Acta Phys. -Chim. Sin.
Acta Phys. -Chim. Sin.
2008 Vol. 24,No. 11
Published: 10 November 2008
Table of Contents
Table of Contents
Table of Contents for Vol.24 No.11
2008, 24 (11): 0.
Enhanced Raman Scattering by Polystyrene Microspheres and Application for Detecting Molecules Adsorbed on Au Single Crystal Surface
LIN Xiu-Mei, WANG Xiang, LIU Zheng, REN Bin
By assembling polystyrene microsphores on a sample surface, the surface Raman signal could be enhanced. The dependence o...
2008, 24 (11): 1941-1944.
Synthesis, Structure and Thermal Property of [(
LIU Guo-Qi, LI Guo-Bao, LIAO Fu-Hui, LIN Jian-Hua
A new compound dicetyltrimethylammonium hexafluorotitanium dihydrate, [(n-C16H33)N(CH3)3]2[TiF6]·2H2O (compound 1...
2008, 24 (11): 1945-1949.
Application of Triphenylamine-Based Sensitizers with Two Carboxylic Acid Groups to Dye-Sensitized Solar Cells
PEI Juan, LIANG Mao, CHEN Jun, TAO Zhan-Liang, XU Wei
Two triphenylamine-based dyes (TPAR3 and TPAR6) containing two carboxylic acid groups with different conjugated lengths ...
2008, 24 (11): 1950-1956.
Mechanism of Formation and Consequent Evolution of Active Cellulose during Cellulose Pyrolysis
LIU Qian, WANG Shu-Rong, WANG Kai-Ge, GUO Xiu-Juan, LUO Zhong-Yang, CEN Ke-Fa
An intermediate product that was yellow, soluble, and solid was obtained in a high-radiation flash pyrolysis reactor. Un...
2008, 24 (11): 1957-1963.
Hydrogen Diffusion Behavior in Perfect
WEI Hong-Yuan; LUO Shun-Zhong; LIU Guo-Ping; XIONG Xiao-Ling; SONG Hong-Tao
The diffusion behavior of hydrogen atomin perfect δ-Pu metal was studied with density functional theory (DFT) and period...
2008, 24 (11): 1964-1968.
Electrical and Optical Properties of MWNTs/HDPE Composites in THz Region
CHEN Xi-Liang; MA Ming-Wang; YANG Xiao-Min; YANG Kang; JI Te; WU Sheng-Wei; ZHU Zhi-Yong
Conductive composites were prepared by filling high density polyethylene (HDPE) with various amounts of multi-walled car...
2008, 24 (11): 1969-1974.
Effect of Composite Modes on Photoelectrochemical Properties of MWCNTs/TiO
ZHANG Wei; CUI Xiao-Li; JIANG Zhi-Yu
A series of nanocomposite of TiO2 thin films and multi-walled carbon nanotubes (MWCNTs) in different forms were prepared...
2008, 24 (11): 1975-1980.
Probing Non-Covalent Complexes of Glutathione with D-Amino Acids by Mass Spectrometry
CHU Yan-Qiu; PAN Ting-Ting; DAI Zhao-Yun; YU Zhuo-Wei; ZHENG Song-Bai; DING Chuan-Fan
To investigate the non-covalent interaction between glutathione and D-amino acids, stoichiometric reduced glutathione (G...
2008, 24 (11): 1981-1987.
Ta/BDD Film Electrode for Electrochemical Oxidation Nitrophenol
GAO Cheng-Yao; CHANG Ming
The physical and electrochemical behaviors of the tantalum substrate born-doped diamond (Ta/BDD)electrode prepared by ho...
2008, 24 (11): 1988-1994.
Adsorption and Dissociation of N
Molecule on UO(100) Surface
ZHENG Jin-De; LU Chun-Hai; SUN Bao-Zhen; CHEN Wen-Kai
The adsorption of N2 molecule on the UO(100) surface was studied with periodic slab model by VWN-BP approach of GGA with...
2008, 24 (11): 1995-1999.
Blue- and Red-Shifted Hydrogen Bonds between HNO and (HF)
NI Jie; LI An-Yong; YAN Xiu-Hua
Quantum chemistry ab initio methods were applied to study the blue-and red-shifted H-bonds between HNO and (HF)1≤n≤shift...
2008, 24 (11): 2000-2006.
Oxidation and Thermodynamic Properties of Ag-Sn Alloy
FENG Jing; CHEN Jing-Chao; XIAO Bing; DU Ye-Ping; WANG Sheng-Hao; ZHANG Li-Juan
Diffused and reactive O atom in process of internal oxidation in Ag-Sn-O system was calculated by density functional per...
2008, 24 (11): 2007-2012.
Adsorption of Methanol on the Pt-Mo(111)/C Surface
LI Lai-Cai; WANG Yi-Wei; TIAN An-Min
The density functional theory (DFT) and self-consistent periodic calculation were used to investigate the methanol adsor...
2008, 24 (11): 2013-2018.
Characterization of Visible Light Response N-F Codoped TiO
Photocatalyst Prepared by Acid Catalyzed Hydrolysis
LI Xiao-Hui, LIU Shou-Xin
N-FcodopedTiO2 (TONF) photocatalystswere prepared usingacidcatalyzed hydrolysismethod frommixed aqueous solution of TiCl...
2008, 24 (11): 2019-2024.
A Density Functional Theory Study of Formaldehyde Adsorption on CeO2(111) Surface
JIANG Shi-Yu; TENG Bo-Tao; LU Ji-Qing; LIU Xue-Song; YANG Pei-Fang; YANG Fei-Yong; LUO Meng-Fei
Formaldehyde adsorption on CeO2(111) surface terminated by bridge O atom was systematically investigated by periodic den...
2008, 24 (11): 2025-2031.
Electrodeposition Behaviors of Pure Cobalt in Ionic Liquid
YANG Pei-Xia; AN Mao-Zhong; SU Cai-Na; WANG Fu-Ping
The electrodeposition of metallic Co from a 1-ethyl-3-methylimidazolium chloride (EMIC) ionic liquid containing ethylene...
2008, 24 (11): 2032-2036.
Preparation of Surface-Modified Hollow LaF
Nanoparticles and Their Tribological Performances
MA Xue-Hui; ZHAO Yan-Bao; WU Zhi-Shen
Surface-modified hollow LaF3 nanoparticles were prepared in an oleate/cetyltrimethylammoniumbromide micellar emulsion. T...
2008, 24 (11): 2037-2041.
Molecular Dynamics Simulation on Melting of Metal Cluster with Small Size
CHEN Ying; WANG Xiu-Ying; ZHAO Jun-Qing
The melting processes of little size metal clusters were simulated by molecular dynamics method. The atomic interaction ...
2008, 24 (11): 2042-2046.
Molecular Dynamics Simulation of Structure and Dynamics Properties of Water Near an Au Nanoparticle
YANG Zhen; YANG Xiao-Ning; XU Zhi-Jun
Classical molecular dynamics simulations were employed to investigate the structural and dynamical properties of water n...
2008, 24 (11): 2047-2052.
Reaction Mechanisms of HCHO+X(X=F, Cl, Br)
LI Xiao-Yan; ZENG Yan-Li; MENG Ling-Peng; ZHENG Shi-Jun
The reactions of HCHO+X (X=F, Cl, Br) were studied at CCSD/6-311++G(d,p)//B3LYP/6-311++G (d,p) level. The computational ...
2008, 24 (11): 2053-2058.
Mechanism of the Copper-Catalyzed Water Gas Shift Reaction
MAO Jiang-Hong; NI Zhe-Ming; PAN Guo-Xiang; XU Qian
A detailed density functional theory (DFT) investigation revealed three possible micro-mechanisms of the water-gas shift...
2008, 24 (11): 2059-2064.
Hydrogen-Bonded Complex between Ozone and Thioperoxy Radical in Gas-Phase
YUAN Kun; LIU Yan-Zhi; ZHU Yuan-Cheng; ZHANG Ji
B3LYP/6-311++G** and MP2/6-311++G** calculations were used to analyze the interaction between thioperoxy radical (HSO) a...
2008, 24 (11): 2065-2070.
Photocatalytic Properties of Composite of SiO
S Solid Solutions
HU Yuan-Fang; LI Yue-Xiang; PENG Shao-Qin; LV Gong-Xuan; LI Shu-Ben
Cd0.53Zn0.47S was prepared by a coprecipitation method. Pt was loaded onto Cd0.53Zn0.47S by photodeposition method. SiO2...
2008, 24 (11): 2071-2076.
Structure and Interaction of Ion-Pairs of [EPy]Cl and [EPy]Br in Gas and Liquid Phases
WANG Xiao-Lu; WAN Hui; GUAN Guo-Feng
The structures of ionic liquids N-ethyl-pyridinium chloride ([EPy]Cl) and N-ethyl-pyridinium bromide ([EPy]Br) were stud...
2008, 24 (11): 2077-2082.
C—S Activation of CS
in Gas Phase
GAO Li-Guo; SONG Xiao-Li; CHEN Xiao-Xia; WANG Yong-Cheng
The reaction of Y+ with CS2, which was selected as the representative system of the reactions of second-row transition m...
2008, 24 (11): 2083-2088.
Synthesis and Micellization of Photosensitive Amphiphilic Comblike SMA Polymer
JIANG Jin-Qiang; FENG Yan; WANG Hong-Mei; LIU Xiao-Ya; ZHANG Sheng-Wen; CHEN Ming-Qing
Coumarin-containing styrene monomer (CS) was designed and synthesized, which could be used together with styrene (St) an...
2008, 24 (11): 2089-2095.
Electron Structure and Energy Transformation Mechanism of the Surface of Porous Nanocrystalline TiO
Doped with La
LI Kui-Ying; GUO Jing; LIU Tong; ZHOU Bing-Jing; LI Yue
The porous nanocrystalline TiO2 doped with La was synthesized by sol-gel method. The combination of the photoacoustic (P...
2008, 24 (11): 2096-2101.
Catalytic Cracking of C
Hydrocarbons on ZSM-5 Molecular Sieves with Low SiO
WANG Wen-Lan; LIU Bai-Jun; ZENG Xian-Jun
The catalytic cracking of C4 hydrocarbons was investigated using ZSM-5 with low SiO2/Al2O3 molar ratio (n(SiO2)/n(Al2O3)...
2008, 24 (11): 2102-2107.
Catalytic Combustion of Methane over CeO
) Solid Solution Promoted Pd/
XIAO Li-Hua, SUN Kun-Peng, XU Xian-Lun
Solid solution CeO2-MOx (M=La3+, Ca2+) promoted Pd/γ-Al2O3 catalysts were prepared by a deposition-precipitation m...
2008, 24 (11): 2108-2113.
Coordination Structure between Modified PAN Fiber and Fe(III) Ion and Its Catalytic Function on Degradation of Azo Dyes
DONG Yong-Chun; DU Fang; HAN Zhen-Bang
The coordination process and structure between amidoxime modified polyacrylonitrile (AO-PAN) fiber and FeCl3 in aqueous ...
2008, 24 (11): 2114-2121.
Frequency Response of SWCNT Field-Effect Transistors with MWCNT Interconnects
ZHU Yu-Zhen; WANG Sheng; WEI Xian-Long; DING Li; ZHANG Zhi-Yong; LIANG Xue-Lei; CHEN Qing; PENG Lian-Mao
Single-walled carbon nanotube field-effect transistors (SWCNT FETs) with multi-walled carbon nanotubes (MWCNTs) as inter...
2008, 24 (11): 2122-2127.
A Random Walk Model for Molecular Anisotropic Diffusion in Siliceous
YANG Xiao-Feng; QIN Zhang-Feng; WANG Jian-Guo
A model of molecules diffusion in β-zeolite was proposed by assuming that the movement of molecules was a random walk on...
2008, 24 (11): 2128-2132.
Effect of Anions on the Electrochemical Formation of TiO
Nanotube Arrays in a Glycerol Based Electrolyte
YIN Yu-Xin; JIN Zheng-Guo; TAN Xin; HOU Feng; ZHAO Lin
The formation of titania nanotubes was achieved by electrochemical anodization in glycerol based electrolytes. We invest...
2008, 24 (11): 2133-2138.
Electrocatalytic Reduction of Maleic Acid at Bundles of TiO
ZHAO Feng-Ming; SHEN Hai-Ping; CHEN Zhao-Yang; MA Chun-An
Anodic oxidation is a novel and simple method to fabricate TiO2 film with particular morphologies in a mixture of 0.5 mo...
2008, 24 (11): 2139-2142.
Phase Behavior of Tween80/BmimPF
ZHENG Yong-Jun; ELI Wumanjiang
To investigate the influence of different alcohols on the isotropic microemulsion zone of a 1-butyl-3-methylimidazolium ...
2008, 24 (11): 2143-2148.