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Acta Phys. -Chim. Sin.
Acta Phys. -Chim. Sin.
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中文
Current Issue
2014 Vol. 30,No. 8
Published: 18 July 2014
Current column
Table of Contents
REVIEW
Retracted
THERMODYNAMICS, KINETICS, AND STRUCTURAL CHEMISTRY
THEORETICAL AND COMPUTATIONAL CHEMISTRY
ELECTROCHEMISTRY AND NEW ENERGY
SOFT MATTER
CATALYSIS AND SURFACE SCIENCE
PHOTOCHEMISTRY AND RADIATION CHEMISTRY
BIOPHYSICAL CHEMISTRY
Table of Contents
Cover and Table of Contents for Vol.30 No. 8
2014, 30 (8): 0.
567
Abstract/Metrics
1111
PDF(11657KB)
REVIEW
Recent Research Progress in Alkaline Polymer Electrolyte Membranes for Alkaline Solid Fuel Cells
HOU Hong-Ying
Alkaline polymer electrolyte membrane fuel cell (APEMFC) has received much recent attention, primarily motivated by thei...
2014, 30 (8): 1393-1407.
DOI: 10.3866/PKU.WHXB201406171
2848
Abstract/Metrics
2744
PDF(2687KB)
Retracted
Development of a Home-Made Long Path Absorption Photometer for the Sensitive Detection of Nitrous Acid
CHEN Lin, HOU Si-Qi, WANG Wei-Gang, TONG Sheng-Rui, PEI Ke-Mei, GE Mao-Fa
This article has been retracted at the request of the authors.
2014, 30 (8): 1408-1415.
DOI: 10.3866/PKU.WHXB201406032
1936
Abstract/Metrics
1278
PDF(941KB)
THERMODYNAMICS, KINETICS, AND STRUCTURAL CHEMISTRY
Rotamers of
m
-Methylanisole Studied by Mass-Analyzed Threshold Ionization Spectroscopy
QIN Chen, TZENG Sheng-Yuan, ZHANG Bing, TZENG Wen-Bih
The S1←S0 electronic transition and threshold ionization of the cis and trans rotamers of m-methylanisole were inve...
2014, 30 (8): 1416-1425.
DOI: 10.3866/PKU.WHXB201405232
1677
Abstract/Metrics
982
PDF(721KB)
pVT
Properties of Alkanes Using Crossover VTSRK Equation of State
SHEN Ai-Jing, DUAN Yuan-Yuan, YANG Zhen
Accurate predictions of the pVT properties of alkanes are very important since they are associated with many fundamental...
2014, 30 (8): 1426-1431.
DOI: 10.3866/PKU.WHXB201405231
1622
Abstract/Metrics
1295
PDF(578KB)
THEORETICAL AND COMPUTATIONAL CHEMISTRY
Effects of
A
-Site Substitutions on Negative Thermal Expansion in PbTiO
3
fromFirst-Principles Calculations
WANG Fang-Fang, CAO Zhan-Min, CHEN Jun, XING Xian-Ran
Recent experimental results have indicated that the negative thermal expansion is a common phenomenon in PbTiO3-based ma...
2014, 30 (8): 1432-1436.
DOI: 10.3866/PKU.WHXB201405281
2246
Abstract/Metrics
1635
PDF(2265KB)
Stability and Raman Spectroscopy of Alkane Guest Molecules (C
n
H
m
,
n
≤6,
m
≤14) in 5
12
6
2
and 5
12
6
4
Water Cavities by Density Functional Theory Calculations
CAO Xiao-Xiao, SU Yan, ZHAO Ji-Jun, LIU Chang-Ling, ZHOU Pan-Wang
The gas composition in natural gas hydrate deposits is complex, and therefore the use of spectroscopic analysis to eluci...
2014, 30 (8): 1437-1446.
DOI: 10.3866/PKU.WHXB201405292
2148
Abstract/Metrics
1149
PDF(922KB)
Theoretical Studies on Low-Lying States of AuX (X=O, S)
LIANG Yan-Ni, WANG Fan
Multireference approaches have commonly been employed to calculate low-lying states of openshell molecules with spin-orb...
2014, 30 (8): 1447-1455.
DOI: 10.3866/PKU.WHXB201405302
1564
Abstract/Metrics
1136
PDF(616KB)
Selective Hydrogenation Mechanism of Cinnamaldehyde on Au(111) Surface
XIAO Xue-Chun, SHI Wei, NI Zhe-Ming
The adsorption behavior and selective hydrogenation reaction mechanisms (C=O addition, C=C addition, and 1,4-conjugate a...
2014, 30 (8): 1456-1464.
DOI: 10.3866/PKU.WHXB201406091
2181
Abstract/Metrics
1488
PDF(1074KB)
ELECTROCHEMISTRY AND NEW ENERGY
AMechanistic Study on Semiconductivity Conversion of Passive Films under Varying Sulfate to Chloride Concentration Ratios
XIA Da-Hai, YANG Li-Xia
Alloy 800 is an important steamgenerator material used in nuclear power plants, and so there is significant interest in ...
2014, 30 (8): 1465-1473.
DOI: 10.3866/PKU.WHXB201405211
2129
Abstract/Metrics
1369
PDF(3517KB)
One-Step Hydrothermal Preparation and Electrochemical Performance of Graphene/Sulfur Cathode Composites
LI Qing-Zhou, LI Yu-Hui, LI Ya-Juan, LIU You-Nian
Reduced graphene oxide/sulfur (RGO/S) composites were synthesized by a one-step hydrothermal method using a mixture of s...
2014, 30 (8): 1474-1480.
DOI: 10.3866/PKU.WHXB201406041
2174
Abstract/Metrics
2313
PDF(1093KB)
Synthesis of Nanostructured LiNi
1/3
Co
1/3
Mn
1/3
O
2
by Ammonia-Evaporation-Induced Synthesis and Its Electrochemical Properties as a Cathode Material for a High-Power Li-Ion Battery
HUA Wei-Bo, ZHENG Zhuo, LI Long-Yan, GUO Xiao-Dong, LIU Heng, SHEN Chong-Heng, WU Zhen-Guo, ZHONG Ben-He, HUANG Ling
We report on an ammonia-evaporation-induced synthetic method for nanostructured LiNi1/3Co1/3Mn1/3O2 cathode material. Po...
2014, 30 (8): 1481-1486.
DOI: 10.3866/PKU.WHXB201405303
2250
Abstract/Metrics
1500
PDF(936KB)
Influence of pH Values on the Structure and Performance of a Polypyrrole Counter Electrode for Dye-Sensitized Solar Cells
SU Jia, LU Shan, WANG Sha-Sha, ZHANG Xue-Hua, FU Yu-Bin, HE Tao
The pH of the solution used to produce an electro- polymerized polypyrrole (PPy) film has a significant impact on the mo...
2014, 30 (8): 1487-1494.
DOI: 10.3866/PKU.WHXB201405272
1902
Abstract/Metrics
1095
PDF(1072KB)
Preparation of a Highly Efficient PbS Electrode and Its Application in Quantum Dots-Sensitized Solar Cells
ZHANG Jing-Bo, LI Pan, YANG Hui, ZHAO Fei-Yan, TANG Guang-Shi, SUN Li-Na, LIN Yuan
To improve the light-to-electric conversion efficiency of quantum dots-sensitized nanocrystalline thin-film solar cells,...
2014, 30 (8): 1495-1500.
DOI: 10.3866/PKU.WHXB201405051
1952
Abstract/Metrics
1125
PDF(631KB)
SOFT MATTER
Self-Assembly of Vesicles from Oligoaramide Based on Multiple Hydrogen Bonds
HE You-Zhou, LIU Yun, LIU Peng, FENG Wen, YUAN Li-Hua
Six-hydrogen-bonded oligoaramide heteroduplexes demonstrate extremely high sequencespecificity and tunable stability dur...
2014, 30 (8): 1501-1508.
DOI: 10.3866/PKU.WHXB201406122
1879
Abstract/Metrics
1203
PDF(1564KB)
Characterization of a Homogeneously Mixed Octyltriethoxyilane/Octadecyltrichlorosilane Self-Assembled Monolayer and Analysis of Its Formation Mechanism
ZHU Zhi-Wen, XU Guo-Hua, ANYue, HE Chao-Hong
The wettability, surface topography, surface potential, and degree of order of a homogeneously mixed octyltriethoxysilan...
2014, 30 (8): 1509-1517.
DOI: 10.3866/PKU.WHXB201405282
1970
Abstract/Metrics
Supporting Info
1055
PDF(3321KB)
CATALYSIS AND SURFACE SCIENCE
Benzylation of Naphthalene over a Mesoporous ZSM-5 Zeolite Microsphere Catalyst
MIAO Hai-Xia, MA Li, MA Jing-Hong, LI Dui-Chun, LI Rui-Feng
A microspherical ZSM-5 zeolite aggregated from nanosized zeolite crystals with intra- and intercrystalline mesoporous st...
2014, 30 (8): 1518-1526.
DOI: 10.3866/PKU.WHXB201405271
1656
Abstract/Metrics
1120
PDF(1142KB)
Effect of Support on the Structural Evolution and Catalytic Performance of WO
3
-Supported Catalysts in the Synthesis of Adipic Acid
ZHANG Zhao-Yan, ZHU Quan-Jing, DING Jing, DAI Wei-Lin, ZONG Bao-Ning
A series of tungsten-based catalysts were synthesized via a traditional impregnation method using SBA-15, hexagonal meso...
2014, 30 (8): 1527-1534.
DOI: 10.3866/PKU.WHXB201406121
1780
Abstract/Metrics
1242
PDF(851KB)
Visible Light Photocatalytic Performance of Cu
2
O/TiO
2
Nanotube Heterojunction Composites Prepared by Pulse Deposition
ZHANG Jian-Fang, WANG Yan, SHEN Tian-Kuo, SHU Xia, CUI Jie-Wu, CHEN Zhong, WU Yu-Cheng
Highly ordered TiO2 nanotube arrays (TNAs) were fabricated by an electrochemical anodization process and Cu2O nanopartic...
2014, 30 (8): 1535-1542.
DOI: 10.3866/PKU.WHXB201405221
1835
Abstract/Metrics
1310
PDF(1607KB)
Microwave-Assisted Solvothermal Synthesis of In-Si Co-Modified TiO
2
Photocatalysts with Enhanced Photocatalytic Activity
TIAN Hong, WANG Hui-Xiang, SHI Wei-Mei, XU Yao
In-Si co-modified TiO2 photocatalysts were synthesized via a microwave-assisted solvothermal method. The obtained materi...
2014, 30 (8): 1543-1549.
DOI: 10.3866/PKU.WHXB201406161
1677
Abstract/Metrics
1021
PDF(742KB)
NO
x
Storage Reduction Performance of Coupled BaFeO
3-
x
+Cu-ZSM-5 Catalyst
Lü Jiao-Long, LI Feng-Li, LI Xin-Gang
A BaFeO3-x+Cu-ZSM-5 coupled catalyst was designed and synthesized to eliminate the NOx emitted from lean-burn exhausts, ...
2014, 30 (8): 1550-1558.
DOI: 10.3866/PKU.WHXB201406031
1614
Abstract/Metrics
981
PDF(841KB)
Effects of Two Different CeO
2
Materials on Lean NO
x
Trap Performance below 300 ℃
ZHU Jin-Xin, SHEN Mei-Qing, Lü Liang-Fang, WANG Jun, WANG Jian-Qiang
The present work investigated the effects of two types of CeO2 materials on the lean NOx trap (LNT) performance over NOx...
2014, 30 (8): 1559-1566.
DOI: 10.3866/PKU.WHXB201405283
1613
Abstract/Metrics
1183
PDF(818KB)
Effect of NO
2
on the Selective Catalytic Reduction of NO with NH
3
over Cu/SAPO-34 Molecular Sieve Catalyst
HAO Teng, WANG Jun, YU Tie, WANG Jian-Qiang, SHEN Mei-Qing
This study investigated the effects of NO2 on the selective catalytic reduction (SCR) of NO by NH3 over Cu/SAPO-34 catal...
2014, 30 (8): 1567-1574.
DOI: 10.3866/PKU.WHXB201405261
2038
Abstract/Metrics
1666
PDF(766KB)
PHOTOCHEMISTRY AND RADIATION CHEMISTRY
Study on the Photodissociation Mechanism of N
2
O
+
via
B
2
П
i
←
X
2
П
Transitions
WU Dan, ZHANG Li-Min, ZHOU Dan-Na
Photofragment (NO+ and N2+) excitation (PHOFEX) spectra of N2O+ via B2Пi←X2Π transitions was obtained over the w...
2014, 30 (8): 1575-1580.
DOI: 10.3866/PKU.WHXB201405202
1451
Abstract/Metrics
1164
PDF(710KB)
Crystal Structure and Radiation Stability of Sr(NO
3
)
2
·DCH18C6 Complex
ZHOU Han-Yang, YU Tian-Lin, AO Yin-Yong, PENG Jing, ZHAI Mao-Lin
Dicyclohexano-18-crown-6 ether (DCH18C6) is an efficient extractant for the removal of 90Sr from liquid radioactive wast...
2014, 30 (8): 1581-1586.
DOI: 10.3866/PKU.WHXB201406061
1805
Abstract/Metrics
905
PDF(746KB)
BIOPHYSICAL CHEMISTRY
Molecular Dynamics Simulations on the Binding of Fullerene to Amyloid-β Oligomers
ZHOU Xiao-Ying, XI Wen-Hui, WEI Guang-Hong
We investigated the binding process of fullerene to fibril-like Aβ42 oligomers by performing multiple molecular dyn...
2014, 30 (8): 1587-1596.
DOI: 10.3866/PKU.WHXB201405291
1738
Abstract/Metrics
1551
PDF(1559KB)