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Acta Phys. -Chim. Sin.
Acta Phys. -Chim. Sin.
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中文
Current Issue
2012 Vol. 28,No. 11
Published: 17 October 2012
Current column
Table of Contents
INVITED COMMENT
REVIEW
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
Retracted
Table of Contents
Cover and Table of Contents for Vol.28 No. 11
2012, 28 (11): 0.
1573
Abstract/Metrics
1800
PDF(6457KB)
INVITED COMMENT
2012年度国家自然科学基金化学科学三处项目评审总结
CHANG Qing-Hua, LEI Jing-Lei, GAO Fei-Xue, YANG Jun-Lin
2012, 28 (11): 2507-2510.
DOI: 10.3866/PKU.WHXB201209264
7337
Abstract/Metrics
3040
PDF(367KB)
REVIEW
Research Progress in Silver Nanoplates
MO Bo, KAN Cai-Xia, KE Shan-Lin, CONG Bo, XU Li-Hong
Metal nanostructures have unique properties that differ from their bulk structures. Among the various silver nanostructu...
2012, 28 (11): 2511-2524.
DOI: 10.3866/PKU.WHXB201208132
6023
Abstract/Metrics
3134
PDF(2040KB)
Preparation and Controlled Assembly of Asymmetric Janus Particles
YANG Yi, YE Wei, CHEN Xiao
Janus particles have different or asymmetric hemispheres both in structure and chemical properties. These particles have...
2012, 28 (11): 2525-2535.
DOI: 10.3866/PKU.WHXB201208222
8035
Abstract/Metrics
4437
PDF(1009KB)
THERMODYNAMICS, KINETICS, AND STRUCTURAL CHEMISTRY
Reduction of the Detailed Kinetic Mechanism for High-Temperature Combustion of
n
-Dodecane
FANY Ya-Mei, WANY Quan-De, WANY Fan, LI Xiang-Yuan
The detailed chemical kinetic mechanism for high-temperature combustion of n-dodecane was systematically reduced via int...
2012, 28 (11): 2536-2542.
DOI: 10.3866/PKU.WHXB201208201
4488
Abstract/Metrics
1938
PDF(1700KB)
Ultrafast Internal Conversion Dynamics of 2-Chloropyridine by Femtosecond Time-Resolved Photoelectron Imaging
GHAZAl Ahmed-Yousif, QIU Xue-Jun, QIN Chao-Chao, LONG Jin-You, ABULIMITI Bumaliya, ZHANG Bing
Ultrafast internal conversion dynamics of 2-chloropyridine were studied by femtosecond time-resolved photoelectron imagi...
2012, 28 (11): 2543-2548.
DOI: 10.3866/PKU.WHXB201208135
3954
Abstract/Metrics
1305
PDF(921KB)
Syntheses, Structures and Photoelectron Property of a Series of Cu(II/I) Coordination Polymers
JIN Jing, XU Xiao-Ting, CONG Sheng-Mei, LI Lei, ZHANG Guang-Ning, NIU Shu-Yun
Three Cu(II/I) coordination polymers/supramolecules were obtained by means of hydrothermal synthesis: (1) [K2Cu2(ox)(bte...
2012, 28 (11): 2549-2557.
DOI: 10.3866/PKU.WHXB201207311
5779
Abstract/Metrics
Supporting Info
1665
PDF(852KB)
Simulation Study of the Effect ofMethanol on the Structure and Properties of 1-Butyl-3-methylimidazolium Tetrafluoroborate Ionic Liquid
WANG Ding, TIAN Guo-Cai
The microstructure and properties of 1-butyl-3-methylimidazolium tetrafluoroborate ([BMIM] [BF4])/methanol mixtures with...
2012, 28 (11): 2558-2566.
DOI: 10.3866/PKU.WHXB201208271
5164
Abstract/Metrics
Supporting Info
2268
PDF(2118KB)
THEORETICAL AND COMPUTATIONAL CHEMISTRY
Equilibrium Solubility Modeling of CO
2
in Na
2
Cr
2
O
7
Solutions
ZHOU En-Nian, YU Zhi-Hui, QU Jing-Kui, Qi Tao, Han Xiao-Ying, ZHANG Guo-Qing
The solubility of CO2 in aqueous Na2Cr2O7 solutions of different concentrations (0, 0.361, 0.650, and 0.901 mol·k...
2012, 28 (11): 2567-2573.
DOI: 10.3866/PKU.WHXB201208211
4027
Abstract/Metrics
1277
PDF(571KB)
Asymmetrical Inter-Cage Electron Transfer Electromers and Their Transfer Characteristics Under Electric Fields
WANG Yin-Feng, HUANG Jian-Gen, ZHOU Guang-Pei, LI Zhi-Ru
The asymmetrical, double-cage-shaped, single molecular solvated electron compounds e-@C24F22(NH)2C20F18 (1, 2, and 3) we...
2012, 28 (11): 2574-2580.
DOI: 10.3866/PKU.WHXB201207302
5192
Abstract/Metrics
Supporting Info
1855
PDF(2108KB)
Statistical Correction of Heat of Formation Calculated by the O3LYP Method
WANG Xiu-Jun, LONG Mi
The results of density functional theory calculations are known to contain inherent numerical errors caused by various i...
2012, 28 (11): 2581-2588.
DOI: 10.3866/PKU.WHXB201207172
3902
Abstract/Metrics
1443
PDF(1346KB)
Effects of Excited State Vibrational Coherence on Photo-Induced Electron Transfer Rates in Dye-Sensitized Nanocrystalline TiO
2
JIANG Li-Lin, LU Xi-Yin, SONG Yun-Fei, LIU Wei-Long, YANG Yan-Qiang
Based on the expression for the electron occupation probability of the excited state, and the empirical formula of the F...
2012, 28 (11): 2589-2596.
DOI: 10.3866/PKU.WHXB201207192
4084
Abstract/Metrics
1290
PDF(1433KB)
Optoelectronic Properties for Main Group Element-Bridged Ladder Compounds
LIU Shu-Juan, MA Ting-Chun, XU Wen-Juan, LIU Xiang-Mei, ZHAO Qiang, HUANG Yan-Qin, HUANG Wei
Ladder-type π-conjugated molecules with fully ring-fused structures have fascinating optoelectronic properties becaus...
2012, 28 (11): 2597-2604.
DOI: 10.3866/PKU.WHXB201208272
4829
Abstract/Metrics
Supporting Info
1492
PDF(1077KB)
Thermal Decomposition Mechanism of
β
-HMX under High Pressures
via
ReaxFF Reactive Molecular Dynamics Simulations
ZHOU Ting-Ting, SHI Yi-Ding, HUANG Feng-Lei
The thermal decomposition mechanisms of condensed phase β-HMX at various densities (ρ= 1.89, 2.11, 2.22, 2.46, ...
2012, 28 (11): 2605-2615.
DOI: 10.3866/PKU.WHXB201208031
5077
Abstract/Metrics
Supporting Info
2740
PDF(3418KB)
ELECTROCHEMISTRY AND NEW ENERGY
Online Electrochemistry/Electrospray Mass Spectrometry with a Coaxial Probe for Investigation of Electrochemical Derivatization of Anthracene with Dodecylamine
LING Xing, DING Chuan-Fan
In the present study, a coaxial probe was used for online electrochemistry/electrospray mass spectrometry (EC/ES-MS). Th...
2012, 28 (11): 2616-2624.
DOI: 10.3866/PKU.WHXB201208133
4596
Abstract/Metrics
Supporting Info
1393
PDF(844KB)
Effects of Current Collectors on the Electrochemical Performance of Electrolytes for Rechargeable Magnesium Batteries
CHEN Qiang, NULI Yanna, YANG Jun, KAILIBINUER Kerimu, WANG Jiulin
The effects of metal (platinum, nickel, stainless steel (SS), copper and aluminum) and carbon paper (carbon fiber, graph...
2012, 28 (11): 2625-2631.
DOI: 10.3866/PKU.WHXB201208032
6093
Abstract/Metrics
2776
PDF(1380KB)
Photoelectric Conversion Efficiency of N719/TiO
2
-In
x
%/FTO Film Electrodes Incorporating In Doped at the TiO
2
Surface
CHENG Hui, YAO Jiang-Hong, CAO Ya-An
Nanoparticles of TiO2 with surface modification by In doping were prepared using a sol-gel technique. These materials ha...
2012, 28 (11): 2632-2640.
DOI: 10.3866/PKU.WHXB201207301
4250
Abstract/Metrics
1844
PDF(925KB)
Novel Organosilicon Ionic Liquid Based Electrolytes for Supercapacitors
ZhONG Hao-Xiang, ZHAO Chun-Bao, LUO Hao, ZHANG Ling-Zhi
A novel room temperature organosilicon ionic liquid (SiN1IL) was synthesized and its chemical structure and electrochemi...
2012, 28 (11): 2641-2647.
DOI: 10.3866/PKU.WHXB201207181
5567
Abstract/Metrics
1930
PDF(657KB)
Influence of Reducer on the Nanopore Structure of Porous Anodic Alumina
ZHU Xu-Fei, HAN Hua, MA Hong-Tu, LU Chao, QI Wei-Xing, XU Chen
In recent years, attention has been focused on adjustment and control of the nanostructures of porous anodic alumina (PA...
2012, 28 (11): 2648-2658.
DOI: 10.3866/PKU.WHXB201208151
4417
Abstract/Metrics
1965
PDF(2696KB)
Effect of Urea on Microbiologically Induced Corrosion of Carbon Steel in Soil
SUN Cheng, LI Xi-Ming, XU Jin, YAN Mao-Cheng, WANG Fu-Hui, WANG Zhen-Yao
The effect of urea on microbiologically induced corrosion (MIC) of carbon steel in soil was investigated using weight-lo...
2012, 28 (11): 2659-2668.
DOI: 10.3866/PKU.WHXB201208243
4392
Abstract/Metrics
1665
PDF(3120KB)
Influence of Polymer Gel Electrolyte on the Performance of Dye-Sensitized Solar Cells Analyzed by Electrochemical Impedance Spectroscopy
DAI Yu-Hua, LI Xiao-Jie, FANG Yan-Yan, SHI Qiu-Fei, LIN Yuan, YANG Ming-Shan
The effects of gel electrolyte polymer matrix structure and composition on the photovoltaic properties of quasi-solid st...
2012, 28 (11): 2669-2675.
DOI: 10.3866/PKU.WHXB201206191
4842
Abstract/Metrics
1926
PDF(867KB)
Preparation of ZnO/In
2
O
3
Composite Hollow Spheres and Their Photoelectrocatalytic Properties to Glucose Degradation
LI Wei-Bing, BU Yu-Yu, YU Jian-Qiang
A series of materials consisting of ZnO/In2O3 composite hollow spheres were successfully prepared by a two-step process ...
2012, 28 (11): 2676-2682.
DOI: 10.3866/PKU.WHXB201207101
3789
Abstract/Metrics
2028
PDF(1255KB)
SOFT MATTER
Synthesis and Characterization of Temperature-Sensitivity P(MEO
2
MA-
co
-OEGMA) Copolymers
LÜ Hai-Yan, LIU Shou-Xin, XU Chao, TIAN Rong, WANG Li
Temperature-responsive P(MEO2MA-co-OEGMA) copolymers of 2-(2-methoxyethoxy) ethyl methacrylate (MEO2MA) and oligo(ethyle...
2012, 28 (11): 2683-2689.
DOI: 10.3866/PKU.WHXB201207161
6923
Abstract/Metrics
2590
PDF(1354KB)
CATALYSIS AND SURFACE SCIENCE
Effect of pH Value on the Properties of Molybdenum-Based Multiphasic Oxide Catalysts in Selective Oxidation of Isobutene to Methacrolein
XU Da, LIU Shi-Yan, LIU Yun-Ling, WANG Zhen-Lü
The effect of different pH values on Mo-Bi-Fe-Co-Mn multiphasic oxide catalysts prepared via co-precipitation methods wa...
2012, 28 (11): 2690-2696.
DOI: 10.3866/PKU.WHXB201208282
5866
Abstract/Metrics
1552
PDF(539KB)
Highly-Dispersed NiO Nanoparticles on SBA-15 for Oxidative Dehydrogenation of Propane to Propylene
LU Huai-Qian, SHI Lei, HE Chong, WENG Wei-Zheng, HUANG Chuan-Jing, WAN Hui-Lin
A series of NiO/SBA-15 (wNiO=20%) catalysts were prepared by impregnating SBA-15 with an aqueous solution of nickel nitr...
2012, 28 (11): 2697-2704.
DOI: 10.3866/PKU.WHXB201207091
4609
Abstract/Metrics
1591
PDF(811KB)
Catalytic Conversion of Methanol to Propylene over (NH
4
)
2
SiF
6
-Modified Nanosized HZSM-5 Zeolite
HU Si, ZHANG Qing, XIA Zhi, GONG Yan-Jun, XU Jun, DENG Feng, DOU Tao
(NH4)2SiF6-modified nanosized HZSM-5 zeolite was prepared and investigated as a catalyst formethanol to propylene conver...
2012, 28 (11): 2705-2712.
DOI: 10.3866/PKU.WHXB201207171
4479
Abstract/Metrics
Supporting Info
1690
PDF(776KB)
Photocatalytic Properties of Aluminum Doped Zinc Oxide Nanocrystals Controlled Prepared via a Synergistic Ultrasonic/Hydrothermal Technique
YANG Xiao-Hong, TONG Qin, LIU Chang, LIU Jin-Ku, HE Wen-Zhi, LI Guang-Ming
Aluminum doped zinc oxide (ZAO) nanocrystals approximately 20 nm in diameter and with good dispersity and crystallinity ...
2012, 28 (11): 2713-2720.
DOI: 10.3866/PKU.WHXB201207163
4906
Abstract/Metrics
1786
PDF(4179KB)
BIOPHYSICAL CHEMISTRY
Adsorption of Core-Shell Poly(Methyl Methacrylate)-Bovine Serum Albumin Nanoparticles on Gold Surface and Its Sensor Application
HE Chuan-Xin, YUAN An-Peng, ZHANG Qian-Lin, REN Xiang-Zhong, LI Cui-Hua, LIU Jian-Hong
Core-shell poly(methyl methacrylate)-bovine serum albumin (PMMA-BSA) nanoparticles with PMMA cores and BSA shells were p...
2012, 28 (11): 2721-2728.
DOI: 10.3866/PKU.WHXB201207191
5872
Abstract/Metrics
1920
PDF(2132KB)
Division of Protein Surface Patches and Its Application in Protein Binding Site Prediction
WANG Pan-Wen, GONG Xin-Qi, LI Chun-Hua, CHEN Wei-Zu, WANG Cun-Xin
Binding site prediction for protein-protein complexes is a challenging problem in the area of computational molecular bi...
2012, 28 (11): 2729-2734.
DOI: 10.3866/PKU.WHXB201208162
4773
Abstract/Metrics
1607
PDF(827KB)
Molecular Dynamics Simulation and Binding Free Energy Calculation of the Conformational Transition of Amyloid Peptide 42 Inhibited by Peptide Inhibitors
DONG Xiao-Yan, DU Wen-Jie, LIU Fu-Feng
The molecular mechanisms of the conformational transition of amyloid β-peptide (Aβ) 42 inhibited by the peptid...
2012, 28 (11): 2735-2744.
DOI: 10.3866/PKU.WHXB201207162
4859
Abstract/Metrics
2509
PDF(1253KB)
PHYSICAL CHEMISTRY OF MATERIALS
Preparation of Nitrogen-Doped Graphene and Its Supercapacitive Properties
SU Peng, GUO Hui-Lin, PENG San, NING Sheng-Ke
Nitrogen-doped graphene was synthesized by the hydrothermal method with graphene oxide (GO) as the raw material and urea...
2012, 28 (11): 2745-2753.
DOI: 10.3866/PKU.WHXB201208221
13437
Abstract/Metrics
7033
PDF(2472KB)
Synthesis and Microwave Absorption Properties of Nickel Nanoparticles-Graphene Composites with Different Morphologies
LI Song-Mei, WANG Bo, LIU Jian-Hua, YU Mei, AN Jun-Wei
Nickel nanoparticles-graphene (Ni-GNs) composites with two different morphologies were successfully synthesized by in si...
2012, 28 (11): 2754-2760.
DOI: 10.3866/PKU.WHXB201208292
5698
Abstract/Metrics
2726
PDF(1201KB)
Retracted
【Retracted】Stability of Au Nanocrystals in 2D Superlattice
ZHAI Wei, WANG Jian-yuan
We synthesized 5.5 nm Au nanocrystals coated by dodecanethiol (C12SH26) by reverse micelle method. The Au nanocrystals a...
2012, 28 (11): 9999-9999.
DOI: 10.3866/PKU.WHXB201208172
4384
Abstract/Metrics
2186
PDF(912KB)