Table of Contents

• Cover and Table of Contents for Vol.30 No. 3
• 2014, 30 (3): 0

• 561Abstract/Metrics
• 1585 PDF(7706KB)

REVIEW

• Heterojunction Interface Modification and Its Effect on the Photovoltaic Performance of Hybrid Solar Cells
• PEI Juan, HAO Yan-Zhong, SUN Bao, LI Ying-Pin, FAN Long-Xue, SUN Shuo, WANG Shang-Xin
• Much attention has been focused on hybrid solar cells because of their low cost and high theoretical efficiencies. The p...
• 2014, 30 (3): 397 -407 DOI: 10.3866/PKU.WHXB201401202

• 1591Abstract/Metrics
• 1518 PDF(1572KB)

THEORETICAL AND COMPUTATIONAL CHEMISTRY

• Dissipative Particle Dynamics Simulation on Aggregation of Rod-Coil-Rod Triblock Copolymer in Dilute Solution
• FAN Zhong-Xiang, HUANG Jian-Hua
• The aggregate morphology of rod-coil-rod copolymers in a dilute solution was investigated by dissipative particle dynami...
• 2014, 30 (3): 408 -412 DOI: 10.3866/PKU.WHXB201312271

• 1388Abstract/Metrics
• 1379 PDF(1496KB)

• Coupling Effects of Diffusive Model and Sticking Model on Aggregation Kinetics of Colloidal Particles：A Monte Carlo Simulation Study
• XIONG Hai-Ling, YANG Zhi-Min, LI Hang
• The effects of the diffusive (Ds(γ)=D0×sγ) and sticking (Pij(σ)=P0×(i×j)σ) mod...
• 2014, 30 (3): 413 -422 DOI: 10.3866/PKU.WHXB201401203

• 1106Abstract/Metrics
• 1181 PDF(4611KB)

• Structures and Properties of BX[(CH₂)_n]₃ and BX(CH₂)[CH(CH₂)_nCH] (X=N, P) with the [n.n.n]propellane Configuration
• LI Jin-Xia, ZHANG Cong-Jie
• We have designed a family of novel molecules BX[(CH2)n]3 and BX(CH2)[CH(CH2)nCH] (X=N, P) with the [n.n.n]propellane con...
• 2014, 30 (3): 423 -430 DOI: 10.3866/PKU.WHXB201312251

• 1328Abstract/Metrics
• 1071 PDF(719KB)

• Theory Studies on Low-Lying States of Lead Chalcogenide Cations
• CAO Zhan-Li, WANG Zhi-Fan, YANG Ming-Li, WANG Fan
• In this work, we investigate the low-lying states of PbS, PbSe, and PbTe cations based on a recently developed equation-...
• 2014, 30 (3): 431 -438 DOI: 10.3866/PKU.WHXB201401023

• 943Abstract/Metrics
• 983 PDF(575KB)

• Effects of External Field and Nanoribbon Length on the Electronic Structure and Properties of Graphene Nanoribbons
• SUN Jin, LIANGWan-Zhen
• We investigated the ground and excited state electronic properties of finite length zigzag graphene nanoribbons, using t...
• 2014, 30 (3): 439 -445 DOI: 10.3866/PKU.WHXB201401141

• 1001Abstract/Metrics
• 1007 PDF(3045KB)

ELECTROCHEMISTRY AND NEW ENERGY

• Fabrication and Photovoltaic Performance of High Efficiency Front-Illuminated Dye-Sensitized Solar Cell Based on Ordered TiO₂ Nanotube Arrays
• GAO Su-Wen, LAN Zhang, WU Wan-Xia, QUE Lan-Fang, WU Ji-Huai, LIN Jian-Ming, HUANG Miao-Liang
• An efficient front-illuminated dye-sensitized solar cell (DSSC) based on ordered TiO2 nanotube (TNT) arrays was prepared...
• 2014, 30 (3): 446 -452 DOI: 10.3866/PKU.WHXB201401022

• 1379Abstract/Metrics
• 1290 PDF(1091KB)

• To Improve the Efficiency of Bulk Heterojunction Organic Solar Cells by Incorporating CdSe/ZnS Quantum Dots
• NI Ting, ZOU Fan, JIANG Yu-Rong, YANG Sheng-Yi
• The efficiency of bulk heterojunction solar cells was enhanced by incorporating CdSe/ZnS core-shell colloidal quantum do...
• 2014, 30 (3): 453 -459 DOI: 10.3866/PKU.WHXB201312274

• 1488Abstract/Metrics
• 1050 PDF(645KB)

• Preparation and Electrochemical Characterization of Nano-LiMnPO₄
• YANG Wen-Chao, BI Yu-Jing, YANG Bang-Cheng, WANG De-Yu, SHI Si-Qi
• Nano-LiMnPO4 samples were synthesized via a two-step heating polyol method. The role of the first thermal plateau temper...
• 2014, 30 (3): 460 -466 DOI: 10.3866/PKU.WHXB201401074

• 1601Abstract/Metrics
• 1580 PDF(1121KB)

• Crystal Structure and Electrochemical Performance of Lithium-Rich Cathode Materials xLi₂MnO₃·(1-x)LiNi_0.5Mn_0.5O₂ (x=0.1-0.8)
• CHEN Lai, CHEN Shi, HU Dao-Zhong, SU Yue-Feng, LI Wei-Kang, WANG Zhao, BAO Li-Ying, WU Feng
• A series of lithium-rich cathode materials, xLi2MnO3·(1-x)LiNi0.5Mn0.5O2 (x=0.1-0.8), were successfully synthesiz...
• 2014, 30 (3): 467 -475 DOI: 10.3866/PKU.WHXB201312252

• 1920Abstract/Metrics
• 1518 PDF(3211KB)

• Synthesis and Electrochemical Lithium Storage Performance of WO₃ Nanorods/Graphene Nanocomposites
• ZHANG Qing-Qing, LI Rong, ZHANG Meng-Meng, GOU Xing-Long
• WO3 nanorods/graphene nanocomposites (WO3/RGO) were prepared by the solvothermal treatment of tungsten hexachloride and ...
• 2014, 30 (3): 476 -484 DOI: 10.3866/PKU.WHXB201401071

• 1760Abstract/Metrics
• 2010 PDF(1068KB)

• Effects of Separator on the Electrochemical Performance of Electrical Double-Layer Capacitor and Hybrid Battery-Supercapacitor
• SUN Xian-Zhong, ZHANG Xiong, HUANG Bo, MA Yan-Wei
• Separators are important components in electrochemical energy storage devices such as electrical double layer capacitors...
• 2014, 30 (3): 485 -491 DOI: 10.3866/PKU.WHXB201401131

• 2401Abstract/Metrics
• 2055 PDF(898KB)

• Influence of Alloying Element Nd on the Electrochemical Behavior of Pb-Ag Anode in H₂SO₄ Solution
• ZHONG Xiao-Cong, GUI Jun-Feng, YU Xiao-Ying, LIU Fang-Yang, JIANG Liang-Xing, LAI Yan-Qing, LI Jie, LIU Ye-Xiang
• Anodic layers and oxygen evolution reaction (OER) of Pb-Ag and Pb-Ag-Nd anodes were investigated by cyclic voltammetry, ...
• 2014, 30 (3): 492 -499 DOI: 10.3866/PKU.WHXB201312301

• 1378Abstract/Metrics
• 1139 PDF(1091KB)

SOFT MATTER

• Antimony-Doped Tin Oxide Aerogel Based on Epoxide Additional Method
• YU Qiu-Jie, ZHOU Bin, ZHANG Zhi-Hua, LIU Guang-Wu, DU Ai
• Antimony-doped tin oxide (ATO) aerogels were prepared from inorganic salts via epoxide additional method, CO2 supercriti...
• 2014, 30 (3): 500 -507 DOI: 10.3866/PKU.WHXB201401201

• 1176Abstract/Metrics
• 1231 PDF(1439KB)

CATALYSIS AND SURFACE SCIENCE

• Effect of Sintering Temperature on the Photocatalytic Activity of Flower-Like Bi₂WO₆
• SHENG Jia-Yi, LI Xiao-Jin, XU Yi-Ming
• Bi2WO6 is reportedly active for the photocatalytic degradation of organic compounds in aerated aqueous solution, but fac...
• 2014, 30 (3): 508 -512 DOI: 10.3866/PKU.WHXB201312302

• 1798Abstract/Metrics
• 1205 PDF(852KB)

• Visible Light Photocatalytic Activity of an In-Doped TiO₂ Thin Film with a Three-Dimensional Ordered Structure
• WANG Jing-Sheng, WANG En-Jun, YU Yan-Long, GUO Li-Mei, CAO Ya-An
• An In-doped TiO2 thin film with a three-dimensional (3D) ordered structure (IO-TiO2-In) was prepared by the self-assembl...
• 2014, 30 (3): 513 -519 DOI: 10.3866/PKU.WHXB201401073

• 1307Abstract/Metrics
• 1055 PDF(786KB)

• Catalytic Performance of Polycrystalline Cu₂O with Different Structures on the Thermal Decomposition of Ammonium Perchlorate
• LUO Xiao-Lin, YANG De-Suo, YUAN Chun-Lan, LUO Xu-Mei, CHEN Ya-Shao
• Porous Cu2O micro-spheres were synthesized without additives, using a homogeneous reactor. The effects of synthesis time...
• 2014, 30 (3): 520 -526 DOI: 10.3866/PKU.WHXB201401061

• 1231Abstract/Metrics
• 1018 PDF(1020KB)

• Influence of Cs Substitution on the Structural Properties and Catalytic Performance of Ni-H₃PW₁₂O₄₀/SiO₂ Catalysts
• JIN Hao, SUN Xiao-Dan, DONG Shu, WU Yi-Zhi, SUN Su-Hua, LIU Jie, ZHU Hui-Hong, YANG Guang, YI Xiao-Dong, FANG Wei-Ping
• Cs-substituted Ni-CsxH3-xPW12O40/SiO2 catalysts were prepared by two-step impregnation and in situ reaction on the suppo...
• 2014, 30 (3): 527 -534 DOI: 10.3866/PKU.WHXB201401072

• 1530Abstract/Metrics
• 791 PDF(616KB)

• Methanol to Propylene over Nanosheets of HZSM-5 Zeolite
• ZHANG Shao-Long, ZHANG Lan-Lan, WANG Wu-Gang, MIN Yuan-Yuan, MATong, SONG Yu, GONG Yan-Jun, DOU Tao
• Nanosheets of HZSM-5 zeolite with different SiO2/Al2O3 molar ratios were synthesized, and their catalytic behavior in th...
• 2014, 30 (3): 535 -543 DOI: 10.3866/PKU.WHXB201401032

• 1666Abstract/Metrics
• 1390 PDF(806KB)

• Effects on Adsorption Desulfurization of CeY Zeolites：Acid Catalysis and Competitive Adsorption
• QIN Yu-Cai, GAO Xiong-Hou, DUAN Lin-Hai, FAN Yue-Chao, YU Wen-Guang, ZHANG Hai-Tao, SONG Li-Juan
• The effects of olefin and aromatic hydrocarbons, as well as the acidic catalytic reactions on the adsorption desulfuriza...
• 2014, 30 (3): 544 -550 DOI: 10.3866/PKU.WHXB201401021

• 1284Abstract/Metrics
• 1171 PDF(842KB)

• Correlation between Galvanic Corrosion and Electronic Work Function of Al Alloy Surfaces
• WANG Jian, WANG Shao-Qing
• Al alloys contain some secondary phases to improve their properties. These secondary phases have different potentials to...
• 2014, 30 (3): 551 -558 DOI: 10.3866/PKU.WHXB201312272

• 1680Abstract/Metrics
• Supporting Info
• 1588 PDF(2022KB)

BIOPHYSICAL CHEMISTRY

• Simulated Mechanism of Triclosan in Modulating the Active Site and Loop of FabI by Computer
• AI Yi-Xin, LU Jun-Rui, XIN Chun-Wei, MU Jiang-Bei, YANG Xu-Yun, ZHANG He
• The impact of conformation of the active site loop, secondary structure, active site volume, and substrate (unsaturated ...
• 2014, 30 (3): 559 -568 DOI: 10.3866/PKU.WHXB201401132

• 1564Abstract/Metrics
• 1859 PDF(4481KB)

PHYSICAL CHEMISTRY OF MATERIALS

• Synthesis of Ag Nanostructures with Controlled Shapes by a Polyvinylpyrrolidone-Assisted Hydrothermal Method
• XU Li-Hong, KAN Cai-Xia, WANG Chang-Shun, CONG Bo, NI Yuan, SHI Da-Ning
• Ag nanostructures with well-defined shapes and optical resonances have been masssynthesized by a hydrothermal method. Po...
• 2014, 30 (3): 569 -575 DOI: 10.3866/PKU.WHXB201312253

• 1720Abstract/Metrics
• 1748 PDF(957KB)

• Controllable Synthesis of Zn_xCd_1-xS Nanowires with Tunable Optical Properties
• LIN Xu-Feng, XI Yan-Yan, LIN De-Lian
• ZnxCd1-xS (0x xCd1-xS nanowires. The LO peak frequency changed smoothly with changing composition, which approximately s...
• 2014, 30 (3): 576 -582 DOI: 10.3866/PKU.WHXB201312232

• 1174Abstract/Metrics
• 989 PDF(1153KB)

• One-Step Preparation of Superhydrophobic Polyaniline/Sodium Dodecylbenzenesulfonate Composites
• SONG Gen-Ping, XIA Dong-Xiang
• Superhydrophobic polyaniline (PANI)/sodium dodecylbenzenesulfonate (SDBS) composites were fabricated in one-step, by the...
• 2014, 30 (3): 583 -588 DOI: 10.3866/PKU.WHXB201401031

• 1836Abstract/Metrics
• 1309 PDF(928KB)