Current Issue
- 2013 Vol. 29,No. 08Published:09 July 2013 Date of publication: 09 July 2013
- Current column
- Table of Contents
- THERMODYNAMICS, KINETICS, AND STRUCTURAL CHEMISTRY
- THEORETICAL AND COMPUTATIONAL CHEMISTRY
- ELECTROCHEMISTRY AND NEW ENERGY
- SOFT MATTER
- CATALYSIS AND SURFACE SCIENCE
- BIOPHYSICAL CHEMISTRY
- PHYSICAL CHEMISTRY OF MATERIALS
-
Table of Contents
-
- Cover and Table of Contents for Vol.29 No. 8
- 2013, 29 (08): 0-0
-
THERMODYNAMICS, KINETICS, AND STRUCTURAL CHEMISTRY
-
- Raman Spectra of Amino Wagging Vibrational Modes in p-π-Conjugated Molecules
- TAO Sha, YU Li-Juan, WU De-Yin, TIAN Zhong-Qun
- Raman spectroscopy has been widely used as a non-destructive testing and molecular recognition technology, providing fin...
- 2013, 29 (08): 1609-1617 DOI: 10.3866/PKU.WHXB201306032
-
- Effect of the Ratio between Ionic Liquids [BMIM]Br and [BMIM][BF4] on the Charge Transfer of Br-
- MA Jing-Yuan, ZOU Yang, JIANG Zheng, HUANG Yu-Ying
- We analyzed the change of hydrogen bonding between Br- and imidazolium cations when the ionic liquid 1-butyl-3-methylimi...
- 2013, 29 (08): 1618-1622 DOI: 10.3866/PKU.WHXB201305272
-
- Method to Determine the Kinetic Parameters of the Autocatalytic Decomposition Reaction and Critical Rate of Temperature Rise of Thermal Explosion of Energetic Materials from DSC Curves
- HU Rong-Zu, ZHAO Feng-Qi, GAO Hong-Xu, YAO Er-Gang, ZHANG Hai, WANG Yao, Chang Xiang-Yu, ZHAO Hong-An
- To evaluate the thermal safety of energetic materials (EMs) using the critical rate of temperature rise of thermal explo...
- 2013, 29 (08): 1623-1631 DOI: 10.3866/PKU.WHXB201305282
-
- Application of Time-Resolved Coherent Anti-Stokes Raman Scattering Technique on the Study of Photocatalytic Hydrogen Production Kinetics
- LV Yong-Gang, LI Zhi-Jun, WU Li-Zhu, WANG Peng, FU Li-Min, ZHANG Jian-Ping
- Based on the laser pulse output from a femtosecond regenerative amplifier and optical parametric amplifier (OPA), a broa...
- 2013, 29 (08): 1632-1638 DOI: 10.3866/PKU.WHXB201304281
-
THEORETICAL AND COMPUTATIONAL CHEMISTRY
-
- Quantitative Structure-Activity Relationship Study of the Non-Nucleoside Inhibitors of HCV NS5B Polymerase by Machine Learning Methods
- CONG Yong, XUE Ying
- The quantitative structure-activity relationship (QSAR) approach was used to predict the activity of two different scaff...
- 2013, 29 (08): 1639-1647 DOI: 10.3866/PKU.WHXB201305171
-
- Electronic Structure and Edge Modification of Armchair MoS2 Nanoribbons
- YANG Zhi-Xiong, YANG Jin-Xin, LIU Qi, XIE Yu-Xing, XIONG Xiang, OUYANG Fang-Ping
- The geometries and electronic properties of armchair MoS2 nanoribbons were investigated by the first-principles method b...
- 2013, 29 (08): 1648-1654 DOI: 10.3866/PKU.WHXB201305211
-
- Effects of Orthogonal Electric Field on Water Flux through a Carbon Nanotube
- GE Zhen-Peng, SHI Yan-Chao, LI Xiao-Yi
- Water transport in nanopores is important for many biological processes and the design of nanodevices. It has been demon...
- 2013, 29 (08): 1655-1660 DOI: 10.3866/PKU.WHXB201305222
-
- Predicting Hypothetical Zeolite Frameworks Using Program FraGen
- LU Jun-Ran, LI Yi, YU Ji-Hong, LU Ying
- Zeolites are microporous materials that have been widely used in various chemical industries. Zeolite structure predicti...
- 2013, 29 (08): 1661-1665 DOI: 10.3866/PKU.WHXB201305273
-
- Improvement of Surface Structure and Enhancement of Conductivity of LiFePO4 Surface by Graphene and Graphene-Like B-C-N Coating
- SUN Chao, YAN Liu-Ming, YUE Bao-Hua
- Density functional theory calculations are used to investigate the surface structure and electric conductivity of the (0...
- 2013, 29 (08): 1666-1672 DOI: 10.3866/PKU.WHXB201304232
-
- Spin-Orbit Coupling and Zero-Field Splitting in Dioxygen Activation by Non-Heme Iron(III)
- LV Ling-Ling, WANG Xiao-Fang, ZHU Yuan-Cheng, LIU Xin-Wen, YUAN Kun, WANG Yong-Cheng
- The mechanism of the O2 activation by the protocatechuate 3,4-dioxygenase was investigated using density functional calc...
- 2013, 29 (08): 1673-1680 DOI: 10.3866/PKU.WHXB201306041
-
ELECTROCHEMISTRY AND NEW ENERGY
-
- Hydrothermal Synthesis of Partially Reduced Graphene Oxide-K2Mn4O8 Nanocomposites as Supercapacitors
- LI Le, HE Yun-Qiu, CHU Xiao-Fei, LI Yi-Ming, SUN Fang-Fang, HUANG He-Zhou
- Nanocomposites of partially reduced graphene oxide (GO)-K2Mn4O8 were synthesized via a hydrothermal process at different...
- 2013, 29 (08): 1681-1690 DOI: 10.3866/PKU.WHXB201305223
-
- Preparation and Electrochemical Capacitance Properties of Graphene Oxide/Polypyrrole Intercalation Composite
- SHI Qin, MEN Chun-Yan, LI Juan
- Graphene oxide/polypyrrole (GO/PPy) intercalation composite was successfully prepared via in-situ chemical oxidative pol...
- 2013, 29 (08): 1691-1697 DOI: 10.3866/PKU.WHXB201306031
-
- Electrochemistry of MgCl2 in LiCl-KCl Eutectic Melts
- TANG Hao, YAN Yong-De, ZHANG Mi-Lin, XUE Yun, ZHANG Zhi-Jian, DU Wei-Chao, HE Hui
- The electrochemical behavior and thermodynamic properties of MgCl2 dissolved in LiCl-KCl eutectic melts in the temperatu...
- 2013, 29 (08): 1698-1704 DOI: 10.3866/PKU.WHXB201305102
-
- Electrochemical Behavior of the System of Uranium(VI) Extraction with CMPO-Ionic Liquid
- WU Jing-Ke, SHEN Xing-Hai, CHEN Qing-De
- The electrochemical behavior of U(VI) extracted from an aqueous solution of uranyl nitrate by octyl(phenyl)-N,N-diisobut...
- 2013, 29 (08): 1705-1711 DOI: 10.3866/PKU.WHXB201306043
-
- Synthesis and Application of Ag-Cu Bimetallic Dendrites
- KANG Ya-Rong, CHEN Fu-Yi
- We synthesized silver-copper (Ag-Cu) dendritic structures on Cu foil by electrodeposition and subsequent galvanic displa...
- 2013, 29 (08): 1712-1718 DOI: 10.3866/PKU.WHXB201305132
-
- Preparation and Properties of Direct-Methane Solid Oxide Fuel Cell Based on a Graded Cu-CeO2-Ni-YSZ Composite Anode
- MENG Xiu-Xia, GONG Xun, YANG Nai-Tao, TAN Xiao-Yao, MA Zi-Feng
- A graded anode-supported solid oxide fuel cell (SOFC) with the structure porous Ni-yttria stabilized zirconia (Ni-YSZ)|m...
- 2013, 29 (08): 1719-1726 DOI: 10.3866/PKU.WHXB201305151
-
- Comparison of Enzymatic Activities and Electroactivities of Adsorbed Glucose Oxidase on Several Nanomaterial-Modified Electrodes
- YANG Da-Wei, CHEN Chao, XIE Qing-Ji, YAO Shou-Zhuo
- The quartz-crystal microbalance technique was used to monitor the adsorption of glucose oxidase (GOx) on bare Au, Au-ele...
- 2013, 29 (08): 1727-1734 DOI: 10.3866/PKU.WHXB201306042
-
- Spectrum Response Enhancement of Organic Solar Cell Using a Poly(3-hexylthiophene) Photosensitizing Layer
- WU Zhen-Wu, LIU Yang, WEI Shang-Jiang, HUANG Xun, ZHANG Dongyu, ZHOU Ming, CHEN Liwei, MA Chang-Qi, WANG Hua
- We report here the photovoltaic performance of a solar cell using poly-{[4,8-bis[(2-ethylhexyl) oxy]-benzo[1,2-b:4,5-b']...
- 2013, 29 (08): 1735-1744 DOI: 10.3866/PKU.WHXB201305241
-
- Effects of Pt Content on the Catalytic Performance of Co@Pt/C Core-Shell Structured Electrocatalysts
- ZHAO Tian-Tian, LIN Rui, ZHANG Lu, CAO Chui-Hui, MA Jian-Xin
- Core-shell structured Co@Pt/C electrocatalysts containing different mass fractions of Co to Pt, which are represented as...
- 2013, 29 (08): 1745-1752 DOI: 10.3866/PKU.WHXB201305101
-
- Electrochemical Behavior of Pyridine-Doped Carbon-Supported Co-Phthalocyanine (Py-CoPc/C) for Oxygen Reduction Reaction and Its Application to Fuel Cell
- DAI Xian-Feng, ZHEN Ming-Fu, XU Pan, SHI Jing-Jing, MA Cheng-Yu, QIAO Jin-Li
- Pyridine-doped, carbon-supported Co-phthalocyanine (Py-CoPc/C) nanoparticle catalysts were synthesized via a combined so...
- 2013, 29 (08): 1753-1761 DOI: 10.3866/PKU.WHXB201306141
-
SOFT MATTER
-
- Growth Modes of Condensates on Nanotextured Surfaces and Mechanism of Partially Wetted Droplet Formation
- LIU Tian-Qing, SUN Wei, LI Xiang-Qin, SUN Xiang-Yu, AI Hong-Ru
- The energy increasing rate (EIR) of a condensed droplet was analyzed during its growth in three different modes. The low...
- 2013, 29 (08): 1762-1770 DOI: 10.3866/PKU.WHXB201306033
-
`s\vl V E `s\vl V
CATALYSIS AND SURFACE SCIENCE
-
- Controllable Synthesis and Photocatalytic Activity of Spherical, Flowerlike and Threadlike Bismuth Vanadates
- LIN Xue, YU Li-Li, Yan Li-Na, GUAN Qing-Feng, Yan Yong-Sheng, ZHAO Han
- Spherical, flowerlike, and threadlike bismuth vanadates (BiVO4) were synthesized via a controllable hydrothermal method ...
- 2013, 29 (08): 1771-1777 DOI: 10.3866/PKU.WHXB201305131
-
- Highly Active and Stable Catalyst for Visible Light Hydrogen Production Based on Oxidative Quenching of Eosin Y
- LI Bo, LÜ Gong Xuan
- The effects and mechanism of methyl viologen (MV2+) on photocatalytic hydrogen production over an active, stable catalys...
- 2013, 29 (08): 1778-1784 DOI: 10.3866/PKU.WHXB201305302
-
BIOPHYSICAL CHEMISTRY
-
- Acid-Induced Unfolding Process of Myoglobin and Its Mutant under Macromolecular Crowding Conditions
- ZHANG Yu-Jiao, TANG Qian, CAO Hong-Yu, ZHENG Xue-Fang
- In this paper, we studied the unfolding process of myoglobin (Mb) and its mutant Mb(D60K) induced by acid under macromol...
- 2013, 29 (08): 1785-1792 DOI: 10.3866/PKU.WHXB201305271
-
- Multicomplex-Based Pharmacophore and QSAR of Aryl-Sulfamides as Pyruvate Kinase M2 Activators
- CHEN Zheng-Jun, JIANG Qing-Lin, HE Gu, HAN Bo, GUO Li
- Pyruvate kinase M2 (PKM2) is well-known as a potential target for cancer therapy. In this study, the multicomplex-based ...
- 2013, 29 (08): 1793-1803 DOI: 10.3866/PKU.WHXB201305152
-
PHYSICAL CHEMISTRY OF MATERIALS
-
- Influence of KH on Reversible Dehydriding Performance of Na-Al-H Complex Hydride
- WANG Shun-Kui, LI Zhi-Jie, XIAO Xue-Zhang, FAN Xiu-Lin, CHEN Zhi-Wen, LI Shou-Quan, GE Hong-Wei, CHEN Li-Xin
- The Na-Al-H complex hydride was prepared by reactive ball milling (NaH/Al+CeCl3) and (NaH/Al+CeCl3/yKH) (y=0.02, 0.04) c...
- 2013, 29 (08): 1804-1808 DOI: 10.3866/PKU.WHXB201306061
-
- Synthesis of Plate Like Silicalite-1 with Controlled Thickness
- YAO Xiao-Qiang, XU Xiang-Yu, LÜ Zhi, JIAO Kun, SONG Jia-Qing, LI Zhao-Fei, WANG Qian, YAN Li-Jun, HE Ming-Yuan
- In this study, plate like Silicalite-1 samples with controlled thickness were synthesized using a SiO2-TPAOH-H2O-NH4F (T...
- 2013, 29 (08): 1809-1813 DOI: 10.3866/PKU.WHXB201305161
-
- Effects of Derivatives of 3-Mercaptoisobutyric Acid on the Aqueous Synthesis of CdTe Quantum Dots
- MA Kai-Guo, FANG Tan, BAI Jin-Yi, GUO Hai-Qing
- Mercapto acids can affect the obtaining CdTe quantum dots (QDs) with narrow size distribution and high fluorescent quant...
- 2013, 29 (08): 1814-1818 DOI: 10.3866/PKU.WHXB201305301
-
- Synthesis and Visible Light Photocatalytic Activities of Au/Cu2O Heterogeneous Nanospheres
- SHANG Yang, CHEN Yang, SHI Zhan-Bin, ZHANG Dong-Feng, GUO Lin
- Au/Cu2O heterogeneous spheres (HGS) were prepared by in situ reduction of preadsorbed AuCl4- on the surface of Cu2O meso...
- 2013, 29 (08): 1819-1826 DOI: 10.3866/PKU.WHXB201305281
-
- Preparation of Electrospun In2O3/CdO Composite and Its Formaldehyde-Sensing Properties
- CHEN Peng-Peng, WANG Jing, ZHANG Chun-Li, HAO Yu-Wen, DU Hai-Ying
- In(NO3)3/polyvinyl pyrrolidone (PVP) nanofiber precursors were synthesized using a traditional electrospinning method, a...
- 2013, 29 (08): 1827-1836 DOI: 10.3866/PKU.WHXB201306091
