled Carbon Nanotubes[J]. Acta Phys. -Chim. Sin., 2003,19(02): 139-143
141. Wang Jin;Chen Hong-Bo;Yun Hong;Lin Jing-Dong;Yi Jun;Zhang Hong-Bin;Liao Dai-Wei.Study on Rh-ZnO/MWNTs Catalyst for Methanol Synthesis[J]. Acta Phys. -Chim. Sin., 2003,19(01): 65-69
142. Zhou Zhen-Hua;Wu Xiao-Man;Wang Yi;Lin Guo-Dong;Zhang Hong-Bin.Characteristics of Adsorption and Desorption of Hydrogen on Multi-walled Carbon Nanotubes[J]. Acta Phys. -Chim. Sin., 2002,18(08): 692-698
143. Zhao Wen-Na;Zou Jian-Wei;Shang Zhi-Cai;Guo Ming;Yu Qing-Sen.A QSPR Study on n-Octanol/Water Partition Coefficient of Disubstituted Benzenes:Application of Theoretical Descriptors Derived from Electrostatic Potentials[J]. Acta Phys. -Chim. Sin., 2002,18(07): 600-603
144. Zou Hong-Ling;Yang Yan-Lian;Wu Bin;Qing Quan;Li Qing-Wen;Zhang Jin;Liu Zhong-Fan.Purification and Characterization of SingleWalled Carbon Nanotubes Synthesized by Chemical Vapor Deposition[J]. Acta Phys. -Chim. Sin., 2002,18(05): 409-413
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