Table of Contents

• Cover and Table of Contents for Vol.30 No. 4
• 2014, 30 (4): 0-0

• 588Abstract/Metrics
• 2169 PDF(10069KB)

REVIEW

• Progress in the Application of Diazine Compounds in Optoelectronic Functional Materials
• MEI Qun-Bo, WENG Jie-Na, TONG Bi-Hai, TIAN Ru-Qiang, JIANG Yuan-Zhi, HUA Qing-Fang, HUANG Wei
• As a new and developing field, organic electronics is attracting much attention and has contributed greatly to progress ...
• 2014, 30 (4): 589-607 DOI: 10.3866/PKU.WHXB201402182

• 1622Abstract/Metrics
• 1574 PDF(906KB)

THERMODYNAMICS, KINETICS, AND STRUCTURAL CHEMISTRY

• Crystal Fine Structure and Optical Rotatory Angle Study on Spin Superfluidity of Intermolecular N⁺H…O^- Hydrogen Bond Electron Cooper Pairing onto D-, L-, and DL-Valine Optical Lattices
• WANG Wen-Qing, ZHANG Yu-Feng, GONG Yan
• With a view to understanding the argument of the phase transition mechanisms of D- and Lvaline around 270 K, the tempera...
• 2014, 30 (4): 608-622 DOI: 10.3866/PKU.WHXB201402181

• 1112Abstract/Metrics
• 1125 PDF(798KB)

• Vibrational Activity Change of Self-Assembled Monolayers upon Chemical Attachment and Nanoscale Block Revealed by Surface Enhanced Raman Spectroscopy
• ZHOU Jie, LI Bo-Lin, ZHU Pei-Zhi, LU Xiao-Lin
• The origin of weak ambiguous vibrational modes in surface enhanced Raman scattering (SERS), i.e., from the high-order ef...
• 2014, 30 (4): 623-627 DOI: 10.3866/PKU.WHXB201312273

• 1366Abstract/Metrics
• 1047 PDF(684KB)

THEORETICAL AND COMPUTATIONAL CHEMISTRY

• Comparing Methods for Predicting the Reactive Site of Electrophilic Substitution
• FU Rong, LU Tian, CHEN Fei-Wu
• Predicting the reactivity of electrophilic substitution at different sites is of theoretical and practical significance,...
• 2014, 30 (4): 628-639 DOI: 10.3866/PKU.WHXB201401211

• 4524Abstract/Metrics
• 3188 PDF(924KB)

• “External Anchoring Sites” for Noble Metal Nanowires on Deprotonated 1,3-Dipolar Cycloaddition Graphene
• CAI Qian, CAI Qiu-Xia, ZHUANG Gui-Lin, ZHONG Xing, WANG Xin-De, LI Xiao-Nian, WANG Jian-Guo
• Density functional theory (DFT) calculations were used to study the adsorption of noble metal (Pt) on deprotonated 1,3-d...
• 2014, 30 (4): 640-645 DOI: 10.3866/PKU.WHXB201402131

• 1504Abstract/Metrics
• 908 PDF(1410KB)

• Dissipative Particle Dynamics Simulation of Multicompartment Micelles Self-Assembled from a Blend of Triblock Copolymers and Diblock Copolymers in an Aqueous Solution
• XU Bo-Shen, ZHAO Ying, SHEN Xian-Liang, CONG Yue, YIN Xiu-Mei, WANG Xin-Peng, YUAN Qing, YU Nai-Sen, DONG Bin
• A dissipative particle dynamics simulation was performed to study the influence of blending different linear triblock co...
• 2014, 30 (4): 646-653 DOI: 10.3866/PKU.WHXB201402122

• 995Abstract/Metrics
• 978 PDF(1402KB)

• Development and Validation of an All-Atom Force Field for the Energetic Materials TATB, RDX and HMX
• JIN Zhao, LIU Jian, WANG Li-Li, CAO Feng-Lei, SUN Huai
• An all-atom force field was developed and validated for three energetic materials 1,3,5-triamino-2,4,6-trinitrobenzene (...
• 2014, 30 (4): 654-661 DOI: 10.3866/PKU.WHXB201402113

• 1426Abstract/Metrics
• Supporting Info
• 1545 PDF(1880KB)

ELECTROCHEMISTRY AND NEW ENERGY

• Di-n-alkylphosphinic Acid with a Long Alkyl Chain as a Coadsorbent for Modifying TiO₂ Photoanodes
• LI Jing-Zhe, KONG Fan-Tai, WU Guo-Hua, CHEN Wang-Chao, HUANG Yang, FANG Xia-Qin, DAI Song-Yuan
• The modification of a TiO2/dye/electrolyte interface can effectively improve the performance of dyesensitized solar cell...
• 2014, 30 (4): 662-668 DOI: 10.3866/PKU.WHXB201401242

• 1266Abstract/Metrics
• 1336 PDF(763KB)

• Preparation and Electrochemical Performance of 5 V LiNi_0.5Mn_1.5O₄ Cathode Material by the Composite Co-Precipitation Method for High Energy/High Power Lithium Ion Secondary Batteries
• ZHU Zhi, QI Lu, LI Wei, LIAO Xi-Ying
• This research developed a novel composite co-precipitation method to prepare high performance LiNi0.5Mn1.5O4 based on a ...
• 2014, 30 (4): 669-676 DOI: 10.3866/PKU.WHXB201402102

• 1205Abstract/Metrics
• 1542 PDF(2951KB)

• Synergistic Inhibition Effect of Imidazoline Ammonium Salt and Sodium Dodecyl Sulfate in CO₂ System
• ZHANG Chen, ZHAO Jing-Mao
• The synergistic inhibition effect of the imidazoline ammonium salt (IAS) and sodium dodecyl sulfate (SDSH) on the corros...
• 2014, 30 (4): 677-685 DOI: 10.3866/PKU.WHXB201402111

• 1388Abstract/Metrics
• 929 PDF(1001KB)

• Model Simulation and Analysis of Spatiotemporal Dynamics for the Electro-Oxidation of Sulfide on Platinum
• YANG Jia-Ping, YU Hui-Yao, HE Yu-Xiu, XIE Jing-Xuan, BI Wen-Yan, GAO Qing-Yu
• Based on the reaction mechanism of the electro-oxidation of sulfide on platinum, we propose a simplified model for study...
• 2014, 30 (4): 686-692 DOI: 10.3866/PKU.WHXB201402142

• 1488Abstract/Metrics
• Supporting Info
• 960 PDF(1213KB)

SOFT MATTER

• Mixed Cationic and Anionic Surfactant Systems Achieve Ultra-Low Interfacial Tension in the Karamay Oil Field
• ZHAO Hai-Na, CHENG Xin-Hao, ZHAO Ou-Di, HUANG Jian-Bin, LIU Chen-Jiang, ZHAO Bo
• Based on cationic and anionic surfactant mixed systems, ultra-low interfacial tension was achieved in the Karamay oil fi...
• 2014, 30 (4): 693-698 DOI: 10.3866/PKU.WHXB201402121

• 1118Abstract/Metrics
• 1002 PDF(610KB)

• Temperature Dependant Mixed Micellization Behavior of a Drug-AOT Mixture in an Aqueous Medium
• RUB Malik Abdul, ASIRI Abdullah M, KUMAR Dileep, AZUM Naved, KHAN Farah
• The mixed micellization behavior of an amphiphilic antidepressant drug amitriptyline hydrochloride (AMT) in the presence...
• 2014, 30 (4): 699-707 DOI: 10.3866/PKU.WHXB201402112

• 970Abstract/Metrics
• 951 PDF(1168KB)

CATALYSIS AND SURFACE SCIENCE

• Synthesis of Quasi-Concave Pt-Ni Nanoalloys via Overgrowth and Their Catalytic Performance towards Methanol Oxidation
• WANG Chun, KANG Jian-Xin, WANG Li-Li, CHEN Ting-Wen, LI Jie, ZHANG Dong-Feng, GUO Lin
• Quasi-concave Pt-Ni alloy nanostructures were synthesized via a solvothermal method, and were thought to form by epitaxi...
• 2014, 30 (4): 708-714 DOI: 10.3866/PKU.WHXB201401222

• 1229Abstract/Metrics
• Supporting Info
• 1567 PDF(2916KB)

• Performance of a Metal-Organic Framework MIL-53(Al)-Supported Cobalt Catalyst in the CO Catalytic Oxidation Reaction
• TAN Hai-Yan, WU Jin-Ping
• Ametal-organic framework (MOF) material MIL-53(Al) (MIL: Materials of Institut Lavoisier) with high thermal stability wa...
• 2014, 30 (4): 715-722 DOI: 10.3866/PKU.WHXB201401221

• 1655Abstract/Metrics
• 1637 PDF(1352KB)

• Effects of Promoter on NiMgAl Catalyst Structure and Performance for Carbon Dioxide Reforming of Methane
• GUO Zhang-Long, HUANG Li-Qiong, CHU Wei, LUO Shi-Zhong
• Catalysts were prepared by adding different types of promoter (Co, Ir, or Pt) to the supported nickel catalyst NiMgAl sa...
• 2014, 30 (4): 723-728 DOI: 10.3866/PKU.WHXB201402242

• 1511Abstract/Metrics
• 1105 PDF(517KB)

• Synthesis, Regeneration and Photocatalytic Activity under Visible-Light Irradiation of Ag/Ag₃PO₄/g-C₃N₄ Hybrid Photocatalysts
• LIU Jian-Xin, WANG Yun-Fang, WANG Ya-Wen, FAN Cai-Mei
• Ag/Ag3PO4/g-C3N4 (g denotes graphitic) was synthesized via an anion-exchange precipitation method, and its photocatalyti...
• 2014, 30 (4): 729-737 DOI: 10.3866/PKU.WHXB201402243

• 1522Abstract/Metrics
• 1507 PDF(1312KB)

PHOTOCHEMISTRY AND RADIATION CHEMISTRY

• Influence of Non-Thermal Plasma Discharge Mode and Reactor Structure on Ammonia Decomposition to Hydrogen
• ZHAO Yue, WANG Li, ZHANG Jia-Liang, GUO Hong-Chen
• At ambient pressure, the effect of plasma discharge mode and reactor structure on ammonia decomposition to hydrogen was ...
• 2014, 30 (4): 738-744 DOI: 10.3866/PKU.WHXB201402141

• 817Abstract/Metrics
• 1095 PDF(1036KB)

• Twofold Influence of Nitro Substituent on Aromatic Ring for Photoluminescence Properties of Benzoic Acid-Functionalized Polystyrene and Eu(Ⅲ) Complexes
• XU Ze-Qing, GAO Bao-Jiao, HOU Xiao-Dong
• Nitrobenzoic acid (NBA) was bound to the side chains of polystyrene (PS) to give nitrobenzoic acidfunctionalized polysty...
• 2014, 30 (4): 745-752 DOI: 10.3866/PKU.WHXB201402101

• 857Abstract/Metrics
• 771 PDF(563KB)

PHYSICAL CHEMISTRY OF MATERIALS

• Modification of Microvoid Defects in Polyacrylonitrile-Based Carbon Fibers by a Liquid Oligomer of Acrylonitrile
• CHAI Xiao-Yan, ZHU Cai-Zhen, HE Chuan-Xin, ZHANG Guang-Zhao, LIU Jian-Hong
• The strength of industrial carbon fibers (CFs) is far lower than their theoretical strength because of defects in the mi...
• 2014, 30 (4): 753-760 DOI: 10.3866/PKU.WHXB201401241

• 1048Abstract/Metrics
• 1167 PDF(1036KB)

• Photocatalytic Degradation of Gas-Phase Toluene over CuO Loaded BiVO₄ Hollow Nanospheres under Visible-light Irradiation
• ZHAO Wei-Rong, ZENG Wan-Yun, XI Hai-Ping, YU Xian-Xian
• The sol-gel method was used for the synthesis of BiVO4 hollow nanospheres by employing carbon spheres as a hard template...
• 2014, 30 (4): 761-767 DOI: 10.3866/PKU.WHXB201402132

• 1492Abstract/Metrics
• 844 PDF(818KB)

• Effects of Annealing on the Magnetic Properties of [NiFe/Cu/Co/Cu]_n Multilayer Nanowire Arrays
• ZHANG Wei-Guo, MA Xiao-Long, XU Yan, YAO Su-Wei, WANG Hong-Zhi
• Highly ordered [NiFe/Cu/Co/Cu]n multilayer nanowire arrays were successfully prepared by a combination of electrodeposit...
• 2014, 30 (4): 768-772 DOI: 10.3866/PKU.WHXB201402114

• 917Abstract/Metrics
• 923 PDF(787KB)

• Preparation and Up-Conversion Photoluminescence Properties of GdAlO₃：Er³⁺, Yb³⁺ Phosphors
• DENG Tao-Li, YAN Shi-Run, HU Jian-Guo
• GdAlO3:Er3+,Yb3+ phosphor was prepared by coprecipitation, sol-gel, and solid-state reaction methods, respectively. The ...
• 2014, 30 (4): 773-780 DOI: 10.3866/PKU.WHXB201402201

• 1111Abstract/Metrics
• 1275 PDF(889KB)

• Preparation, Characterization and Gas Sensing Mechanism of ZnO-Doped SnO₂ Nanofibers
• TANG Wei, WANG Jing, YAO Peng-Jun, DU Hai-Ying, SUN Yan-Hui
• SnO2 nanofibers were fabricated by electrospinning, using SnCl2 ·2H2O as the raw material. The influences of ZnO ...
• 2014, 30 (4): 781-788 DOI: 10.3866/PKU.WHXB201402191

• 1408Abstract/Metrics
• 1334 PDF(1132KB)

• Preparation of Polyethylenimine-Functionalized Silica Nanotubes and Their Application for CO₂ Adsorption
• YAO Man-Li, DONG Yan-Yan, XIE Jing, JIA Ai-Ping, XIE Guan-Qun, HU Geng-Shen, LUO Meng-Fei
• Mesoporous ethane-silica nanotubes (E-SNTs) were synthesized using P123 as a template and 1,2-bis(trimethoxysilyl)ethane...
• 2014, 30 (4): 789-796 DOI: 10.3866/PKU.WHXB201402123

• 1241Abstract/Metrics
• 988 PDF(856KB)