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Acta Phys. -Chim. Sin.
Acta Phys. -Chim. Sin.
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中文
Current Issue
2015 Vol. 31,No. 11
Published: 13 November 2015
Current column
Table of Contents
THERMODYNAMICS, KINETICS, AND STRUCTURAL CHEMISTRY
THEORETICALAND COMPUTATIONAL CHEMISTRY
ELECTROCHEMISTRY AND NEW ENERGY
SOFT MATTER
CATALYSIS AND SURFACE SCIENCE
PHOTOCHEMISTRY AND RADIATION CHEMISTRY
BIOPHYSICAL CHEMISTRY
PHYSICAL CHEMISTRY OF MATERIALS
Table of Contents
Cover and Table of Contents for Vol.31 No. 11
2015, 31 (11): 0.
923
Abstract/Metrics
1079
PDF(4155KB)
THERMODYNAMICS, KINETICS, AND STRUCTURAL CHEMISTRY
Simulation of Surface Plasmon Coupled Emission with Silver Film
Chen. CHEN,Dan-Feng. LU,Jin. CHENG,Zhi-Mei. QI
Surface plasmon coupled emission (SPCE) is a physical process opposite to conventional surface plasmon resonance (SPR) w...
2015, 31 (11): 2023-2028.
DOI: 10.3866/PKU.WHXB201509182
3121
Abstract/Metrics
497
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1386
PDF(3011KB)
Laser-Induced Fluorescence Spectra of the Photolyzed Products of C
2
H
5
SSC
2
H
5
by 266 nm Laser
Hai-Yan. HAO,Zhen. LIU,Li-Li. ZU
Organic sulfides are an atmospheric pollutant that photolyze in the atmosphere, causing additional pollution. The S―S bo...
2015, 31 (11): 2029-2035.
DOI: 10.3866/PKU.WHXB201509231
3384
Abstract/Metrics
8
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Supporting Info
1185
PDF(2998KB)
Study on Thermodynamic Properties of Ionic Liquid 1-Ethyl-3-methylimidazolium Alanine
Ling. ZHENG,Ben-Han. FAN,Xiao-Xue. BU,Yi. PAN,Jia-Xin. DONG,Wei. GUAN
We synthesized the alanine-based ionic liquid [C2mim][Ala] (1-ethyl-3-methylimidazolium alanine) by using the neutraliza...
2015, 31 (11): 2036-2042.
DOI: 10.3866/PKU.WHXB201509111
3019
Abstract/Metrics
4
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Supporting Info
1236
PDF(982KB)
Determination of Iron Liposome/Water Partition Coefficients and Identification of Influencing Factors
Ni-Na. LI,Li-Na. GENG,Lin. WANG,Lin-Lin. YUAN,Yan-Zhong. CHANG,Jian-Jun. ZHANG
Ferric citrate liposomes (FAC-Lip) and heme liposomes (Heme-Lip) were successfully prepared by a rotary-evaporated film-...
2015, 31 (11): 2043-2048.
DOI: 10.3866/PKU.WHXB201509141
2854
Abstract/Metrics
3
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1226
PDF(971KB)
Crystal Structure and Thermal Decomposition Kinetics of Byproduct of Synthesis of RDX: 3, 5-Dinitro-1-oxygen-3, 5-diazacyclohexane
Jing. LI,Li-Zhen. CHEN,Jian-Long. WANG,Guan-Chao. LAN,Huan. HOU,Man. LI
A new cyclic byproduct was formed during hexahydro-1, 3, 5-trinitro-1, 3, 5-triazine (RDX) preparation by direct nitrati...
2015, 31 (11): 2049-2056.
DOI: 10.3866/PKU.WHXB201510092
4162
Abstract/Metrics
7
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1310
PDF(1896KB)
THEORETICALAND COMPUTATIONAL CHEMISTRY
Rényi Entropy, Tsallis Entropy and Onicescu Information Energy in Density Functional Reactivity Theory
Shu-Bin. LIU,Chun-Ying. RONG,Ze-Min. WU,Tian. LU
Density functional theory dictates that the electron density determines everything in a molecular system's ground state,...
2015, 31 (11): 2057-2063.
DOI: 10.3866/PKU.WHXB201509183
4765
Abstract/Metrics
10
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1673
PDF(446KB)
Computation of Electron Affinities with the Second Order Multireference Perturbation Theory
Zhi-Hui. FAN,Fei-Wu. CHEN
Electron affinities of F, Cl, OH, SH, CN, CH2, and NH2 have been computed with the second order multireference perturbat...
2015, 31 (11): 2064-2076.
DOI: 10.3866/PKU.WHXB201508201
3226
Abstract/Metrics
6
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916
PDF(390KB)
Application of the Multi-Center Partition Method to Construct the Potential Energy Surface of H
3
Wei. DAI,Liu-Yang. CHEN,Li-Min. ZHENG,Ming-Hui. YANG
The potential energy surface plays an important role in studying molecular reaction dynamics. In this work, a new method...
2015, 31 (11): 2077-2082.
DOI: 10.3866/PKU.WHXB201509143
2572
Abstract/Metrics
6
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1079
PDF(1683KB)
First-Principles Calculations of Electronic Properties of Defective Armchair MoS
2
Nanoribbons
Yan. SHAO,Fang-Ping. OUYANG,Sheng-Lin. PENG,Qi. LIU,Zhi-An. JIA,Hui. ZOU
We investigated the electronic properties of armchair MoS2 nanoribbons with vacancy defects using a first-principles met...
2015, 31 (11): 2083-2090.
DOI: 10.3866/PKU.WHXB201510132
3137
Abstract/Metrics
10
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1517
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Molecular Dynamics Simulation of Pd Clusters Deposited on Pd/Ag Substrates
Kun. WANG,Juan-Fang. LIU,Qing-Hua. CHEN
Using molecular dynamics simulations, we investigated the microscopic processes of large palladium clusters deposited on...
2015, 31 (11): 2091-2098.
DOI: 10.3866/PKU.WHXB201509153
2414
Abstract/Metrics
8
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1238
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ELECTROCHEMISTRY AND NEW ENERGY
Preparation of Cross-Linked Porous Carbon Nanofiber Networks by Electrospinning Method and Their Electrochemical Capacitive Behaviors
Jian-Jian. LU,Zong-Rong. YING,Xin-Dong. LIU,Shuang-Sheng. ZHAO
Cross-linked porous carbon nanofiber networks were successfully prepared by electrospinning followed by preoxidation and...
2015, 31 (11): 2099-2108.
DOI: 10.3866/PKU.WHXB201510081
4664
Abstract/Metrics
17
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2100
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Photoelectrochemical Properties of Hierarchical ZnO Nanosheets Micro-
N
anostructure Modified with Sb
2
S
3
Nanoparticles
Yan-Zhong. HAO,Zhi-Min. GUO,Bao. SUN,Juan. PEI,Shang-Xin. WANG,Ying-Pin. LI
We fabricated highly ordered ZnO nanosheet arrays on ITO substrates by adding KCl and ethylenediamine(EDA) through poten...
2015, 31 (11): 2109-2116.
DOI: 10.3866/PKU.WHXB201509151
3057
Abstract/Metrics
6
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1351
PDF(9593KB)
One-Step Synthesis of Reduced Graphene Oxide supported Pt Nanoparticles and Its Electrocatalytic Activity for Methanol Oxidation
Hai-Li. GAO,Xiao-Long. LI,Wei. HE,Rui-Ting. GUO,Bo. CHAI
In this study, graphite oxide was prepared from natural graphite powder using a modified Hummers method. Well-dispersed ...
2015, 31 (11): 2117-2123.
DOI: 10.3866/PKU.WHXB201509181
3450
Abstract/Metrics
16
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1725
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SOFT MATTER
Effect of TBAB/KCl on Constructing Anionic Wormlike Micelles
Yi-Xiu. HAN,Hong. ZHOU,Yong-Qiang. WEI,Yong-Jun. MEI,Hang. WANG
Using rheological measurements, we investigated the wormlike micelles formed by anionic surfactants, sodium oleate (NaOA...
2015, 31 (11): 2124-2130.
DOI: 10.3866/PKU.WHXB201509112
2608
Abstract/Metrics
10
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1167
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CATALYSIS AND SURFACE SCIENCE
Preparation and Application of Pt-
N
i Catalysts supported on Cobalt-Polypyrrole-Carbon for Fuel Cells
Mei-Ni. YANG,Rui. LIN,Ren-Jie. FAN,Tian-Tian. ZHAO,Hao. ZENG
By using pulse-microwave assisted chemical reduction, we prepared a Pt-Ni alloy supported on a cobalt-polypyrrole-carbon...
2015, 31 (11): 2131-2138.
DOI: 10.3866/PKU.WHXB201509171
3315
Abstract/Metrics
9
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1630
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ZSM-5 Zeolite with Micro-Mesoporous Structures Synthesized Using Different Templates for Methanol to Propylene Reaction
Lan-Lan. ZHANG,Yu. SONG,Guo-Dong. LI,Shao-Long. ZHANG,Yun-Shan. SHANG,Yan-Jun. GONG
ZSM-5 zeolites with different pore structures were synthesized using different templates (tetrapropyl ammonium hydroxide...
2015, 31 (11): 2139-2150.
DOI: 10.3866/PKU.WHXB201509281
3815
Abstract/Metrics
6
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1641
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Growth, Electronic Structure and Thermal Stability of Ni on ZrO
2
(111) Thin Film Surfaces
Yong. HAN,Qian. XU,Huan-Xin. JU,Jun-Fa. ZHU
The growth mode, electronic structure, and thermal stability of Ni nanoparticles on thin ZrO2(111) film surfaces were in...
2015, 31 (11): 2151-2157.
DOI: 10.3866/PKU.WHXB201510083
2764
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7
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1546
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Improvement of Adsorptive Separation Performance for C
2
H
4
/C
2
H
6
Mixture by CeO
2
Promoted CuCl/Activated Carbon Adsorbents
Jian-Dong. XING,Fang-Li. JING,Wei. CHU,Hong-Li. SUN,Lei. YU,Huan. ZHANG,Shi-Zhong. LUO
CeO2 promoted CuCl/activated carbon (AC) adsorbents were prepared using an incipient wetness impregnation method, and ch...
2015, 31 (11): 2158-2164.
DOI: 10.3866/PKU.WHXB201510091
2716
Abstract/Metrics
8
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1597
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Cu-SSZ-13 Catalyst Synthesized under Microwave Irradiation and Its Performance in Catalytic Removal of NO
x
from Vehicle Exhaust
Hua-Feng. YU,Guo-Pei. ZHANG,Li-Na. HAN,Li-Ping. CHANG,Wei-Ren. BAO,Jian-Cheng. WANG
Cu-SSZ-13 catalysts had been prepared by using a microwave irradiation (MW) method and a conventional hydrothermal (CH) ...
2015, 31 (11): 2165-2173.
DOI: 10.3866/PKU.WHXB201509184
3047
Abstract/Metrics
8
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1863
PDF(1597KB)
PHOTOCHEMISTRY AND RADIATION CHEMISTRY
Photoelectric Properties of Novel Amide-Functionalized Ir(III) Complexes
Wei. SHEN,Wen-Wen. TIAN,Zheng-Jian. QI,Yue-Ming. SUN
A series of luminescent cyclometalated Ir(III) complexes functionalized with amide derivatives were prepared and compare...
2015, 31 (11): 2174-2182.
DOI: 10.3866/PKU.WHXB201510084
2642
Abstract/Metrics
6
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Supporting Info
1122
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Strong Single-Band Down-Conversion Emission in Tm
3+
-Doped NaYF
4
Microparticles
Chun-Long. XU,Jin-Guo. WANG,Xiang-Yu. ZHANG
We synthesized Tm3+-doped NaYF4 microcrystals with various length-to-diameter ratios by using a facile hydrothermal meth...
2015, 31 (11): 2183-2190.
DOI: 10.3866/PKU.WHXB201509142
3040
Abstract/Metrics
9
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1641
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BIOPHYSICAL CHEMISTRY
Accurate Activity Predictions of B-Raf Type II Inhibitors
via
Molecular Docking and QSAR Methods
Hai-Chun. LIU,Shuai. LU,Ting. RAN,Yan-Min. ZHANG,Jin-Xing. XU,Xiao. XIONG,An-Yang. XU,Tao. LU,Ya-Dong. CHEN
B-Raf kinase plays an important role in the mitogen-activated protein kinase (MAPK) signaling transmission pathway and h...
2015, 31 (11): 2191-2206.
DOI: 10.3866/PKU.WHXB201510134
3408
Abstract/Metrics
41
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2197
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PHYSICAL CHEMISTRY OF MATERIALS
Finely Controlling the Diameter of the TiO
2
Nanowire Array by Micelles in the Reversed Micelle Reaction under Hydrothermal Condition
Jie. YANG,Yu-He. LI,Hai-Long. HU
We establish a model for growing titania nanowires arrays (TNAs) within micelles on the hydrophilic substrate of fluorin...
2015, 31 (11): 2207-2212.
DOI: 10.3866/PKU.WHXB201509152
2740
Abstract/Metrics
2
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1129
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Preparation and Optimization of Vertically Arrayed Zinc Oxide Nanorods
Juan. MA,Feng-Dan. SONG,Ze-Qi. ZHOU,Sui-Tao. QI,Chun-Hai. YI,Bo-Lun. YANG
A two-step method for growing vertical zinc oxide nanorod arrays on indium tin oxide (ITO)-coated glass substrates is pr...
2015, 31 (11): 2213-2219.
DOI: 10.3866/PKU.WHXB201509301
2748
Abstract/Metrics
5
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1139
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Preparation and Supercapacitor Properties of Carbon-Coated SnO
2
Hollow Fibers
Xiao-Mei. HAN,Yan-Bo. WU,Heng-Yan. ZHAO,Jun. BI,Bin-Bin. WEI
A new carbon-coated SnO2 hollow fiber was successfully prepared by coaxial electrospinning, and its supercapacitor prope...
2015, 31 (11): 2220-2228.
DOI: 10.3866/PKU.WHXB201510131
3389
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7
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1953
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