1998 Volume 14 Issue 4

Solvation Interaction and Stability of Modified Superoxide Dismutase
Li Wen-Zhong , Miao Fang-Ming
1998, 14(04): 289-292  doi: 10.3866/PKU.WHXB19980401
[Abstract](3707) [FullText HTML] [PDF 645KB](2073)
Abstract:

The stability of Copper, Zinc superoxide dismutase increases remarkably when the lysines on the surface of the enzyme are modified. The fmite difference solution to the Poisson-Boltzman equation (FDPB) method is used to calculate the electrostatic in...

AFM Studies of HTDIOO Monomolecular Layer LB Films
Tian Fang , Wang Chen , Bai Chun-Li , Xu Yu
1998, 14(04): 293-298  doi: 10.3866/PKU.WHXB19980402
[Abstract](3236) [FullText HTML] [PDF 1889KB](2147)
Abstract:

The structures of HTDIOO molecular monolayer and multilayer LB films have been observed by atomic force microscopy (AFM) in molecular and nanometer scales. It demonstrates that large AFM probe tip force could damage the structure of HTDIOO LB films. ...

Ab initio Calculations of 1,2-Bidentate Thiolato Complexes of Fe,Co and Ni
Zheng Kang-cheng , Rao Huo-Feng , He Feng , Xu Zhi-Tao , Liu Han-Qin
1998, 14(04): 299-304  doi: 10.3866/PKU.WHXB19980403
[Abstract](3653) [FullText HTML] [PDF 971KB](2216)
Abstract:

The ab initio calculations of the transition metal 1,2-bidentate thiolato complexes Co(mpo)3、Fe(mpo)3 and Ni(mpo)2 have been performed using the G94W software at Hartree-Fock level and LanL2DZ basis set, which is a double-zeta basis set containing ef...

Organic Electroluminescent Devices Using Rare Earth Complex Eu(DBM)3 as an Emitter
Li Bin , Ma Dong-Ge , Zhang Hong-Jie , Zhao Xiao-Jiang , Ni Jia-Zuan
1998, 14(04): 305-308  doi: 10.3866/PKU.WHXB19980404
[Abstract](3505) [FullText HTML] [PDF 685KB](2313)
Abstract:

Eu3+ narrow band emitting EL device with PPV, Alq3 as hole and electron transportation layers has been prepared. The emitting layer, which consists of PVK, Eu(DBM)3 and PBD is f0rmed by spin-casting method. A maximum luminance of 52cd•m-2 is achieved...

Charge Transport Properties of TiO2 Nanocrystalline/Nanoporous Film
Hao Yan-Zhong , Yang Mai-Zhi , Yu Chi-Zhen , Cai Sheng-Min
1998, 14(04): 309-314  doi: 10.3866/PKU.WHXB19980405
[Abstract](3803) [FullText HTML] [PDF 1316KB](2159)
Abstract:

Charge transport properties of TiO2 nanoporous film were investigated by electrochemical and photoelectrochemical methods. The results show that charge transports in nanoporous film are different from that in conventional bulk semiconductors. The ele...

Studies on Photoelectrochemical Behaviors of Nanocrystalline TiO2 Films
Luo Jin , Su Lian-Yong , Xie Lei , Zhou Jing , Zu Yan-Bing , Lin Zhong-Hua
1998, 14(04): 315-319  doi: 10.3866/PKU.WHXB19980406
[Abstract](3870) [FullText HTML] [PDF 1233KB](2243)
Abstract:

The photoelectrochemical behaviors and mechanisms of the nanocrystalline TiO2 films prepared using different preparation methods were studied .The results showed were studied . The results showd that the photoelectrochemical behaviors of nanocrystall...

Structure of Highly Siliceous ZSM-5 Zeolites and Ti-ZSM-5 Zeolites Obtained by Indirect Synthesis
Zhao Qi , Han Xiu-Wen , Liu Xiu-Mei , Liu Xian-Chun , Zhai Run-Sheng , Bao Xin-He , Lin Li-Wu , Guo Xin-Wen , Zhang Fa-Zhi , Wang Xiang-Sheng
1998, 14(04): 320-326  doi: 10.3866/PKU.WHXB19980407
[Abstract](4231) [FullText HTML] [PDF 1110KB](2315)
Abstract:

Solid state NMR with magic angle spinning (MAS) and cross polarization(CP) techniques, and IR spectroscopy have been used to investigate the structural Characterizations of the highly siliceous ZSM-5(S-1) zeolites synthesized using various organic am...

Vibrational Energy Transfer from Highly Excited State CO to C2H2
Wang Bao-Shan , Guo Jing-Zhong , Gu Yue-Shu , Mao Wen-Tao , Kong Fan-Ao
1998, 14(04): 327-331  doi: 10.3866/PKU.WHXB19980408
[Abstract](3446) [FullText HTML] [PDF 792KB](2322)
Abstract:

The energy transfer process of highly vibrational states of CO with C2H2 has been studied by the Time -resolved Fourier Transform Infrared Emission Spectroscopy. The vibrational population of CO(v=1-3)were obtained by the simulations of the IR emissi...

A Theoretical Study on the Cycloaddition Reaction of Silylene and Ethylene
Lu Xiu-Hui , Wang Yi-Xuan , Deng Cong-Hao
1998, 14(04): 332-336  doi: 10.3866/PKU.WHXB19980409
[Abstract](3429) [FullText HTML] [PDF 720KB](2205)
Abstract:

The cycloaddition reaction of silylene(SiH2, A) and ethylene has been studied by using ab initio calculations, a reasonable mechanism of the reaction has been suggested. The thermodynamic and kinetic properties of the reaction have been calculated by...

Simulation to the Structure Sensitive of Cu Based catalyst for Methanol Synthesis
Wang Gui-Chang , Sun Yu-Han , Zhong Bing
1998, 14(04): 337-342  doi: 10.3866/PKU.WHXB19980410
[Abstract](3963) [FullText HTML] [PDF 871KB](2369)
Abstract:

The microkinetic data of methanol synthesis from CO2 and H2 catalyzed by Cu(111) and Cu(110) have been calculated by means of BOC-MP empirical method, and its formate mechanism has been simulated by Monte Carlo method. It was found that the activatio...

Study of Thermochemical Properties of Cu(II)-α,α'-bipyridyl-macrocyclic Dioxotetraamine Ternary Systems
Zhou Zhi-Fen , Lin Hua-Kuan , Li Su-Qi , Zhu Shou-Rong , Chen Rong-Ti
1998, 14(04): 343-348  doi: 10.3866/PKU.WHXB19980411
[Abstract](3215) [FullText HTML] [PDF 862KB](2607)
Abstract:

Thermal effects of coordination reaction of Cu(Ⅱ )-α,α'-bipyridyl-macrocyclic dioxotetraaming ternary complex compounds have been determined in aqueous solution at 25.0±0.1℃ and I=0.1 mol•dm-3 KNO3 by means of model RD-1 automatic conduction calorime...

Mechanism of the Isomerization of Difluorosilacyclopropene
Hu Hai-Quan , Liu Cheng-Bu
1998, 14(04): 349-352  doi: 10.3866/PKU.WHXB19980412
[Abstract](3066) [FullText HTML] [PDF 515KB](2141)
Abstract:

The isomerization of singlet difluorosilacyclopropene has been studied by using ab initio method with 6-31G(d) basis set. The transition state with a 3-member cycle of this reaction has been obtained, and the intrinsic reaction coordinate (IRC) calcu...

Relationship between Cell Metabolism and Content of Oxygen as Studied by High Resolution 1H NMR Using A Model Sample
Huang He , Mao Xi-An , Ye Chao-Hui , Xie Ze-Ping , Deng Kai , Pan Hua
1998, 14(04): 353-357  doi: 10.3866/PKU.WHXB19980413
[Abstract](3162) [FullText HTML] [PDF 861KB](2257)
Abstract:

High resolution H NMR, was applied to investigation of the relationship between cell metabolism and the content of oxygen using a model sample contaming yeast and blood. Signals from the metabolism have been observed, and the dependence of metabolism...

Measurement of Dispersion Capacity of MoO3 on Low Specific Surface Support α-Al2O3
Zhang Bin , Wu Nian-Zu , Xie You-Chang , Tang You-Qi
1998, 14(04): 358-360  doi: 10.3866/PKU.WHXB19980414
[Abstract](3275) [FullText HTML] [PDF 499KB](2152)
Abstract:

Dispersion of MoO3 on low specific surface area support α-Al2O3 was studied withBET, SEM, XPS, XRD and LRS. The dispersion capacity of MoO3 on α-Al2O3 obtained by XPS and XRD are 0.15gMoO3/100m2 α-Al2O3 surface for α-Al2O3 obtained by calcinating γ-A...

Effect of Catalyst Fabrication Method on the Performance of Oxygen Electrode in PEMFC
Si Yong-Chao , Han Zuo-Qing , Chen Yan-Xi
1998, 14(04): 361-364  doi: 10.3866/PKU.WHXB19980415
[Abstract](3655) [FullText HTML] [PDF 864KB](2371)
Abstract:

The effects of two catalyst fabrication techniques, impregnation method and colloidal method, on the performance of the oxygen electrode are studied and the difference in the catalytic activity of the two kinds of catalysts towards oxygen reduction a...

Study on the Protection Film of AMT Formed on Bronze by Scanning Tunneling Microsecopy
Li Ying , Cao Chu-Nan , Lin Hai-Chao , Zhu Yi-Fan , Li Da-Gang , Shi Bing-Bing , Wan Li , Xu Fei , Tao bao-Cheng
1998, 14(04): 365-368  doi: 10.3866/PKU.WHXB19980416
[Abstract](3340) [FullText HTML] [PDF 986KB](2139)
Abstract:

The morphology of the protection film of AMT formed on bronze has been observed by scanning tunneling microscopy in angstrom scale. Three to five ellipse units join together to forma linear structure. Many such linear structures make up the protectio...

Problems in Measurement of Organic Molecular β by the Solvatochromism
Zhu Pei-Wang , Wang Chuan-Guang , Wang Peng , Ye Cheng
1998, 14(04): 369-374  doi: 10.3866/PKU.WHXB19980417
[Abstract](6661) [FullText HTML] [PDF 989KB](2125)
Abstract:

In This paper some problems, which should be noticed in the measurements of organic molecular first hyperpolarizability(β) by the solvatochromism , are discussed based on the results of the measurements for 11 compounds .The experiments indicate the ...

Mutual Coupling of Surface Electromagnetic Wave Between Silver Particles: Studies on the Mechanism of the Surface Enhanced Infrared Spectroscopy
Zhang Jin , Zhao Jiang , He Hui-Xin , Zhang Hao-Li , Li Hu-Lin , Liu Zhong-Fan
1998, 14(04): 375-379  doi: 10.3866/PKU.WHXB19980418
[Abstract](3776) [FullText HTML] [PDF 865KB](2182)
Abstract:

Mutual coupling of surface electromagnetic wave between different silver particles on silver island substrates is realized experimentally and its effect on surface enhanced infrared spectroscopy is studied. Silver island substrates of different size ...

The Fluorescence Studies of a Hydrophobically Modified Polyelectrolytes
Chen Shun-Qing , Yang Ya-Hong
1998, 14(04): 380-384  doi: 10.3866/PKU.WHXB19980419
[Abstract](4166) [FullText HTML] [PDF 713KB](2370)
Abstract:

Epichlorohydrin (ECH) and tetraethylenepentamine(TEPA) were copolymerized and the copolymers were modified hydrophobically using a pendant C18 hydrophobic group (HPTE).Hydrophobic interaction of modified polymer was investigated by fluorescence using...

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