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ISSN 1000-6818CN 11-1892/O6CODEN WHXUEU
Acta Phys Chim Sin >> 2009,Vol.25>> Issue(02)>> 285-290     doi: 10.3866/PKU.WHXB20090215         中文摘要
Simulation of Methane Adsorption in AFS Molecular Sieves
CHEN Shan-Jun; DAI Wei; LUO Jiang-Shan; TANG Yong-Jian; WANG Chao-Yang; SUN Wei-Guo
Institute of Atomic and Molecular Physics, Sichuan University, Chengdu 610065, P. R. China; Research Centre of Laser Fusion, China Academy of Engineering Physics, Mianyang 621900, Sichuan Province, P. R. China
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The adsorption of methane in AFS molecular sieves was investigated by a grand canonical Monte Carlo (GCMC) simulation. The results were compared with the methane adsorption in IRMOF-6 materials obtained by Dvren et al. (Langmuir, 2004, 20: 2683). It was indicated that the adsorbed amouts in AFS were very striking. AFS molecular sieve is relative ideal adsorbent in the adsorbs storage natural gas system at the medium and low pressure. The Dubinin-Astakhov (DA) method was employed to analyze the physical factors that affect the storage of methane.

Keywords: Methane   Adsorption isotherm   Molecular sieve   Grand canonical Monte Carlo   Simulation  
Received: 2008-07-25 Accepted: 2008-10-27 Publication Date (Web): 2008-12-08
Corresponding Authors: TANG Yong-Jian Email: yj_tang2008@126.com


Cite this article: CHEN Shan-Jun; DAI Wei; LUO Jiang-Shan; TANG Yong-Jian; WANG Chao-Yang; SUN Wei-Guo. Simulation of Methane Adsorption in AFS Molecular Sieves[J]. Acta Phys. -Chim. Sin., 2009,25 (02): 285-290.    doi: 10.3866/PKU.WHXB20090215
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97. TIAN Yu-Qin, TIAN Yi-Ling, ZHAO Lin, ZHU Rong-Jiao, MA Chao.Gas-Liquid Phase Boundary Lines and Critical Curve for the Water+Methane System[J]. Acta Phys. -Chim. Sin., 2012,28(08): 1803-1808
98. ZHENG Zhao-Yang, ZHAO Ji-Jun.Lattice Energies and Elastic Properties of Solid Methane: Assessment of Different Density Functionals[J]. Acta Phys. -Chim. Sin., 2012,28(08): 1809-1814
99. YANG Rong-Jie, GUO Ya, TANG Fang-Miao, WANG Xiao-Ping, DU Rong-Gui, LIN Chang-Jian.Effect of Sodium D-Gluconate-Based Inhibitor in Preventing Corrosion of Reinforcing Steel in Simulated Concrete Pore Solutions[J]. Acta Phys. -Chim. Sin., 2012,28(08): 1923-1928
100. ZHANG Rong-Bin, LIANG Lei, ZENG Xian-Rong, SHANG Jin-Yan, WANG Tao, CAI Jian-Xin.Catalytic Properties of Ni /MWCNT and La-Promoted Ni /MWCNT for Methanation of Carbon Dioxide Reaction[J]. Acta Phys. -Chim. Sin., 2012,28(08): 1951-1956
101. WANG Yan-Hong, CHEN Yu-Juan, BAO Ling, LANG Xue-Mei, FAN Shuan-Shi.Molecular Dynamics Simulation of CH4 Hydrate Decomposition in the Presence of Poly(2-ethyl-2-oxazoline)[J]. Acta Phys. -Chim. Sin., 2012,28(07): 1683-1690
102. LI Jun-Nan, PU Min, SU Yong, HE Jing, EVANS David G..Theoretical Study on the Synthesis of Ethyl Tertiary Butyl Ether over HZSM-5 Zeolite[J]. Acta Phys. -Chim. Sin., 2012,28(07): 1630-1636
103. XU Zhao-Ying, ZHAO Li-Ling, CAO Zan-Xia, WANG Ji-Hua.Effects of the Residue Mutations on the Segment of P53-DNA Binding Region Based on Molecular Dynamics Simulation[J]. Acta Phys. -Chim. Sin., 2012,28(07): 1665-1675
104. MEI Yong-Jun, HAN Yi-Xiu, ZHOU Hong, YAO Lin, JIANG Bo.Synergism between Hydrophobically Modified Polyacrylic Acid and Wormlike Micelles[J]. Acta Phys. -Chim. Sin., 2012,28(07): 1751-1756
105. ZHANG Lan, ZHANG Zhen-Zhong, WEI Ji-Ying, MENG Bi-Fang, JIANG Feng, LIANG Tong-Xiang.Synthesis of Combined Micro-Mesoporous Zeolites and Their Application to Automobile Cold Start Emission Control[J]. Acta Phys. -Chim. Sin., 2012,28(06): 1439-1447
106. LAI Li-Shan, WU Yong-Quan, SHEN Tong, ZHANG Ning, GAO Shuai.Molecular Dynamics Simulation of Induced Solidification Process of Pure Liquid Fe by Al2O3 Nanoparticles[J]. Acta Phys. -Chim. Sin., 2012,28(06): 1347-1354
107. WEN Fei, ZHONG Bei-Jing.Skeletal Mechanism Generation Based on Eigenvalue Analysis Method[J]. Acta Phys. -Chim. Sin., 2012,28(06): 1306-1312
108. LÜ Yong-Jun, CHEN Min.Molecular Transport through Finite-Length Carbon Nanotubes[J]. Acta Phys. -Chim. Sin., 2012,28(05): 1070-1076
109. GAO Yu-Fei, MENG Qing-Yuan, ZHANG Lu, LIU Jia-Qiu, JING Yu-Hang.Molecular Dynamics Simulation of Thermal Transport Properties for Boron Nitride Nanotubes[J]. Acta Phys. -Chim. Sin., 2012,28(05): 1077-1084
110. JIANG Qian, CHU Wei, SUN Wen-Jing, LIU Feng-Si, XUE Ying.A DFT Study of Methane Adsorption on Nitrogen-Containing Organic Heterocycles[J]. Acta Phys. -Chim. Sin., 2012,28(05): 1101-1106
111. ZHANG Xia, ZHANG Qiang, ZHAO Dong-Xia.Quasi-Elastic Neutron Scattering Spectroscopy of the 1-Propanol/Water Solution by Molecular Dynamics Simulations[J]. Acta Phys. -Chim. Sin., 2012,28(05): 1037-1044
112. CHEN Yong-Dong, WANG Lei, TANG Shui-Hua, CAO Hong-Yan, GONG Mao-Chu, CHEN Yao-Qiang.Effect of Ce0.45Zr0.45Y0.07La0.03O1.95/La-Ba-Al2O3 Mass Ratio on the Activity of Fe-Based Monolithic Catalysts for the Combustion of Thin Methane[J]. Acta Phys. -Chim. Sin., 2012,28(05): 1237-1242
113. SUN De-Lin, ZHOU Jian.Dissipative Particle Dynamics Simulations on Mesoscopic Structures of Nafion and PVA/Nafion Blend Membranes[J]. Acta Phys. -Chim. Sin., 2012,28(04): 909-916
114. LI Hai-Lan, JIA Yu-Xiang, HU Yang-Dong.Molecular Dynamics Simulation of the Desalination of Sea Water by a Forward Osmosis Membrane Containing Charged Carbon Nanotubes[J]. Acta Phys. -Chim. Sin., 2012,28(03): 573-577
115. MIAO Yan-Lin, SUN Huai, WANG Lin, SUN Ying-Xin.Predicting Hydrogen Storage Performances in Porous Aromatic Frameworks Containing Carboxylate Functional Groups with Divalent Metallic Cations[J]. Acta Phys. -Chim. Sin., 2012,28(03): 547-554
116. YANG Dong-Hua, ZHAO Jun-Fu, ZHANG Jun-Liang, DOU Tao, WU Zhong-Hua, CHEN Zhong-Jun.Designed Synthesis and Crystallization of Fe-Al-EU-1 Zeolites Containing Framework-Iron[J]. Acta Phys. -Chim. Sin., 2012,28(03): 720-728
117. HUO Wei-Feng, LI Yi, LU Jun-Ran, YU Ji-Hong, XU Ru-Ren, LI Jing.A Computational Method for Specified Substructure Search in Inorganic Crystal Structures[J]. Acta Phys. -Chim. Sin., 2012,28(03): 536-540
118. LIU Guan-Feng, HUANG Jian-Hua.Monte Carlo Simulation on the Structures of a Nanoparticle/ Copolymer Mixed System[J]. Acta Phys. -Chim. Sin., 2012,28(02): 309-314
119. CAO Jian, CAO Zan-Xia, ZHAO Li-Ling, WANG Ji-Hua.Effect of α-Synuclein (1-17) Peptide for Cu2+-Bound and Metal-Free Forms by Molecular Dynamics Simulations[J]. Acta Phys. -Chim. Sin., 2012,28(02): 479-488
120. HAN Bing, CHU Yue-Ying, ZHENG An-Min, DENG Feng.Adsorption Structure and Energy of Pyridine Confined inside Zeolite Pores[J]. Acta Phys. -Chim. Sin., 2012,28(02): 315-323
121. LI Cao-Long, CHEN Wei, YUAN Jian, SHANGGUAN Wen-Feng.Hydrogen Evolution by Photocatalytic Steam Reforming of Methane over Pt/TiO2[J]. Acta Phys. -Chim. Sin., 2012,28(02): 450-456
122. LIU Zhen, LIU Gou-Sheng, YU Jian-Guo.Effect of Primary Alkylamine Adsorption on Muscovite Hydrophobicity[J]. Acta Phys. -Chim. Sin., 2012,28(01): 201-207
123. ZHAN Wei-Shen, PAN Shi, WANG Qiao, LI Hong, ZHANG Yi.Comparison of D-SS and D-ST Dyes as Photo Sensitizers in Dye-Sensitized Solar Cells[J]. Acta Phys. -Chim. Sin., 2012,28(01): 78-84
124. PAN Rui-Li, FAN Wei-Bin, LI Yu-Ping, LI Xiao-Feng, LI Sha, DOU Tao.Synthesis, Characterization of SSZ-33 Molecular Sieves and Their Performance for the Automobile Tailpipe Hydrocarbon Trap[J]. Acta Phys. -Chim. Sin., 2011,27(12): 2893-2899
125. SUN Shi-Cai, LIU Chang-Ling, YE Yu-Guang, JIANG Qian.Dissociation Conditions and Influencing Factors of Methane Hydrate in Chloride Salt Solution under High Pressure[J]. Acta Phys. -Chim. Sin., 2011,27(12): 2773-2778
126. HUA Xiao-Xiao, WANG Jing-Bo, WANG Quan-De, TAN Ning-Xin, LI Xiang-Yuan.Mechanism Construction and Simulation for the High-Temperature Combustion of n-Dodecane[J]. Acta Phys. -Chim. Sin., 2011,27(12): 2755-2761
127. WU Man-Man, TANG Xiao-Feng, NIU Ming-Li, ZHOU Xiao-Guo, DAI Jing-Hua, LIU Shi-Lin.Ionization and Dissociation of Methyl Chloride in an Excitation Energy Range of 13-17 eV[J]. Acta Phys. -Chim. Sin., 2011,27(12): 2749-2754
128. WANG Song, MAO Dong-Sen, GUO Xiao-Ming, LU Guan-Zhong.Dimethyl Ether Synthesis from CO2 Hydrogenation over CuO-TiO2-ZrO2/HZSM-5 Catalysts[J]. Acta Phys. -Chim. Sin., 2011,27(11): 2651-2658
129. YU Shan-Qing, TIAN Hui-Ping, ZHU Yu-Xia, DAI Zhen-Yu, LONG Jun.Mechanism of Rare Earth Cations on the Stability and Acidity of Y Zeolites[J]. Acta Phys. -Chim. Sin., 2011,27(11): 2528-2534
130. ZHANG Xia, ZHANG Qiang, ZHAO Dong-Xia.Hydrogen Bond Lifetime Definitions and the Relaxation Mechanism in Water Solutions[J]. Acta Phys. -Chim. Sin., 2011,27(11): 2547-2552
131. LIU Jian, ZHAO Zhen, WANG Hong-Xuan, DUAN Ai-Jun, JIANG Gui-Yuan.Selective Oxidation Performance of Propane over Supported Vanadium Oxide Catalysts[J]. Acta Phys. -Chim. Sin., 2011,27(11): 2659-2664
132. ZHANG Yong, XIAO Zhong-Dang.Brownian Dynamics Simulation of Three Nonlinear Interactions on the Folding Process of Single Completely Stretched DNA Chain[J]. Acta Phys. -Chim. Sin., 2011,27(11): 2705-2710
133. DOU Yu-Sheng, LI Wei, YUAN Shuai, ZHANG Wen-Ying, LI An-Yang, SHU Kun-Xian, TANG Hong.Dynamics Simulation of Photophysical Deactivation Pathway for Stacked Thymines[J]. Acta Phys. -Chim. Sin., 2011,27(11): 2559-2564
134. YUAN Wen-Hui, CHANG Ran-Ran, LIU Xiao-Chen, LI Li.Preparation of PHI Zeolite Membrane with High Separation Performance by the Secondary Growth Method[J]. Acta Phys. -Chim. Sin., 2011,27(10): 2493-2498
135. JIN Yi, WANG Yue, BIAN Fu-Yong, SHI Qiang, GE Mao-Fa, WANG Shu, ZHANG Xing-Kang, XU Si-Chuan.Three-Dimensional Structure of Dopamine 3-Subtype Receptor with the Active Site Residues for the Binding of Dopamine[J]. Acta Phys. -Chim. Sin., 2011,27(10): 2432-2446
136. PENG Xuan, ZHANG Qin-Xue, CHENG Xuan, CAO Da-Peng.Adsorption and Separation of CO2/CH4/N2 Binary Mixtures in an Ordered Mesoporous Carbon Material CMK-3[J]. Acta Phys. -Chim. Sin., 2011,27(09): 2065-2071
137. ZHAO Liu-Jie, RAN Jing-Yu, WU Sheng.Thermodynamic Study of the Humidity Ratio for Methane Reforming at Low Temperature in a Micro-Combustor[J]. Acta Phys. -Chim. Sin., 2011,27(09): 2027-2034
138. XU Xiao-Ling, LI Chun-Yi, SHAN Hong-Hong.Novel Modified Magnesium-Aluminate Spinels as Potential FCC Matrix Components[J]. Acta Phys. -Chim. Sin., 2011,27(08): 1947-1955
139. XU Pei-Jun, TANG Yuan-Yuan, ZHANG Jing, ZHANG Zhi-Bo, WANG Kun, SHAO Ying, SHEN Hu-Jun, MAO Ying-Chen.Molecular Dynamics Simulation of Organic Solvents Based on the Coarse-Grained Model[J]. Acta Phys. -Chim. Sin., 2011,27(08): 1839-1846
140. XIA Wen-Sheng, CHANG Gang, HOU Yu-Hui, WENG Wei-Zheng, WAN Hui-Lin.Influence of Ni Chemical States on the Partial Oxidation Mechanism of Methane: An Energetics Analysis[J]. Acta Phys. -Chim. Sin., 2011,27(07): 1567-1573
141. ZHANG Shao-Long, LI Bin, ZHANG Fei-Yue, MA Li, HAN Yan-Hua, FAN Min-Guang.Aromatization of Ethanol over Metal Modified P/HZSM-5 Zeolite[J]. Acta Phys. -Chim. Sin., 2011,27(06): 1501-1508
142. LIU Yun-Hong, GAO Ya-Jun, WANG Fen-Ying, ZHU Tie-Min, ZHAO Jian-Wei.Molecular Dynamics Simulation of the Influence of Crystal Orientation on the Formation Probability of Silver Monoatomic Chains during Stretching[J]. Acta Phys. -Chim. Sin., 2011,27(06): 1341-1345
143. ZHAI Dong, ZHAO Liang, PAN Hui-Fang, ZHAO Zhen, DUAN Ai-Jun, GAO Jin-Sen, CHEN Yu.Monte Carlo Investigation into C4 Hydrocarbon Adsorption in FAU, BEA and LTL Zeolites[J]. Acta Phys. -Chim. Sin., 2011,27(06): 1400-1406
144. CHEN Cong, LI Wei-Zhong, SONG Yong-Chen, WENG Lin-Dong.Structure and Kinetics of Hydrogen Bonds in Aqueous Glucose Solutions[J]. Acta Phys. -Chim. Sin., 2011,27(06): 1372-1378
145. LIU Zhen-Hai, SHANG Ya-Zhuo, HUANG Yong-Min, PENG Chang-Jun, LIU Hong-Lai.Disassembly of Polyelectrolyte/Surfactants Complex Induced by Macroions[J]. Acta Phys. -Chim. Sin., 2011,27(05): 1135-1142
146. WANG Wang-Yin, PAN Ming-Xue, QIN Yu-Cai, WANG Ling-Tao, SONG Li-Juan.Effects of Surface Acidity on the Adsorption Desulfurization of Cu(I)Y Zeolites[J]. Acta Phys. -Chim. Sin., 2011,27(05): 1176-1180
147. ZHANG Hui-Min, HU Rui-Sheng, HU Jia-Nan, ZHANG Yu-Long.Preparation and Catalytic Activities of La2CoAlO6 for Methane Combustion[J]. Acta Phys. -Chim. Sin., 2011,27(05): 1169-1175
148. SONG Lei, YU Feng, WU Li-Xia, ZHOU Xiao-Guo, LIU Shi-Lin.Anionic Production Pathways Involved in the Reaction between OH- and CH2ClF[J]. Acta Phys. -Chim. Sin., 2011,27(04): 801-807
149. YUAN Shuai, ZHANG Wen-Ying, LI An-Yang, ZHU Yi-Min, DOU Yu-Sheng.Dynamics Simulation of a New Deactivation Pathway for Stacked Adenines[J]. Acta Phys. -Chim. Sin., 2011,27(04): 825-830
150. LI Wen, ZHOU Jin, XING Wei, ZHUO Shu-Ping, Lü Yi-Min.Preparation of Microporous Carbon Using a Zeolite HY Template and Its Capacitive Performance[J]. Acta Phys. -Chim. Sin., 2011,27(03): 620-626
151. MA Yan-Hui, ZHAO Hui-Ling, TANG Sheng-Jie, HU Jun, LIU Hong-Lai.Synthesis of Micro/Mesoporous Composites and Their Application as CO2 Adsorbents[J]. Acta Phys. -Chim. Sin., 2011,27(03): 689-696
152. HU Song-Qing, YU Li-Jun, YAN You-Guo, ZHANG Jun, REN Zhen-Jia, TI Yang.Experimental and Theoretical Study of the Synergistic Inhibitive Effect of SDBS and HA[J]. Acta Phys. -Chim. Sin., 2011,27(02): 275-280
153. JIA Yu-Xiang, LI Yan, HU Yang-Dong.Behavior of Carbon Nanotube Membranes as Channels of Salt and Water in Forward Osmosis Process[J]. Acta Phys. -Chim. Sin., 2011,27(01): 228-232
154. JING Bo, ZHANG Jian, Lü Xin, ZHU Yue-Jun, ZHANG Feng-Jiu, JIANG Wei, TAN Ye-Bang.Dissipative Particle Dynamics Simulation of Interface Tension in the Ternary Triton X-100/Toluene/H2O System[J]. Acta Phys. -Chim. Sin., 2011,27(01): 65-70
155. LIU Xiao-Yu, LI Chun, TIAN Wen-Yu, CHEN Tao, WANG Lu-Hua, ZHENG Zhong, ZHU Jian-Bo, SUN Mao, LIU Chun-Li.Molecular Dynamics Modeling of Uranyl Ion Adsorption onto the Basal Surfaces of Kaolinite[J]. Acta Phys. -Chim. Sin., 2011,27(01): 59-64
156. SUN Hao, JIANG Yong-Jun, YU Qing-Sen, GAO Hui.Molecular Dynamics Simulations on the Role of Structural Mg2+ Ions in Phosphoryl Transfer Catalyzed by GSK-3β[J]. Acta Phys. -Chim. Sin., 2011,27(01): 207-212
157. CHEN Hua-Rong, CHANG Ran-Ran, LI Li, YUAN Wen-Hui.High Performance NaA Zeolite Membrane for Hydrogen Separation Synthesized on an Organic-Functionalized α-Al2O3 Ceramic Hollow Fiber Surface[J]. Acta Phys. -Chim. Sin., 2011,27(01): 241-247
158. LI Yan-Feng, ZHU Ji-Qin, LIU Hui, WANG Peng, TIAN Hui-Ping.Increase in the Hydrothermal Stability of the La-Modified ZSM-5 Zeolite[J]. Acta Phys. -Chim. Sin., 2011,27(01): 52-58
159. LIU Bai-Jun, MENG Qing-Lei, WANG Hui, MENG Qing-Min.Synthesis and Characterization of Al MCM-41 Mesoporous Molecular Sieves[J]. Acta Phys. -Chim. Sin., 2010,26(12): 3257-3262
160. QIAO Gui-Min, REN Zhen-Jia, ZHANG Jun, HU Song-Qing, YAN You-Guo, TI Yang.Molecular Dynamics Simulation of Corrosive Medium Diffusion in Corrosion Inhibitor Membrane[J]. Acta Phys. -Chim. Sin., 2010,26(11): 3041-3046
161. KE Yan-Rong, JIN Hong-Wei, LIU Zhen-Ming, ZHANG Liang-Ren.Homology Modeling and Structure Validation of the Adenosine A1 Receptor[J]. Acta Phys. -Chim. Sin., 2010,26(10): 2833-2839
162. ZHU Su-Hua, YAN Liu-Ming, JI Xiao-Bo, SHAO Chang-Le, LU Wen-Cong.Electroosmotic Drag of Water in Hydrated Potassium Perfluorosulfonated Polymer Membrane in External Electric Fields[J]. Acta Phys. -Chim. Sin., 2010,26(10): 2659-2665
163. LIU Fu-Feng, JI Luo, DONG Xiao-Yan.Effects ofMolecular Volume and Fractional Polar Surface Area of Osmolytes on the Thermal Stability of Chymotrypsin Inhibitor 2[J]. Acta Phys. -Chim. Sin., 2010,26(10): 2813-2820
164. LIU Jie-Xiang, ZHANG Xiao-Guang, DUAN Zhong-Yu, LIU Xiao-Li.NOx Molecule Adsorption in [Ag]-MAPO-5 (M=Si, Ti)Molecular Sieves[J]. Acta Phys. -Chim. Sin., 2010,26(10): 2679-2685
165. GUO Yu-Hua, PU Min, CHEN Biao-Hua.Adsorption of Linear C2-C5 Olefins on HYand H-ZSM-5 Zeolites[J]. Acta Phys. -Chim. Sin., 2010,26(09): 2503-2509
166. WU Li-Xia, YU Feng, LIU Jing, DAI Jing-Hua, ZHOU Xiao-Guo, LIU Shi-Lin.Ab initioMolecular Dynamics Investigation on the Production Channels for the Reaction of O- with CH3F[J]. Acta Phys. -Chim. Sin., 2010,26(09): 2331-2336
167. GAO Guan-Dao, LI Jing, ZHANG Ai-Yong, AN Xiao-Hong, ZHOU Lei.Optimizational Preparation and Mesoporous Material Characteristics of a Novel Biomimetic Photocatalyst and Its Application to the Photocatalytic Degradation of Phenol[J]. Acta Phys. -Chim. Sin., 2010,26(09): 2437-2442
168. LIU Shu-Ping, YUE Ming-Bo, WANG Yi-Meng.One-Step Synthesis of Mesoporous Beta Zeolite Using Phosphate[J]. Acta Phys. -Chim. Sin., 2010,26(08): 2224-2228
169. MAO Dong-Sen, GUO Qiang-Sheng, MENG Tao.Effect of Magnesium Oxide Modification on the Catalytic Performance of Nanoscale HZSM-5 Zeolite for the Conversion of Methanol to Propylene[J]. Acta Phys. -Chim. Sin., 2010,26(08): 2242-2248
170. WANG Zhou-Xiang, YAN Wen-Fu, TIAN Da-Yong, CAO Xue-Jing, YU Ji-Hong, XU Ru-Ren.Preparation of Highly b-Oriented Silicalite-1 Films[J]. Acta Phys. -Chim. Sin., 2010,26(07): 2044-2048
171. LIU Yi-Wu, YU Huan, ZHANG Xiao-Ming, SUO Ji-Shuan.Direct Gas-Phase Epoxidation of Propylene over Au/Ti-MCM-41(H) Catalysts[J]. Acta Phys. -Chim. Sin., 2010,26(06): 1585-1592
172. WU Jian, WANG Yu, HUANG Feng, YANG Yang, MENG Chang-Gong.Thermal Diffusion Synthesis and Characterization of SnO2 Clusters within ZSM-5 Crystals[J]. Acta Phys. -Chim. Sin., 2010,26(06): 1705-1710
173. LIU Fu-Feng, DONG Xiao-Yan, SUN Yan.Molecular Dynamics Simulation of the Conformational Transition of Amyloid Peptide 42 Inhibited by Trehalose[J]. Acta Phys. -Chim. Sin., 2010,26(06): 1643-1650
174. MU Wei, LIU Da-Huan, YANG Qing-Yuan, ZHONG Chong-Li.Diffusion Rates of Gas Molecules Adsorbed in Metal-Organic Frameworks[J]. Acta Phys. -Chim. Sin., 2010,26(06): 1657-1663
175. ZHANG Xiang, MA Cong-Cong, ZHANG Xue-Jun, SHAO Xiao-Hong, CAO Da-Peng.Adsorption Separation of a Small Amount of 1,1,1,2-Tetrafluoroethane in Air Using Molecular Simulation[J]. Acta Phys. -Chim. Sin., 2010,26(06): 1637-1642
176. ZHANG Jun, YU Wei-Zhao, YAN You-Guo, YU Li-Jun, REN Zhen-Jia.Molecular Dynamics Simulation of the Adsorption Behavior of Imidazoline Corrosion Inhibitors on a Fe(001) Surface[J]. Acta Phys. -Chim. Sin., 2010,26(05): 1385-1390
177. HE Yue, DONG Mei, LI Jun-Fen, WANG Jian-Guo, FAN Wei-Bin.Synthesis and Catalytic Properties of MeAPO-5 Molecular Sieves for Selective Oxidation of Cinnamyl Alcohol[J]. Acta Phys. -Chim. Sin., 2010,26(05): 1305-1310
178. HE Xiang-Wei, LONG Hai-Tao, YUAN Gu, Xu Xiao-Jie, ZHOU Ya-Wei.Investigation of Interaction of Small Natural Product Molecules and Human Telomeric G-Quadruplex and Thermal Stabilities of the Complexes by Electrospray Ionization Mass Spectrometry[J]. Acta Phys. -Chim. Sin., 2010,26(04): 1082-1086
179. LIU Ping, XING Guo-Wen, LI Xuan-Wen, YE Yun-Hua.Adsorptive Immobilization of Four Proteases on Different Molecular Sieves[J]. Acta Phys. -Chim. Sin., 2010,26(04): 1113-1118
180. WANG Luo-Xin, XU Jie, ZOU Han-Tao, YI Chang-Hai.Effect of Chirality and Size on the Thermal Decomposition of Nitromethane Confined inside Single-Walled Carbon Nanotube[J]. Acta Phys. -Chim. Sin., 2010,26(03): 721-726
181. DING Wei, LIU Guo-Yu, YU Tao, QU Guang-Miao, CHENG Jie-Cheng, WU Jun-Zheng.Molecular Dynamics Simulations and Free Energy Perturbation Calculations of Alkyl Aryl Sulfonate[J]. Acta Phys. -Chim. Sin., 2010,26(03): 727-734
182. LEI Ze, ZHU Qing-Shan, HAN Min-Fang.Fabrication and Performance of Direct Methane SOFC with a Cu-CeO2-Based Anode[J]. Acta Phys. -Chim. Sin., 2010,26(03): 583-588
183. SHAO Ju-Xiang, TAN Ning-Xin, LIU Wei-Xiong, LI Xiang-Yuan.Influence of H2O and CO2 in Air on the Combustion of Ethylene (II)——Reaction Mechanismand Kinetics Simulation[J]. Acta Phys. -Chim. Sin., 2010,26(02): 270-276
184. MAO Dong-Sen, GUO Qiang-Sheng, MENG Tao, LU Guan-Zhong.Effect of Hydrothermal Treatment on the Acidity and Catalytic Performance of Nanosized HZSM-5 Zeolites for the Conversion of Methanol to Propene[J]. Acta Phys. -Chim. Sin., 2010,26(02): 338-344
185. WANG Jin-E, YANG Chun.Direct Syntheses and Characterizations of PW11/SBA-15 Mesoporous Hybrid Materials[J]. Acta Phys. -Chim. Sin., 2010,26(02): 515-520
186. WANG Huan, ZHAO Shu-Feng, LAN Yang-Chun, LIU Xiao, LU Jia-Xing.Electrochemical Reduction Reaction Mechanism of Cinnamonitrile[J]. Acta Phys. -Chim. Sin., 2010,26(02): 277-282
187. BAI Mei-Gui, TAO Xu-Mei, WU Qing-You, HUANG Zhi-Jun, LI Yu-Liang, YIN Yong-Xiang, DAI Xiao-Yan.Effect of Different Feeding Modes on CO2 Reforming of CH4 by Thermal Plasma[J]. Acta Phys. -Chim. Sin., 2009,25(12): 2455-2460
188. ZHENG Hui, SHEN Liang, BAI Bin.Monte Carlo Simulation of a Lattice Model for the Intermetallic Compound NiAl[J]. Acta Phys. -Chim. Sin., 2009,25(12): 2531-2536
189. WANG Wei-Bin, YIN Jian-Zhong, SUN Li-Hua, FENG En-Min.Molecular Dynamics Simulation of Thermodynamic Properties for CO2/Ionic Liquid Systems[J]. Acta Phys. -Chim. Sin., 2009,25(11): 2291-2295
190. JU Xiu-Fang, JIN Ling-Ling, MA Tao, CHEN Xiao- Lu, SONG Li-Juan.Effects of 1,5-Hexadiene and Benzene on the Desulfurization Property of NiYZeolites[J]. Acta Phys. -Chim. Sin., 2009,25(11): 2256-2260
191. XU Chen, GUAN Jing-Qi, WU Shu-Jie, KAN Qiu-Bin.Effect of Silica Source on the Hydrothermal Synthesis of ITQ-13 Zeolite[J]. Acta Phys. -Chim. Sin., 2009,25(11): 2275-2278
192. LIU Bai-Jun, ZENG Xian-Jun.Catalytic Conversion of Mixed C4 Hydrocarbons over ZSM-5/ZSM-57 Composite Zeolite Catalyst[J]. Acta Phys. -Chim. Sin., 2009,25(10): 2055-2060
193. GAO Ting-Hong, LIU Rang-Su, ZHOU Li-Li, TIAN Ze-An, XIE Quan.Formation Properties of Cluster Structures during the Rapid Solidification of Liquid Ca7Mg3 Alloy[J]. Acta Phys. -Chim. Sin., 2009,25(10): 2093-2100
194. KONG De-Jin, ZOU Wei, ZHENG Jun-Lin, QI Xiao-Lan, FANG Ding-Ye.Crystallization Kinetics and Influencing Factors in the Syntheses of MFI/MFI Core-Shell Zeolites[J]. Acta Phys. -Chim. Sin., 2009,25(09): 1921-1927
195. LI Ping, TAN Ning-Xin, RAO Han-Bing, LI Ze-Rong, Chen Yu-Zong.Classification Models for HERG Potassium Channel Inhibitors Based on the Support Vector Machine Approach[J]. Acta Phys. -Chim. Sin., 2009,25(08): 1581-1586
196. LIU Wei-Xiong, YANG Yang, SHAO Ju-Xiang, SONG Wen-Yan, LI Xiang-Yuan, LE Jia-Ling.Influence of H2O and CO2 Contamination in Air on the Combustion Properties of Ethylene[J]. Acta Phys. -Chim. Sin., 2009,25(08): 1618-1622
197. ZHANG Chang-Hua, ZHANG Yan, ZHANG Song, ZHANG Bing.Photodissociation Dynamics of Chloroiodomethane in the A-Band[J]. Acta Phys. -Chim. Sin., 2009,25(08): 1708-1712
198. FENG Li-Li, ZHAO Wei, LIU Yang, JIAO Liang, LI Xing-Guo.Photocatalytic Degradation of Rhodamine B by Nanocrystalline TiO2 Loaded into MCM-41 Molecular Sieves[J]. Acta Phys. -Chim. Sin., 2009,25(07): 1347-1351
199. FU Yi-Zheng, LIU Ya-Qing, LAN Yan-Hua.Molecular Dynamics Simulation on Compatibility of Hydroxyl-Terminated Polybutadiene/Plasticizer Blends[J]. Acta Phys. -Chim. Sin., 2009,25(07): 1267-1272
200. SHI Jie-Hua, XIAO Ke-Ke, LV Yuan-Yuan.Host-Guest Interactions of β-Cyclodextrin with Enantiomers of Ethyl α-Chloropropionates[J]. Acta Phys. -Chim. Sin., 2009,25(07): 1273-1278
201. TAO Chang-Gui, FENG Hai-Jun, ZHOU Jian, LV Ling-Hong, LU Xiao-Hua.Molecular Simulation of Oxygen Adsorption and Diffusion in Polypropylene[J]. Acta Phys. -Chim. Sin., 2009,25(07): 1373-1378
202. ZHAO Jian-Wei, LIU Hong-Mei, NI Wen-Bin, GUO Yan, YIN Xing.Electron Transfer Studied at theMolecular Level[J]. Acta Phys. -Chim. Sin., 2009,25(07): 1472-1480
203. ZANG Xiao-Ya, LIANG De-Qing, FAN Shuan-Shi, TANG Cui-Ping.Influence of 5A-Type Zeolite Powder on Tetrahydrofuran Hydrate Formation and Dissociation Process[J]. Acta Phys. -Chim. Sin., 2009,25(06): 1047-1052
204. ZENG Fan-Gui, JIA Jian-Bo.Reaction Types and Kinetics of Methane Generation from Huolinhe Lignite Pyrolysis by TG/MS Experiment and Quantum Chemical Calculations[J]. Acta Phys. -Chim. Sin., 2009,25(06): 1117-1124
205. SONG Qi-Sheng, GUO Xin-Li, YUAN Shi-Ling, LIU Cheng-Bu.Molecular Dynamics Simulation of Sodium Dodecyl Benzene Sulfonate Aggregation on Silica Surface[J]. Acta Phys. -Chim. Sin., 2009,25(06): 1053-1058
206. SUN Xiu-Liang, HUANG Chong-Pin, ZHANG Jie, CHEN Biao-Hua.Location of Al and Acid Strength of Brφnsted Acid in Beta Zeolite[J]. Acta Phys. -Chim. Sin., 2009,25(06): 1136-1142
207. WANG Li-Juan, LIU Gou-Sheng, SONG Xing-Fu, YU Jian-Guo.Molecular Modeling for Selective Adsorption of Halite with Dodecylmorpholine[J]. Acta Phys. -Chim. Sin., 2009,25(05): 963-969
208. MENG Ming-Cheng, LI Lin-Li, ZHAN Xian-Cheng, TAO Jian-Lin, HAN Xue.Evaluation of the Influence of Humidity and Temperature on the Drug Stability by Plane Single Time Point Experiments[J]. Acta Phys. -Chim. Sin., 2009,25(05): 897-904
209. HAO Zhi-Xian, ZHAO Hai-Tao, WANG Li-Jun, XIE Li-Li, TIAN Zhen, LI Qing-Hua.Effects of Si/Al Molar Ratio on the Crystallinity and Toluene Adsorption of SAPO-5 Synthesized under Microwave Radiation[J]. Acta Phys. -Chim. Sin., 2009,25(05): 829-834
210. LEI Qiang-Hua, CHEN Chang-An, XIONG Yi-Fu.Thermodynamic Hydrogen Isotopic Effect of Mg2NiQ6 (Q=H, D, T)[J]. Acta Phys. -Chim. Sin., 2009,25(05): 941-946
211. SUN Hao, JIANG Yong-Jun, YU Qing-Sen, ZOU Jian-Wei.Molecular Dynamics Simulation of Significant Roles of Structural Water Molecules in Glycogen Synthase Kinase-3β[J]. Acta Phys. -Chim. Sin., 2009,25(04): 635-639
212. CHEN Xin-Yuan, LV Yang, LI Shen-Min.Molecular Dynamics Simulations on the Stability of (3+1) Mixed-Type Hybrid G-quadruplex in Human Telomere[J]. Acta Phys. -Chim. Sin., 2009,25(04): 783-791
213. CUI Wei, ZHANG Huai, JI Ming-Juan.Molecular Dynamics Simulations and Free Energy Calculations of a Novel Series of Protein Tyrosine Phosphatase 1B Difluoromethylenephosphonic Acid Inhibitors[J]. Acta Phys. -Chim. Sin., 2009,25(04): 668-676
214. CAI Kai-Cong, WANG Jian-Ping.Molecular Dynamical Structures of Glycolaldehyde[J]. Acta Phys. -Chim. Sin., 2009,25(04): 677-683
215. WAN Li-Hua, YA Ke-Feng, LI Xiao-Sen, FAN Shuan-Shi.Molecular Dynamics Simulation of Methane Hydrate Dissociation Process in the Presence of Thermodynamic Inhibitor[J]. Acta Phys. -Chim. Sin., 2009,25(03): 486-494
216. SHAO Qing; LV Ling-Hong; LU Xiao-Hua; WEI Ming-Jie; ZHU Yu-Dan; SHEN Wen-Feng.Molecular Simulation of Solute Hydration Structure in Nanoscale Confinement[J]. Acta Phys. -Chim. Sin., 2009,25(03): 583-589
217. FAN Min-Guang, LI Bin, ZHANG Fei-Yue, LI Wang-Liang, XING Jian-Min, LIU Zi-Li.Distribution of Copper Ions in a CuLaHY Zeolite and Its Performance in Adsorption Desulfurization[J]. Acta Phys. -Chim. Sin., 2009,25(03): 495-501
218. ZHAO Yong-Shan, ZHENG Qing-Chuan, ZHANG Hong-Xing, CHU Hui-Ying, SUN Chia-Chung.Homology Modeling of Human Serine Racemase and Its Molecular Docking with Peptide Inhibitors[J]. Acta Phys. -Chim. Sin., 2009,25(03): 417-422
219. CHEN Cong, LI Wei-Zhong.Molecular Dynamics Simulation of Hydrogen Bonding Characteristics in Aqueous Glycerol Solutions[J]. Acta Phys. -Chim. Sin., 2009,25(03): 507-512
220. WU Ding-Hong, XU Xiao-Jie.Computational Simulation of Benefiting Qi and Activating Blood Mechanismof Traditional Chinese Medicine[J]. Acta Phys. -Chim. Sin., 2009,25(03): 446-450
221. ZHANG Guo; BAI Fu-Quan; ZHOU Xin; LIU Tao; PAN Qing-Jiang; FU Hong-Gang; ZHANG Hong-Xing.Adsorption of Thiophene and the Mixture of Thiophene and Iso-octane on MCM-22 Zeolite by Monte Carlo Simulation[J]. Acta Phys. -Chim. Sin., 2009,25(02): 218-222
222. PAN Guo-Xiang; NI Zhe-Ming; WANG Fang; WANG Jian-Guo; LI Xiao-Nian.Molecular Dynamics Simulation on Structure, Hydrogen-Bond and Hydration Properties of Diflunisal Intercalated Layered Double Hydroxides[J]. Acta Phys. -Chim. Sin., 2009,25(02): 223-228
223. XU Jun-Ke; LI Zhao-Jing; WANG Ji-Hui; ZHOU Wei; MA Jian-Xin.Characterization and Analysis of Carbon Deposited on the Surface of Ni/Al2O3 Catalyst for Methane Dry Reforming[J]. Acta Phys. -Chim. Sin., 2009,25(02): 253-260
224. LUO Xiao-Lin; CHEN Ya-Shao; CHANG Peng-Mei; YANG De-Suo; JIANG Luan.Synthesis of SAPO-11 Molecular Sieve Microspheres Using a Microwave Technique and Mediated by Ionic Micelles[J]. Acta Phys. -Chim. Sin., 2009,25(01): 137-144
225. LI Zhen-Quan; GUO Xin-Li; WANG Hong-Yan; LI Qing-Hua; YUAN Shi-Ling; XU Gui-Ying; LIU Cheng-Bu.Molecular Dynamics Simulation of Anionic Surfactant Aggregation at the Oil/Water Interface[J]. Acta Phys. -Chim. Sin., 2009,25(01): 6-12
226. FU Yi-Zheng; LIU Ya-Qing; MEI Lin-Yu; LAN Yan-Hua.Molecular Dynamics Simulation on Binding Energies and Mechanical Properties of HTPB and Different Crystal Faces of Al[J]. Acta Phys. -Chim. Sin., 2009,25(01): 187-190
227. ZHAO Rui-Hua, DONG Mei, QIN Zhang-Feng, DING Jian-Fei, GUO Xing-Cui, WANG Jian-Guo.Synthesis and Characterization of CoAPO-5 with different Cobalt Contents and Their Catalytic Performance for Cyclohexane Oxidation[J]. Acta Phys. -Chim. Sin., 2008,24(12): 2304-2308
228. ZHANG Nuo-Wei, HUANG Chuan-Jing, KUANG Fei-Ping, GAO Xiao-Xiao, WENG Wei-Zheng, WAN Hui-Lin.Effect of a Mg Promoter on the Structure and Catalytic Performance of a Co/Mg/HZSM-5 Catalyst for the Partial Oxidation of Methane to Syngas[J]. Acta Phys. -Chim. Sin., 2008,24(12): 2165-2171
229. XIAO Li-Hua, SUN Kun-Peng, XU Xian-Lun.Catalytic Combustion of Methane over CeO2-MOx (M=La3+, Ca2+) Solid Solution Promoted Pd/γ-Al2O3 Catalysts[J]. Acta Phys. -Chim. Sin., 2008,24(11): 2108-2113
230. CHEN Ying; WANG Xiu-Ying; ZHAO Jun-Qing.Molecular Dynamics Simulation on Melting of Metal Cluster with Small Size[J]. Acta Phys. -Chim. Sin., 2008,24(11): 2042-2046
231. YANG Xiao-Feng; QIN Zhang-Feng; WANG Jian-Guo.A Random Walk Model for Molecular Anisotropic Diffusion in Siliceous β-Zeolites[J]. Acta Phys. -Chim. Sin., 2008,24(11): 2128-2132
232. ZHONG Yi-Jun; XU Xiao-Hua; XIAO Qiang; JIANG Li; ZHU Wei-Dong; MA Chun-An.Selective Oxidation of Carbon Monoxide and Ethene Mixture on Zeolite NaA Membranes Coated Catalysts[J]. Acta Phys. -Chim. Sin., 2008,24(10): 1875-1878
233. LIU Hai-Miao; XIONG Xiao-Gen; ZHAO Chang-Chun; ZHENG Ju-Hua; GAO Qing-Yu.Complex Oscillations in the Oxidation of Sulfide by Hydrogen Peroxide[J]. Acta Phys. -Chim. Sin., 2008,24(10): 1897-1901
234. LI Xiao-Feng; ZHAO Li-Feng; SUN Huai.Comparison of GEMC and GDI Methods in Prediction of the Fluid Vapor-liquid Equilibrium[J]. Acta Phys. -Chim. Sin., 2008,24(10): 1824-1830
235. HU Jian-Ping; KE Guo-Tao; CHANG Shan; CHEN Wei-Zu; WANG Cun-Xin.Conformational Change of HIV-1 Viral DNA after Binding with Integrase[J]. Acta Phys. -Chim. Sin., 2008,24(10): 1803-1810
236. WANG Hong-Guo; JIANG Heng; XU Jing; SUN Zhao-Lin; ZHANG Xiao-Tong; ZHU He-Li; SONG Li-Juan.Effects of Benzene and 1-Octene on Desulfurization by Selective Adsorption with Ce(IV)Y[J]. Acta Phys. -Chim. Sin., 2008,24(09): 1714-1718
237. ZENG Yu-Yao; ZHANG Bing-Jian.Designed Metal-Organic Frameworks Based on MOF-5 and Their Methane Adsorption Calculation by Grand Canonical Monte
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238. WANG Li-Na; LIU Zhong-Wei; ZHU Ai-Min; ZHAO Guo-Li; XU Yong.Numerical Simulation of·OH and HO2· Radicals in Dielectric Barrier Discharge Plasmas[J]. Acta Phys. -Chim. Sin., 2008,24(08): 1400-1404
239. SHEN Qiu-Chan; LIANG Wan-Chun; HU Xing-Bang; LI Hao-Ran.Molecular Dynamics Simulation for Formamide Aqueous Solution[J]. Acta Phys. -Chim. Sin., 2008,24(07): 1169-1174
240. ZHANG Jun; ZHAO Wei-Min; GUO Wen-Yue; WANG Yong; LI Zhong-Pu.Theoretical Evaluation of Corrosion Inhibition Performance of Benzimidazole Corrosion Inhibitors[J]. Acta Phys. -Chim. Sin., 2008,24(07): 1239-1244
241. CUI Bao-Qiu; GONG Li-Dong; ZHAO Dong-Xia.Molecular Dynamics Simulation of Microperoxidase in Aqueous Solution in Terms of the ABEEM/MM Method[J]. Acta Phys. -Chim. Sin., 2008,24(06): 1035-1040
242. GUO Liang; WU Zhan-Song.Mechanism of Methane’s Adsorption on Nanometer Active Carbon at Supercritical State[J]. Acta Phys. -Chim. Sin., 2008,24(05): 737-742
243. PEI Su-Peng; ZHANG Bin; JIAO Kun; BAO Ren-Lie; YUE Bin; HE He-Yong.Nanostructured CoMoO4 Supported on Mesoporous SBA-15 for Catalytic Oxidative Dehydrogenation of Propane to Propene[J]. Acta Phys. -Chim. Sin., 2008,24(04): 561-564
244. GENG Chun-Yu; DING Li-Ying; HAN Qing-Zhen; WEN Hao.Influence of Gas Molecule on Stability of Methane Hydrate[J]. Acta Phys. -Chim. Sin., 2008,24(04): 595-600
245. ZHANG Rong; TAN Zai-You; ZHENG Dun-Sheng; LUO San-Lai; LI Hao-Ran.Molecular Dynamics Simulations on the Special System of TFE Aqueous Solution[J]. Acta Phys. -Chim. Sin., 2008,24(03): 428-432
246. WANG Shu-Jun; ZANG Na; RUAN Wen-Juan; ZHU Zhi-Ang.Molecular Recognition of Chiral Zinc Porphyrin with Amino Acid Ester Derivatives[J]. Acta Phys. -Chim. Sin., 2008,24(03): 507-512
247. REN Xiu-Bin; LI Huan-Ying; GUO Xiang-Yun.Oscillatory Behavior during the Partial Oxidation of Methane[J]. Acta Phys. -Chim. Sin., 2008,24(02): 197-200
248. ZHANG Ya-Yuan; JIANG Zheng; ZHANG Shi-Chao; ZHU Qing-Shan.Catalytic Performance of La0.8Sr0.2FeMn1.5Al9.5O19-δ Hexaaluminate-typed Aerosol Catalysts[J]. Acta Phys. -Chim. Sin., 2008,24(02): 211-216
249. GENG Li-Na; KANG Ning; NING Zhou-Yun; WU Li-Qing; LI Yan; SUN Li-Quan; LUO Ai-Qin.Solid Phase Extraction of Dropropizine Using Molecularly Imprinted Polymers[J]. Acta Phys. -Chim. Sin., 2008,24(01): 25-31
250. DING Bing-Jing; HUANG Shi-Ping; WANG Wen-Chuan.Dimerization of Ethene Catalyzed by Acidic Zeolites[J]. Acta Phys. -Chim. Sin., 2007,23(12): 1864-1868
251. MA Chun-An; WANG Xiao-Juan; LI Guo-Hua; LI Mei-Chao; CHEN Song.Electroreduction Characteristics of Nitromethane in Ionic Liquid BMImBF4[J]. Acta Phys. -Chim. Sin., 2007,23(11): 1719-1722
252. JIANG Yong; CHU Wei; JIANG Cheng-Fa; WANG Yao-Hong.A DFT Study of Pdn(n=1-7) Clusters and Their Interactions with CH4 Molecule[J]. Acta Phys. -Chim. Sin., 2007,23(11): 1723-1727
253. WANG Hua-Sheng; KVARAN Agust.REMPI Spectra of the Hydrogen Halides[J]. Acta Phys. -Chim. Sin., 2007,23(10): 1543-1552
254. YANG Zhong-Zhi; CUI Bao-Qiu.Dynamic Simulations of the Hydrogen-bondings on the Proximal Side of the Heme in Terms of ABEEM/MM Method[J]. Acta Phys. -Chim. Sin., 2007,23(09): 1332-1336
255. MA Na; JI Sheng-Fu; WU Ping-Yi; HU Lin-Hua; NIE Ping-Ying.Preparation, Characterization and Catalytic Performance for Hydrodesulfurization of WxC/SBA-16 Catalysts[J]. Acta Phys. -Chim. Sin., 2007,23(08): 1189-1194
256. YUAN Hao; LI Qing-Hua; SHA Fei; XIE Li-Li; TIAN Zhen; WANG Li-Jun.Application of Ultraviolet Treatment in the Synthesis of Pure-silica Zeolite Thin Films with Low Dielectric Constant[J]. Acta Phys. -Chim. Sin., 2007,23(08): 1219-1223
257. LI Shu; LIU Lei; CAO Zhen; WANG Ji-Qiang; YAN Tian-Ying.Molecular Dynamics Simulation on a Eutectic Systemof LiTFSI/Urea[J]. Acta Phys. -Chim. Sin., 2007,23(07): 983-986
258. CHEN Yu-Ping; LU Ling-Hong; SHAO Qing; HUANG Liang-Liang; LU Xiao-Hua.Adsorption and Diffusion of Alkanes in Mordenite[J]. Acta Phys. -Chim. Sin., 2007,23(06): 905-910
259. YUAN Yong-Zhi; XIONG Hai-Ling; LI Hang; ZHU Hua-Ling; JIANG Xian-Jun.Effect of Gravity and Electrolyte Concentration on the Fractal Structure of Colloidal Aggregates[J]. Acta Phys. -Chim. Sin., 2007,23(05): 688-694
260. ZHANG Xiao-Fei; HU Rui-Sheng; GAO Guan-Jun; MENG He; SU Hai-Quan.Influence of Two Complexants on Structure and Performance of Ce-Sn-O Complex Oxides[J]. Acta Phys. -Chim. Sin., 2007,23(05): 659-663
261. PENG Chuan-Xiao; WANG Li; ZHANG Yan-Ning.Amorphization of Ni Nanowires Induced by Strain Rate[J]. Acta Phys. -Chim. Sin., 2007,23(04): 517-520
262. ZENG Yong-Ping;JU Shen-Gui;XING Wei-Hong;CHEN Chang-Lin.Adsorption of Mixtures of Thiophene, Benzene and n-hexane in MFI and MOR Using Molecular Simulation[J]. Acta Phys. -Chim. Sin., 2007,23(03): 343-348
263. ZHANG Xiu-Qing;YUAN Shi-Ling;XU Gui-Ying;LIU Cheng-Bu.Mesoscopic Simulation of the Phase Separation on Triblock Copolymer in Aqueous Solution[J]. Acta Phys. -Chim. Sin., 2007,23(02): 139-144
264. HU Ze-Shan;FU Min;WEI Xiao-Ping;SHAO Ming-Hao.Influence of Polydispersity on the Absorbance Spectra of ZnO Nanoparticles[J]. Acta Phys. -Chim. Sin., 2007,23(01): 59-63
265. YANG Zhen;XU Zhi-Jun;YANG Xiao-Ning.Structures of Binary Hard-core Repulsive Yukawa Mixtures Near Solid Surfaces from DFT[J]. Acta Phys. -Chim. Sin., 2006,22(12): 1460-1465
266. LIU Yong-Ming;LI Gui-Zhi;SONG Wan-Kun;WANG Jin-Jun.Molecular Simulation and Interaction between Human Serum Albumin and Topotecan Hydrochloride[J]. Acta Phys. -Chim. Sin., 2006,22(12): 1456-1459
267. HU Wei;LUO Qing;LI Shen-Hui;SHEN Wan-Ling;YUE Yong;DENG Feng.Base-induced Brönsted Acid Sites on Dealuminated HY Zeolite: A Solid-state NMR Spectroscopy Study[J]. Acta Phys. -Chim. Sin., 2006,22(10): 1233-1237
268. CAO Chen-Zhong;ZENG Rong-Jin.Effect of Electronegativity and Polarizability on the C 1s Core Ionization Energies of Halomethanes[J]. Acta Phys. -Chim. Sin., 2006,22(09): 1085-1089
269. TANG Ke;SONG Li-Juan;DUAN Lin-Hai;LI Xiu-Qi;GUI, Jian-Zhou;SUN Zhao-Lin.Deep Desulfurization by Selective Adsorption on Heteroatom Zeolite Prepared by Secondary Synthesis[J]. Acta Phys. -Chim. Sin., 2006,22(09): 1116-1120
270. ZHOU Zhen;YAN Tian-Ying;GAO Xue-Ping.Simulation and Design for Energy Storage Materials[J]. Acta Phys. -Chim. Sin., 2006,22(09): 1168-1174
271. JIN Chun;JIA Yin-Juan;Wang Bao-Jun;FAN Bin-Bin;MA Jing-Hong;LI Rui-Feng.Epoxidation of Styrene Catalyzed by Zeolite-encapsulated Symmetrical and Unsymmetrical Co(II)Salen-type Schiff Base Complexes[J]. Acta Phys. -Chim. Sin., 2006,22(08): 947-952
272. HOU Si-Cong;LIU Ling-Tao;KOU Yuan.Li-ZnO/La2O3 Catalyst for the Oxidation Coupling of Methane at Low Temperature[J]. Acta Phys. -Chim. Sin., 2006,22(08): 1040-1042
273. HOU Huai-Yu;CHEN Guo-Liang;CHEN Guang.Molecular Dynamics Simulation of the Structure Transformation before and after Ni Melting[J]. Acta Phys. -Chim. Sin., 2006,22(07): 771-776
274. HU Jun;WANG Jian-Jun;ZHOU Li-Hui;XIE Song-Hai;LIU Hong-Lai.The Mechanism of Mesoporous Phase Transition of Titanic-Silica Mesoporous Materials[J]. Acta Phys. -Chim. Sin., 2006,22(06): 679-683
275. ZHOU Dan-Hong;WANG Yu-Qing;HE Ning;YANG Gang.The π-complexation Mechanisms of Cu(I), Ag(I)/Zeolites for Desulfurization[J]. Acta Phys. -Chim. Sin., 2006,22(05): 542-547
276. GUO Xiang-Dan; HUANG Shi-Ping; TENG Jia-Wei; XIE Zai-Ku.Study on the Adsorption of Water on NanZSM-5 Type Zeolite: Molecular Simulation[J]. Acta Phys. -Chim. Sin., 2006,22(03): 270-274
277. XU Jun-bo; WU Hao; LU Dong-yun; HE Xian-feng; WEN Hao.Dissipative Particle Dynamics Simulation on the Meso-scale Structure of Diblock Copolymer Film[J]. Acta Phys. -Chim. Sin., 2006,22(01): 16-21
278. JU Yan-a; SHEN Zhi-hong; ZHAO Jia; ZHAO Jun-qiao; WANG Xiu-lin.Characterization of Framework Hetero-atom (B, Ti, Fe) in Y-type Zeolite[J]. Acta Phys. -Chim. Sin., 2006,22(01): 28-32
279. WANG Da-wang; MA Teng-cai; CUI Jin-hua.Methane Coupling in Atmospheric Pressure Glow Discharge Plasma with a Rotary Helix Electrode[J]. Acta Phys. -Chim. Sin., 2005,21(11): 1291-1294
280. LIU Chun-li; LI Chun-hua; CHEN Wei-zu; WANG Cun-xin.Study on Interaction between HIV-1 Integrase and Its Dicaffeoyl Inhibitors through Molecular Modeling Approach[J]. Acta Phys. -Chim. Sin., 2005,21(11): 1229-1234
281. WU Xiao-ping; LIU Zhi-ping; WANG Wen-chuan.Molecular Dynamics Simulation of Gas Solubility in Room Temperature Ionic Liquids[J]. Acta Phys. -Chim. Sin., 2005,21(10): 1138-1142
282. ZHUANG Wen-chang; CHEN Xiao; YANG Chun-jie; WANG Lu-yan; CHAI Yong-cun.Study of Ordering for AOT/Water Lamellar Lyotropic Liquid Crystal: Small-angle X-ray Scattering Experiments[J]. Acta Phys. -Chim. Sin., 2005,21(09): 1055-1058
283. WU Xiao-ping; LIU Zhi-ping.Computer Simulation Study of the Mixtures of Room Temperature Ionic Liquid [bmim][BF4] and Water[J]. Acta Phys. -Chim. Sin., 2005,21(09): 1036-1041
284. FANG Mei-juan; LUO Shu-na; WANG He-qing; LIU Wan-yun; ZHAO Yu-fen.The Effect of Phosphoryl Oxygen on the Intermolecular Action of Alanine and Lysozyme[J]. Acta Phys. -Chim. Sin., 2005,21(09): 1042-1045
285. LI Hui-ying; PU Min; CHEN Biao-hua.DFT Study on Double-bond Isomerization of trans-2-butene Catalyzed by Zeolites[J]. Acta Phys. -Chim. Sin., 2005,21(08): 898-902
286. JIN Sheng-ming; QIU Guan-zhou; YANG Hua-ming; DENG Zhen-xia.Preparation of HMS and AlSBA Mesoporous Materials from Sepiolite[J]. Acta Phys. -Chim. Sin., 2005,21(07): 796-799
287. LI Yong-Xin; GUO Yu-Hua; JI Yong-Qiang.Catalytic Activity of M/(MgO)y(CeO2)1-y (M=Ni, Co, Cu) Catalysts for Methane Combustion[J]. Acta Phys. -Chim. Sin., 2005,21(05): 468-473
288. ZHANG Ai-Long; LIU Rang-Su; LIANG Jia; ZHENG Cai-Xing.A Simulation Study for Effects of Cooling Rate on Evolution of Microstructures during Solidification Process of Liquid Metal Ni[J]. Acta Phys. -Chim. Sin., 2005,21(04): 347-353
289. JIA Yu-Xiang; GUO Xiang-Yun.Monte Carlo Simulation of Adsorption Process of CO and H2 in Supercritical Fluids[J]. Acta Phys. -Chim. Sin., 2005,21(03): 306-309
290. ZHENG Jun-Lin; ZHAI Shang-Ru; YANG Dong-Jiang; ZHANG Ye; WU Dong; SUN Yu-Han.Comparison on the Catalytic Cracking and Alkylation Activities between MSU-SMFI and MCM-41 Aluminosilicates[J]. Acta Phys. -Chim. Sin., 2005,21(03): 324-327
291. ZHANG Tao;GU Ting-Kun;QI Yuan-Hua.Evolvement on the Microstructure of Molten Compound AuCu3 in Rapid Cooling[J]. Acta Phys. -Chim. Sin., 2005,21(02): 173-176
292. LIU Ying-Chun;WANG Qi;LÜ Ling-Hong;ZHANG Lian-Zhong.Structural and Diffusion Properties of Water in Hydrophobic Micropores by Molecular Simulation[J]. Acta Phys. -Chim. Sin., 2005,21(01): 63-68
293. Yang Bing; Zhang Hai-Quan; Xu Hai; Zheng Yan; Yu Jing-Sheng; Ma Yu-Guang; Shen Jia-Cong.A Theoretical Investigation of Conformation and Electronic Structure of Poly(m-phenylene) and Its Derivatives[J]. Acta Phys. -Chim. Sin., 2004,20(12): 1476-1480
294. Jiang Zheng;Hou Hong-Xia;Hao Zheng-Ping;Kang Shou-Fang;Li Jin-Jun;Hu Chun.Effects of La Incorporation in Ba1xLaxFeAl11O19δ on the Performance of Methane Catalytic Combustion[J]. Acta Phys. -Chim. Sin., 2004,20(11): 1313-1319
295. Le Yuan; Chen Jian-Feng; Wang Wen-Chuan.Determination of Pore Size Distribution of Silica Hollow Microspheres by Experiment and Simulation[J]. Acta Phys. -Chim. Sin., 2004,20(11): 1303-1307
296. Dai Zhi-Hui;Ju Huang-Xian.Direct Electron Transfer of Protein Immobilized on Mesoporous Molecular Sieves Matrix[J]. Acta Phys. -Chim. Sin., 2004,20(10): 1262-1266
297. Song Ji-Guo;Shen Pei-Kang.Electrochemical Characterization of Copper Paratolylsulfonate[J]. Acta Phys. -Chim. Sin., 2004,20(10): 1216-1220
298. Lian Wen-Hao;Zheng Ying;Wang Xu-Xu;Fu Xian-Zhi.Preparation and Property of a MCM-41 Surface Neopentyl-titanium and Surface Titanium Oxides[J]. Acta Phys. -Chim. Sin., 2004,20(09): 1138-1143
299. Liu Rang-Su;Liu Feng-Xiang;Dong Ke-Jun;Zheng Cai-Xing;Liu Hai-Rong;Peng Ping;Li Ji-Yong.Cluster Structions and Magic Number Characteristics during Solidification Process of Liquid Metal Al[J]. Acta Phys. -Chim. Sin., 2004,20(09): 1093-1098
300. Wang Cao;Kong Fan-Ao.Dissociation of Polyatomic Molecules in the Intense Femtosecond Laser Field[J]. Acta Phys. -Chim. Sin., 2004,20(08S): 1055-1062
301. Zhu Jian-Hua;Xu Yang;Wang Ying;Zhou Shi-Lu;Zhou Chun-Fang.Adsorption and Catalytic Degradation of Nitrosamines by Zeolites and Molecular Sieves[J]. Acta Phys. -Chim. Sin., 2004,20(08S): 946-952
302. Yuan Shi-Ling;Wu Rui;Cai Zheng-Ting.Dissipative Particle Dynamics Simulation on the Block Polymer in Aqueous Solution[J]. Acta Phys. -Chim. Sin., 2004,20(08): 811-815
303. Chen Hong-Lin;Shen Bao-Jian;Pan Hui-Fang.Physicochemical and Catalytic Properties of ZSM-5/Y Composite Zeolites Dealuminated by the Steaming[J]. Acta Phys. -Chim. Sin., 2004,20(08): 854-859
304. Xue Ke-Yi;Gao Qing-Yu;Liu Bing;Xu Liang-Qin.Dependence of the H2O2-Na2S2O3 Reaction on pH and [H2O2]0/[Na2S2O3]0[J]. Acta Phys. -Chim. Sin., 2004,20(07): 772-775
305. Guan Li-Li;Duan Lian-Yun;Xie You-Chang.The Adsorptive Separation of N2 and Ar by Some Zeolites Highly Exchanged with Li[J]. Acta Phys. -Chim. Sin., 2004,20(07): 684-689
306. Liu Jie-Xiang;Dong Mei;Qin Zhang-Feng;Wang Jian-Guo.Molecular Simulation of Dichlorobenzene Sorption in AlPO4-5Molecular Sieves[J]. Acta Phys. -Chim. Sin., 2004,20(07): 696-700
307. Huang Jian-Hua;Zhu Chao-Ying;Luo Meng-Bo.Monte Carlo Simulation on Surfactant-Polymer Mixed System[J]. Acta Phys. -Chim. Sin., 2004,20(07): 690-695
308. Wei Ke-Cheng;Lu Dong-Yun;Zhou Han;Xu Wei;Wen Hao;Xu Zhi-Hong.Mesoscale Simulation for Succinimide Dispersant Systems[J]. Acta Phys. -Chim. Sin., 2004,20(06): 602-607
309. Cui Jin-Hua;Xu Gen-Hui;Liu Chang-Jun.Novel Plasma Reactor with Rotary Multi-tip Electrode Used in CH4 Coupling[J]. Acta Phys. -Chim. Sin., 2004,20(05): 557-560
310. Shi Xi-E;Zhai Shang-Ru;Dai Li-Yi;Shan Yong-Kui;He Ming-Yuan;Wei Wei;Wu Dong;Sun Yu-Han.Synthesis of Mesoporous Aluminosilicate Nanoparticles and Its Performance in Catalytic Cracking[J]. Acta Phys. -Chim. Sin., 2004,20(03): 265-270
311. Liu Xin;Meng Chang-Gong;Liu Chang-Hou.Melting and Superheating of Ag at High Heating Rate[J]. Acta Phys. -Chim. Sin., 2004,20(03): 280-284
312. Shao Jun;Xu Hua;Lu Wen-Cong;Chen Nian-Yi.Transport Property Anomalies under High Pressure in Molten Na2O-SiO2 Binary System Studied by Molecular Dynamics Simulation[J]. Acta Phys. -Chim. Sin., 2004,20(03): 237-239
313. Yin Kai-Liang;Xu Duan-Jun;Xia Qing;Ye Ya-Jing;Wu Guo-Ying;Chen Cheng-Lung.Molecular Dynamics Simulation on Solidification Process of n-hexadecane Systems[J]. Acta Phys. -Chim. Sin., 2004,20(03): 302-305
314. Nie Chun-Fa;Suo Ji-Shuan.Synthesis,Characterization and Catalytic Applications of Asymmetric Hydrogenation Catalyst Immobilized on Hybrid MCM-41[J]. Acta Phys. -Chim. Sin., 2004,20(02): 149-153
315. Guo Ming;Yan Jian-Wei;Yu Qing-Sen;Shang Zhi-Cai;Lü Jian-De.Characterization of Interaction between Gatifloxacin and Bovine Serum Albumin[J]. Acta Phys. -Chim. Sin., 2004,20(02): 202-206
316. Liu Lei;Zhang Gao-Yong;Dong Jin-Xiang.Effects of Different Templating Agent on the Structure of Silica MCM-41 Mesoporous Molecular Sieves[J]. Acta Phys. -Chim. Sin., 2004,20(01): 65-69
317. Xia Ke;Hou Ting-Jun;Xu Xiao-Jie;Shen Xing-Hai.Molecular Modeling of DPH-Cyclodextrins Nanotube-type Aggregate[J]. Acta Phys. -Chim. Sin., 2004,20(01): 5-8
318. Chen Ji-Xiang;Qiu Ye-Jun;Zhang Ji-Yan;Su Wan-Hua.Influence of La2O3 and CeO2 Promoters on Physico-chemical Properties and Catalytic Performance of Ni/MgO Catalyst in Methane Reforming with Carbon Dioxide[J]. Acta Phys. -Chim. Sin., 2004,20(01): 76-80
319. Qin Xu-Bo;Zhang Yan-Ning;Lu Jian-Lin.The Ability of Glass Formation Dominated by the Mismatch in Atomic Size[J]. Acta Phys. -Chim. Sin., 2003,19(12): 1163-1166
320. Sun Zhi-Wei;Zhu Ru-Zeng;Li Yin-Mei;Xu Sheng-Hua;Lou Li-Ren.Dependence of Collision Frequency on Distance between Two Hard-sphere Particles Estimated by Computer Simulation[J]. Acta Phys. -Chim. Sin., 2003,19(11): 1081-1084
321. Li Yi-Ming;Yuan Shi-Ling;Xu Gui-Ying.Applications of Computer Simulation in the Study of Surfactant System[J]. Acta Phys. -Chim. Sin., 2003,19(10): 986-992
322. Zheng Jun-Lin;Zhang Ye;Wei Wei; Wu Dong;Sun Yu-Han;Deng Feng;Luo Qing;Yue Yong.Hydrothermally Stable Mesoporous Aluminosilicates with Strongly Acidic Sites[J]. Acta Phys. -Chim. Sin., 2003,19(10): 907-912
323. Liu Rang-Su;Liu Feng-Xiang;Li Ji-Yong;Dong Ke-Jun;Zheng Cai-Xing.Effects of Thermal History of Liquid Metal Al on Its Solidification Microstructures[J]. Acta Phys. -Chim. Sin., 2003,19(09): 791-794
324. Zhang Hua-Bei;Dai Mei;Liu Chun-Ping.QSAR Studies of Novel Pyridylamine Ligands for the Nicotinic Acetylcholine Receptor[J]. Acta Phys. -Chim. Sin., 2003,19(09): 871-874
325. Liu Xin;Meng Chang-Gong;Liu Chang-Hou.Heating Rate Induced Melting and Superheating of Pb[J]. Acta Phys. -Chim. Sin., 2003,19(08): 681-685
326. Wang Shun;Gao Qing-Yu;Wang Xin-Hong;Lin Juan-Juan;Lai Shun-An;Mo Yan-Xue.Complex Kinetics of the Chlorite-Thiosulfate in an Unbuffered Reaction System[J]. Acta Phys. -Chim. Sin., 2003,19(08): 762-765
327. Yu Yong-Hui;Li Chun-Hua;Lu Ben-Zhuo;Chen Wei-Zu;Wang Cun-Xin.A New Method to Select the Near-native Conformations from the Docked Structures[J]. Acta Phys. -Chim. Sin., 2003,19(08): 757-761
328. Zhang Tao;Zhang Xiao-Ru;Wu Ai-Ling;Guan Li;Xu Chang-Ye.Molecular Dynamics Simulations of the Heating and Melting Processes of Metal Cu[J]. Acta Phys. -Chim. Sin., 2003,19(08): 709-713
329. Tang Xiao-Ping;Wang Su-Fan;Gao Li-Rong;Wang Cao;Kong Fan-Ao.Dissociation of Methane in Intense Femtosecond Laser Field[J]. Acta Phys. -Chim. Sin., 2003,19(07): 661-665
330. Cheng Zhi-Lin;Chao Zi-Sheng;Wan Hui-Lin.Nanosized NaY Zeolite Synthesized Rapidly by Microwave Induction[J]. Acta Phys. -Chim. Sin., 2003,19(06): 487-491
331. Piao Ling-Yu;Li Yong-Dan.Structure of Carbon Nanotubes from Decomposition of Methane on an Aerogel Catalyst[J]. Acta Phys. -Chim. Sin., 2003,19(04): 347-351
332. Wang Zhe-Ming;Yan Zi-Feng.Skeletal Isomerization of Butene on Si, Zr-substituted Aluminum Phosphate Zeolites[J]. Acta Phys. -Chim. Sin., 2003,19(03): 216-220
333. Zhou Chang-Jun;Lin Wei;Zhu Yue-Xiang;Xie You-Chang.Sulphur Poisoning Mechanism of SnO2 Based Catalysts for Methane Combustion[J]. Acta Phys. -Chim. Sin., 2003,19(03): 246-250
334. Zhai Shang-Ru;Pu Min;Zhang Ye;Wu Dong;Sun Yu-Han.High-Yield Synthesis of MCM-48 Using Mixed Surfactants and Adjusting pH Route[J]. Acta Phys. -Chim. Sin., 2003,19(02): 167-170
335. Zhou Guo-Rong;Wu You-Shi;Zhang Chuan-Jiang;Zhao Fang.Molecular Dynamics Simulations of the Effect of Icosahedral Quasicrystal on the Formation of Amorphous[J]. Acta Phys. -Chim. Sin., 2003,19(01): 13-16
336. Zhang Yan-Ning;Wang Li;Bian Xiu-Fang.Melting of Au Nanoclusters by Molecular Dynamics Simulation[J]. Acta Phys. -Chim. Sin., 2003,19(01): 35-39
337. Wang Jun-Wei;Xu Jin-Guang;Tian Zhi-Jian;Xu Yun-Peng;Xu Zhu-Sheng;Lin Li-Wu.Effect of Introduction of Ba, Mn on Thermal Stability and Catalytic Activity to Methane Combustion of Al2O3[J]. Acta Phys. -Chim. Sin., 2002,18(11): 1018-1022
338. Guan Li-Li;Duan Lian-Yun;Xie You-Chang.Adsorptive Separation of N2 and Ar by some Zeolites Exchanged with Ca2+[J]. Acta Phys. -Chim. Sin., 2002,18(11): 998-1004
339. Bi Zhi-Chu;Liao Wen-Sheng.Wettability Changes by CTAB Adsorption at Surfaces of SiO2 Film or Silica Gel Powder and Mimic Oil Recovery[J]. Acta Phys. -Chim. Sin., 2002,18(11): 962-966
340. Yan Zhen;Kou Yuan.Homogeneous Partial Oxidation of Methane Catalyzed by NOx under Oxidizing Conditions[J]. Acta Phys. -Chim. Sin., 2002,18(11): 1048-1051
341. Zhou Ling-Ping;Li Wei;Tao Ke-Yi;Li He-Xuan;Li Xuan-Wen.The Stability with Time-on-Stream of NaBr-Promoted KY Zeolite Catalyst for the Oxidative Methylation of Toluene with Methane[J]. Acta Phys. -Chim. Sin., 2002,18(10): 916-919
342. Zhang Xian-Ren;Wang Wen-Chuan.Molecular Simulation on Adsorption of Methane in Mesopore MCM-41[J]. Acta Phys. -Chim. Sin., 2002,18(08): 680-685
343. Zou Ji-Jun;Li Yang;Zhang Yue-Ping;Liu Chang-Jun.Product Distribution of Conversions of Methane and Carbon Dioxide Using Dielectric Barrier Discharge[J]. Acta Phys. -Chim. Sin., 2002,18(08): 759-763
344. Ji Yong-Qiang;Feng Wen-Lin;Hao Mao-Rong;Li Hui-Ying.The Reaction Path and Varitional Rate Constant of the Reaction CH3+CH3NO2→CH4+CH2NO2[J]. Acta Phys. -Chim. Sin., 2002,18(08): 721-726
345. Cong Hong-Ri;Bian Xiu-Fang;Li Xi-Zhen;Li Hui.MD Simulation of Liquid Al80Fe20 Alloy during Rapid Cooling[J]. Acta Phys. -Chim. Sin., 2002,18(05): 414-419
346. Wang Li;Yi Su;Bian XiuFang.Atom Clusters in Liquid and Amorphous of Ni3Al Alloy[J]. Acta Phys. -Chim. Sin., 2002,18(04): 297-301
347. Cui Jin-Hua;Xu Gen-Hui;Han Sen.Eliminating Coke Formed in CH4 Coupling under Plasma via Pure H2 Discharge in the System[J]. Acta Phys. -Chim. Sin., 2002,18(03): 276-278
348. Song Chun-Min;Yan Zi-Feng;Max Lu.Synthesis and Characterization of Supersurface MCM-41 Zeolites[J]. Acta Phys. -Chim. Sin., 2002,18(03): 279-283
349. Zhou Jian;Zhu Yu;Wang Wen-Chuan;Lu Xiao-Hua;Wang Yan-Ru;Shi Jun.Molecular Dynamics Study of Supercritical Aqueous Sodium Chloride Solutions[J]. Acta Phys. -Chim. Sin., 2002,18(03): 207-212
350. He Ming-Feng;Kang Zhe-Wen;Feng Tao;Han Xiao-Jun.Optimum Configuration of Bicatalysts for A-B2 Reactions[J]. Acta Phys. -Chim. Sin., 2002,18(02): 137-141
351. Cong Hong-Ri;Bian Xiu-Fang;Li Hui;Wang Li.Mediumrange Order Structure in Liquid Al80Fe20Alloy[J]. Acta Phys. -Chim. Sin., 2002,18(01): 39-44
352. Xu Hua;Shao Jun.Molecular Dynamics Simulation of Fast Li Conduction in Fluoroborate Glasses[J]. Acta Phys. -Chim. Sin., 2002,18(01): 10-13
353. Guo Rong;Liu Wei-Ya;Fan Guo-Kang.Interaction of Malachite Green with CTAB Micelles[J]. Acta Phys. -Chim. Sin., 2001,17(12): 1062-1066
354. Yao Yun-Feng;Zhang Mai-Sheng;Yang Yan-Sheng.Synthesis of Nano-sized MCM-41 Mesoporous Molecular Sieve by[J]. Acta Phys. -Chim. Sin., 2001,17(12): 1117-1121
355. Fan Shan-Hu;Yu Xiang-Yang;Zhan She-Xia;Chen Liu-Ping;Gu Xi-Lan;Li Yu-Guang;Shi Zhong-Bing.Kinetics Modeling Study on Continuous Circulative Flow Immobilized Photocatalytic Reactor[J]. Acta Phys. -Chim. Sin., 2001,17(11): 1000-1005
356. Cao Da-Peng;Wang Wen-Chuan;Shen Zhi-Gang;Chen Jian-Feng.Determination of Optimum Pressure for Supercritical Methane Adsorbed in Nano-material[J]. Acta Phys. -Chim. Sin., 2001,17(10): 940-943
357. Yang Yong-Lai;Xu Heng-Yong;Li Wen-Zhao.Study on Carbon Deposition of CH4,C2H6 and C2H4 Cracking over Ni-based Catalysts[J]. Acta Phys. -Chim. Sin., 2001,17(09): 773-775
358. Zhou Chang-Jun;Zhu Yue-Xiang;Xie You-Chang.Catalytic Combustion of Methane over Tin Dioxide Supported Silver Catalysts[J]. Acta Phys. -Chim. Sin., 2001,17(09): 850-854
359. Yan Qian-Gu;Luo Chun-Rong;Weng Wei-Zheng;Yang Le-Fu;Wan Hui-Lin;Wu Ting-Hua.Activation of Methane over Ni/TiO2 Catalyst[J]. Acta Phys. -Chim. Sin., 2001,17(08): 733-738
360. Zhou Jian;Wang Wen-Chuan.Gibbs Ensemble Monte Carlo Simulation of Adsorption Equilibrium of Methane[J]. Acta Phys. -Chim. Sin., 2001,17(08): 723-727
361. Liu Zhen-Lin;Meng Ming;Fu Yi-Lu;Jiang Ming;Hu Tian-Dou;Xie Ya-Ning;Liu Tao.Structure Characterization of γ-Mo2N and Mo Nitrides Supported on Zeolites[J]. Acta Phys. -Chim. Sin., 2001,17(07): 631-635
362. Liu Xin-Mei;Yan Zi-Feng;Wang Huai-Ping.Optimization of Zeolite for Producing Lighter Olefin and Diesel in FCC Process[J]. Acta Phys. -Chim. Sin., 2001,17(06): 547-551
363. Liang Shi-Qiang;Zhang Bing-Jian;Lu Ying-Hong;Hu Wen-Xuan;Jin Zhi-Jun.New Perturbation Theory Model for Chainlike Molecule Fluid and the Predicted Heat Capacity[J]. Acta Phys. -Chim. Sin., 2001,17(05): 416-421
364. Lu An-Hui;Li Wen-Cui;Zheng Jing-Tang.Preparation of PANbased Molecular Sieve ACF and Study of Surface Structure by XPS[J]. Acta Phys. -Chim. Sin., 2001,17(03): 216-221
365. Xin Jing;Suo Ji-Shuan;Zhang Xiao-Ming;Ren Tong;Yan Liang;Zhang Han-Peng.Novel Templating Route to Mesoporous Silica Molecular Sieves[J]. Acta Phys. -Chim. Sin., 2001,17(03): 193-195
366. Ji Ya-Ying;Li Wen-Zhao;Xu Heng-Yong;Chen Yan-Xin.Study on the Ignition Process for the Catalytic Partial Oxidation of Methane to Synthesis Gas by MS-TPSR Technique[J]. Acta Phys. -Chim. Sin., 2001,17(03): 201-205
367. Guo Rong;Fan Guo-Kang;Liu Tian-Qing;Jiao Xin-An.The Interaction of Methylene Blue and Bovine Serum Albumin in SDS Micelle System[J]. Acta Phys. -Chim. Sin., 2001,17(02): 185-188
368. Wang Xu-Xu;Fu Xian-Zhi.Reaction of Surface Hydroxyl Group of MCM41 with Tetraneopentylzirconium[J]. Acta Phys. -Chim. Sin., 2001,17(02): 165-168
369. Gong Yan-Jun;Li Zhi-Hong;Wu Dong;Sun Yu-Han.Interface Characteristics of Organo-MSU-x Silica[J]. Acta Phys. -Chim. Sin., 2001,17(01): 1-4
370. Su Wen-Yue;Fu Xian-Zhi;Wei Ke-Mei.Effect of Sulfation on Structure and Photocatalytic Performance of TiO2[J]. Acta Phys. -Chim. Sin., 2001,17(01): 28-31
371. Zhu Li-Li, Hou Ting-Jun, Xu Xiao-Jie.Computer Simulation Studies of the Adsorption Behacisrs of Xylenes in ITQ-1 Zeolite[J]. Acta Phys. -Chim. Sin., 2000,16(11): 981-986
372. Ng Seikweng, Hu Sheng-Zhi.The Spce Groups of Some Lanthanum Complexes[J]. Acta Phys. -Chim. Sin., 2000,16(10): 879-885
373. Zhang Yu, Jin Xin-Yu, Chen Kang-Sheng.Simulation Analysis of Active Particles in Plasma Polymerization Film Deposition[J]. Acta Phys. -Chim. Sin., 2000,16(10): 892-898
374. Wang Li, Bian Xiu-Fang, Li Hui.Liquid-Solid Transition and Crystal Growth of Metal Cu by Molecular Dynamics Simulation[J]. Acta Phys. -Chim. Sin., 2000,16(09): 825-829
375. Ng Seikweng, Hu Sheng-Zhi.Space Groups of some Scandium Complexes[J]. Acta Phys. -Chim. Sin., 2000,16(09): 804-809
376. Zhu Ai-Min, Zhang Xiu-Ling, Gong Wei-Min, Zhang Bao-An.Study on Coupling of Methane under Pulse Corona Plasma in the Presence of Oxygen[J]. Acta Phys. -Chim. Sin., 2000,16(09): 839-843
377. Li Jian-Chang, Xue Zeng-Quan, Zhang Hao, Zeng Yan, Liu Wei-Min, Wu Quan-De.Chiral Fractal Patterns of TCNQ Thin Films Grown by Vacuum Evaporation[J]. Acta Phys. -Chim. Sin., 2000,16(07): 579-582
378. Ji Ming-Juan, Yang Peng-Cheng.Active Site in Met-enkephalin[J]. Acta Phys. -Chim. Sin., 2000,16(07): 596-600
379. Xu Hua, Shao Jun.Molecular Dynamics Simulation of the Phase Transition of α-berlinite under High Pressure[J]. Acta Phys. -Chim. Sin., 2000,16(06): 512-516
380. Chen Hong-Shan, Niu Jian-Zhong, Xia Chun-Gu, Li Shu-Ben.Raman Spectroscopy Characterization of Na-W-Mn/SiO2 Catalyst for Oxidative Coupling of Methane[J]. Acta Phys. -Chim. Sin., 2000,16(06): 543-546
381. Ji Ming-Juan, Yang Peng-Cheng, Ye Xue-Qi, Hou Ting-Jun, Xu Xiao-Jie.Adsorptive of Water Molecule in Model Zeolite[J]. Acta Phys. -Chim. Sin., 2000,16(06): 487-490
382. Li Jian-Chang, Song Yan-Lin, Xue Zeng-Quan, Liu Wei-Min, Jiang Lei, Zhu Dao-Ben.Microstructure and Electric Properties of Polyaniline-TCNQ Complex Thin Film Grown by Vacuum Evaporation[J]. Acta Phys. -Chim. Sin., 2000,16(04): 289-293
383. Jin Wen-Zheng, Wang Wen-Chuan.Monte Cario Simulation of the Chemical Potentials of N2-C6H6 Mixture[J]. Acta Phys. -Chim. Sin., 2000,16(03): 253-257
384. Li Chun-Yi, Yu Chang-Chun, Shen Shi-Kong.The Main Origin of CO2 in Partial Oxidation of Methane to syngas over a Ni/Al2O3 Catalyst[J]. Acta Phys. -Chim. Sin., 2000,16(02): 97-100
385. Shi Lei, Zhang Xiao-Gang, Zhang Xi-Feng, Yang Guan-Ying, Han Bu-Xing, Yan Hai-Ke.Study of Molecular lnteraction in Mixed Supercritical Fluids by Molecular Simulation and Partial Molar Volume Measurement[J]. Acta Phys. -Chim. Sin., 2000,16(01): 31-35
386. Ji Ming-Juan, Ye Xue-Qi, Yang Peng-Cheng.Molecular Dynamics Simulations for Met-enkephalin[J]. Acta Phys. -Chim. Sin., 1999,15(11): 1011-1016
387. Zhou Jian, Lu Xiao-Hua, Wang Yan-Ru, Shi Jun.Molecular Dynamics Simulation of Supercritical Water[J]. Acta Phys. -Chim. Sin., 1999,15(11): 1017-1022
388. Zhang Xiao-Gang, Li Yong-Wang, Zhong Bing, Peng Shao-Yi.Molecular Simulation in Hydrogen,Carbon Monoxide,Methanol and Hexane System[J]. Acta Phys. -Chim. Sin., 1999,15(11): 1036-1040
389. Cao Da-Peng, Wang Wen-Chuan.Simulation of Microscopic Structure of Propane Adsorbed in Slit Micropores[J]. Acta Phys. -Chim. Sin., 1999,15(07): 581-587
390. Zeng Jian-Qing, Zhang Jing-Cheng, Zhong Bing.Monte Carlo Simulation of CO Oxidation Reaction on Fractal Surface[J]. Acta Phys. -Chim. Sin., 1999,15(06): 555-559
391. Tang Xiao-Ming, Wei Sai-Zhen, Mao Zu-Sui, Li Hai-Yang, Chen Xiao-Feng, Zheng Yong-Ming.Fractal Characteristics of Film Surface[J]. Acta Phys. -Chim. Sin., 1999,15(05): 403-406
392. Li Jing-Sheng, Bian Xuan-Xia.Study on Mechanism of Breakage and Coalescence of Colloidal Aggregates at Steady-state under Shear[J]. Acta Phys. -Chim. Sin., 1999,15(05): 467-470
393. Jin Rong-Chao, Chen Yan-Xin, Cui Wei, Li Wen-Zhao, Yu Chun-Ying, Jiang Yi.Mechanism of Catalytic Partial Oxidation of Methane to Synthesis Gas on Nickel Catalyst[J]. Acta Phys. -Chim. Sin., 1999,15(04): 313-318
394. Zhang Zhao-Rong, Suo Ji-Shuan, Zhang Xiao-Ming, Li Shu-Ben.Novel Methods for the Synthesis of MCM-41 Mesoporous Molecular Sieves and the Recovery of Template[J]. Acta Phys. -Chim. Sin., 1999,15(04): 333-337
395. Chen Wang-Zhong, Zhang Shao-Wen, Hu Yuan-Dong, Xie Yun-De, Jiao Ke-Fang.The Aldol Condensation Mechanism of Acetone on Aluminum[J]. Acta Phys. -Chim. Sin., 1999,15(01): 40-43
396. Qiu Shi-Lun, Zhai Qing-Zhou, Xiao Feng-Shou, Zhang Zong-Tao, Han Yu.The Developments of the Studies of New Type Zeolite Molecular Sieve Host-nanoguest Composite Materials[J]. Acta Phys. -Chim. Sin., 1998,14(12): 1116-1122
397. Zhao Qi, Han Xiu-Wen, Liu Xiu-Mei, Zhai Run-Sheng, Lin Li-Wu, Bao Xin-He, Guo Xin-Wen, Li Gang, Wang Xiang-Sheng.Studies on the TS-1 Zeolites Synthesized by Tetrapropylammonium Bromide as Template[J]. Acta Phys. -Chim. Sin., 1998,14(10): 906-912
398. Liu Yan-Fang, Zhao Min, Shen Shi-Gang, Gao Jun-Gang.Curing Kinetics of Tetrabromo-bisphenol-a Epoxy Resin with Diaminodiphenyl Methane[J]. Acta Phys. -Chim. Sin., 1998,14(10): 927-931
399. Yang Peng-Cheng, Ye Xue-Qi, Ji Ming-Juan, Zhao Zhu-Liu, Zhang Zhuo-Ya, Hou Ting-Jun, Xu Xiao-Jie.The Study of Non-framework Cation Position in Zeolite Model[J]. Acta Phys. -Chim. Sin., 1998,14(09): 817-820
400. Jin Rong-Chao, Chen Yan-Xin, Li Wen-Zhao, Ji Ya-Ying, Qin Yong-Sheng, Jiang Yi.Ni/α-Al2O3 Catalyst for the Partial Oxidation of Methane to Syngas[J]. Acta Phys. -Chim. Sin., 1998,14(08): 737-741
401. Yang Peng-Cheng, Ye Xue-Qi, Ji Ming-Juan, Zhao Zhu-Liu, Zhang Zhuo-Ya, Hou Ting-Jun, Xu Xiao-Jie.Theoritical Study of the Al Atoms Positions in Zeolite Framework[J]. Acta Phys. -Chim. Sin., 1998,14(08): 686-690
402. Tang Xiao-Ming, Wei Sai-Zhen, Mao Zu-Sui, Chen Xiao-Feng, Zheng Yong-Ming.Study of the Relationship between Fractal Surface's Roughness and Light Scattering[J]. Acta Phys. -Chim. Sin., 1998,14(07): 585-589
403. Li Hui, Bian Xiu-Fang, Li Yu-Chen, Liu Hong-Bo, Chen Kui-Ying.The Molecular Dynamics Simulation of Liquid Noble Metal Au[J]. Acta Phys. -Chim. Sin., 1998,14(07): 630-634
404. Fan Xiao-Wei, Zhou Shao-Jie, Zhang Qing-Xiang, Deng Jing-Kang, Zheng Yan-You, Gao Nai-Fei, Chen Xue-Jun.Accurate Study of Valence Orbitals of Methane by Electron Momentum Spectroscopy[J]. Acta Phys. -Chim. Sin., 1998,14(06): 573-576
405. Zeng Jin-Long, Xiong Zhi-Tao, Lin Guo-Dong, Yu La-Jia, Zhang Hong-Bin.Spectroscopic Characterization of Mo/HZSM-5-based Catalysts for Dehydro-aromatization of Methane[J]. Acta Phys. -Chim. Sin., 1998,14(05): 394-400
406. Yin Dong-Hong, Yin Du-Lin.Study on the Solid-state Reaction of ZnCl2 and Y Zeolites under Microwave lrradiation[J]. Acta Phys. -Chim. Sin., 1998,14(05): 448-452
407. Wang Gui-Chang, Sun Yu-Han, Zhong Bing.Simulation to the Structure Sensitive of Cu Based catalyst for Methanol Synthesis[J]. Acta Phys. -Chim. Sin., 1998,14(04): 337-342
408. 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.Structure of Highly Siliceous ZSM-5 Zeolites and Ti-ZSM-5 Zeolites Obtained by Indirect Synthesis[J]. Acta Phys. -Chim. Sin., 1998,14(04): 320-326
409. Zhang Zhao-Rong, Suo Ji-Shuan, Zhang Xiao-Ming, Li Shu-Ben.A Novel Synthesis Method for MCM-41 Mesoporous Silica Molecular Sieves[J]. Acta Phys. -Chim. Sin., 1998,14(03): 243-248
410. Zeng Jian-Qing, Zhang Jing-Cheng, Zhong Bing.Monte Carlo Simulation of the Phase Transition and Self-oscillation in A+B2 Surface Catalytic Reaction[J]. Acta Phys. -Chim. Sin., 1998,14(02): 103-108
411. Shang Zhi-Cai,Yu Qing-Sen,Lin Rui-Sen.Monte Carlo Simulation Calculation of Volume and Surface Area of Molecule[J]. Acta Phys. -Chim. Sin., 1997,13(12): 1097-1100
412. Qi Xue-Yong,Wang Ya-Juan,Yang Kong-Zhang.XRD Studies on the Interaction between CrO3 and NaY、NaM Zeolites[J]. Acta Phys. -Chim. Sin., 1997,13(10): 938-941
413. Jiang Ming,Fu Yi-Lu.Characterization of Cu(I)Y Zeolites Prepared by Solid-state Ion Exchange[J]. Acta Phys. -Chim. Sin., 1997,13(09): 822-826
414. Zhu Xiao-Lei,Zhou Zhi-Hua,Lu Wen-Qing,Huang Jin-Fan,Peng Pan-Ying.A Possible New Solid Phase Observed from Molecular Dynamics Study of CBr4[J]. Acta Phys. -Chim. Sin., 1997,13(09): 815-821
415. Deng Feng,Dong Jin-Xiang,Du You-Ru,Ye Chao-Hui.Solid-state NMR Studies on AlPO4-5 Molecular Sieve with Al/P>1[J]. Acta Phys. -Chim. Sin., 1997,13(09): 780-785
416. Liu Wei-,Xu Yi-De,Li Li-Yun,Hu Hong-Bing.Study Mo/HZSM-5 Catalysts by NMR[J]. Acta Phys. -Chim. Sin., 1997,13(08): 693-699
417. Chen Ping-An,Dong Xian-Dui,Lu Jun-Tao;He Ping.The Model Analysis of Bipolar Electrode Polarization[J]. Acta Phys. -Chim. Sin., 1997,13(06): 489-492
418. Yuan Zhong-Yong,Chen Tie-Hong,Wang Jing-Zhong,Li He-Xuan.Study of the Formation Mechanism of Mesoporous Molecular Sieve MCM-41[J]. Acta Phys. -Chim. Sin., 1997,13(05): 452-454
419. Guo Xiang-Yun,Zhong Bing,Peng Shao-Yi.Determination of the Fractal Dimension of Particle Surface by Chemical Kinetic Method[J]. Acta Phys. -Chim. Sin., 1997,13(01): 52-55
420. Tian Yi-Ling,Xiao Yan-Fan,Zhu Hong-Xu,Dong Xi-Jing,Ren Xiao-Wen,Zhang Feng-Cai.Interfacial Tensions between Water and Non-polar Fluids at High Pressures and High Temperatures[J]. Acta Phys. -Chim. Sin., 1997,13(01): 89-95
421. Li Jing-Sheng,P.Mark Rodger.Characteristics of Colloidal Aggregates with Weakly Bound Potential under Shear[J]. Acta Phys. -Chim. Sin., 1997,13(01): 20-27
422. Li Jing-Sheng,P.Mark Rodger.Characteristics of Colloidal Aggregates with Many-body Effect[J]. Acta Phys. -Chim. Sin., 1997,13(01): 28-35
423. Fan Xiao-Wei,Zhou Shao-Jie,Zheng Yen-You,Chen Xue-Jun.Binding Energy Spectra and Electron Momentum Profiles of the Valence Shell for Methane[J]. Acta Phys. -Chim. Sin., 1996,12(12): 1106-1109
424. Kou Fu-Ping,Lin Hua-Kuan,Zhu Shou-Rong,Chen Rong-Ti.A Zinc(II) Complex of Tripyridylamine(TPA) as a Model for Carbonic Anhydrase[J]. Acta Phys. -Chim. Sin., 1996,12(09): 804-808
425. Zhang Wan-Jing,Ji Tian-Hao,Meng Xian-Ping,Liu Ying-Jun,Lin Bing-Xiong.Studies on the Synthesis and structure of Pd Clusters Encaged in Y-zeolite[J]. Acta Phys. -Chim. Sin., 1996,12(07): 609-614
426. Lei Yu,Cheng Zhao-Nian,Tang Ding-Yuan.A Study of Structure in β-BAB2O4 Melt by Molecular Dynamics Simulation[J]. Acta Phys. -Chim. Sin., 1996,12(06): 481-484
427. Lin Cheng-Zhi,Cai Xiao-Hai,Xie You-Chang.Study of Dispersion State of CuCl2 onto the Surface of NaY Zeolite[J]. Acta Phys. -Chim. Sin., 1996,12(06): 523-526
428. Chu Yan-Lai,Li Shu-Ben,Gong Hua,Chen Zheng-Shi.Active Phase and Reaction Mechanism of Methane Partial Oxidation on Ni-Cu-Al2O3 Catalysts[J]. Acta Phys. -Chim. Sin., 1996,12(05): 429-435
429. Wang Bi-Xun,Fu Yi-Lu,Fang Shu-Nong.A Study of [Cu-O-Cu]2+ Species on Cu-ZSM-5 Zeolite by in situ Infrared Spectroscopy[J]. Acta Phys. -Chim. Sin., 1995,11(11): 974-978
430. Yu Lin,Xu Yi-De,Guo Xie-Xian.A FT-IR Study on the Interaction of CH4 and O2 with the Surface of SrO-La2O3/CaO Catalysts[J]. Acta Phys. -Chim. Sin., 1995,11(10): 902-906
431. Cheng Zhao-Nian,Ding Hong,Lei Yu,Xu Li.A Study of Molecular Dynamics Simulation for Rubidium Chloride Melting[J]. Acta Phys. -Chim. Sin., 1995,11(10): 890-895
432. Zhang Fu-Shun,Wu Zhi-Yun,Kan Qiu-Bin.Study on IR Spectra of Ti-ZSM-11 Zeolite[J]. Acta Phys. -Chim. Sin., 1995,11(09): 836-839
433. Liu Rang-Su,Zhou Qun-Yi,Li Ji-Yong.A Molecular Dynamics Simulartion Study on the Structural Transitions in Liquid Metals[J]. Acta Phys. -Chim. Sin., 1995,11(08): 755-757
434. Liu Xin-Hua,Miao-Yin,Li Xiao-Li,Sheng Shi-Shan.Promoting Effect of La2O3 on Ni/γ-Al2O3 Methanstion Catalyst[J]. Acta Phys. -Chim. Sin., 1995,11(08): 746-750
435. Gu Jian-De,Tian An-Min,Yan Guo-Sen.Molecular Dynamics Simulations for the Spectra of N2 and O2 Aqueous Solutions[J]. Acta Phys. -Chim. Sin., 1995,11(08): 719-723
436. Chen Lai-Yuan,Xu Zhu-Sheng,Zhang Tao,Li Xin-Sheng,Lin Li-Wu.Structure of Mo/HZSM-5 Catalysts and Their Reactivities of Methane Dehydro-oligomerization under Non-oxidizing Conditions[J]. Acta Phys. -Chim. Sin., 1995,11(07): 601-606
437. Dai Min-Guang,Miao Rui-Ping.Studies on Binary Gas Solid Adsorption(IV)[J]. Acta Phys. -Chim. Sin., 1995,11(07): 596-600
438. Bao Jian-Bin,Han Shi-Jun.A Method for the Estimation of Infinite Dilution Activity Coefficient for a Real Solution by Monte Carlo Simulation[J]. Acta Phys. -Chim. Sin., 1995,11(06): 568-571
439. Gu Jian-De,Muhammad Ashraf Khan,Tian An-Min,Yan Guo-Sen.Quantum Correction for the Heat Capacity of Liquid Water[J]. Acta Phys. -Chim. Sin., 1995,11(06): 509-515
440. Li Si-Dian,Wang Shuang-He.Computer Simulation of the Surface Processes of fcc C60[J]. Acta Phys. -Chim. Sin., 1995,11(05): 470-472
441. Ji Min, Bi Ying-Li, Zhen Kai-Ji, Xu Yu-Hua, Wei Quan.The Study on Structures of CaO-La2O3 Catalysts by Fluorescence Emission of Eu3+[J]. Acta Phys. -Chim. Sin., 1995,11(02): 175-179
442. Huang Shi-Ping, Liu Hong-Lin, Ma Yan-Hui, Tang Bo, Chen Nian-Yi.Molecular Dynamics Simulation of ZnCl2 Melts[J]. Acta Phys. -Chim. Sin., 1995,11(01): 71-73
443. Xiong Guo-Xing, Xia Xin-Rui, Chen Heng-Rong, Guo Xie-Xian.Synergetic Effect between NaCl and B2O3 in Modified FeOχ Catalysts[J]. Acta Phys. -Chim. Sin., 1994,10(11): 971-977
444. Huang Shi-Ping, Ma Yan-Hui, Tang Bo, Xu Hua, Chen Nian-Yi.Molecular Dynamics Study of NaCl-NaBr Melt[J]. Acta Phys. -Chim. Sin., 1994,10(11): 1045-1048
445. Lai Lu-Hua, Wang Le-Yu, Deng Qiao-Lin, Han Yu-Zhen, Ma Li-Bin, Xu Xiao-Jie, Tang You-Qi.Constraint Monte-Carlo Simulated Annealing:Application in Peptide Conformational Analysis in Solution[J]. Acta Phys. -Chim. Sin., 1994,10(10): 867-869
446. Cheng Zhao-Nian, Jia Zheng-Ming, Xu Li, Chen Nian-Yi.Molecular Dynamics Simulations of Molten Salt Solutions NaCaF3, Na2CaF4 and Na3CaF5[J]. Acta Phys. -Chim. Sin., 1994,10(08): 676-679
447. Li Guang-Jin, Guo Xie-Xian, Fujimoto Toshiyuki, Ichikawa Masaru.Mechanismic Study of the Synthesis of Intrazeolite Pt Carbonyl Clusters[J]. Acta Phys. -Chim. Sin., 1994,10(08): 710-715
448. Zhao Zhen, Yuan Song-Yue, Yu Zuo-Long.Role of Lithium in Multicomponent Oxide Catalysts for Oxidative Coupling of Methane[J]. Acta Phys. -Chim. Sin., 1994,10(07): 616-622
449. Du Hong-Bin, Zhou Qun, Zhou Feng-Qi, Long Wen-Qin.Study on the Synthesis and Structure of Cu-ZSM-5 Type Molecular Sieve[J]. Acta Phys. -Chim. Sin., 1994,10(07): 635-638
450. Pan Jing-Jun, Han Bu-Xing, Yan Hai-Ke, Li Zhi-Fen, Liu Rui-Lin.Solubilities of Methane in Mixed Solvents of Water and t-butye Alcohol[J]. Acta Phys. -Chim. Sin., 1994,10(06): 501-507
451. Li Guang-Jin, Yang Ya-Shu, Guo Xie-Xian, Ichikawa Masaru.Dispersion of Catalysts Derived from Intrazeolite Pt Carbonyl Clusters[J]. Acta Phys. -Chim. Sin., 1994,10(06): 549-554
452. Deng Qiao-Lin, Lai Lu-Hua, Han Yu-Zhen, Miao Zhen-Wei, Ji Ai-Xue, Xu Xiao-Jie.Application of Simulated Annealing: Study on Relationship between Conformation of Linear Peptides and Their Cyclization Yields[J]. Acta Phys. -Chim. Sin., 1994,10(05): 444-448
453. Zhao Zhen, Yuan Song-Yue, Yu Zuo-Long.Study of Methane Oxidative Coupling over Ti-La-Li Mixed Oxides[J]. Acta Phys. -Chim. Sin., 1994,10(04): 324-329
454. Xie You-Chang; Wang Chuan-Bao; Tang You-Qi.Dispersion Capacities of KCl and NaCl in Zeolites[J]. Acta Phys. -Chim. Sin., 1993,9(06): 735-739
455. Wu Xiong-Wu; Shi Jun.A New Simulation Approach to the Entropy-related Properties of Fluids[J]. Acta Phys. -Chim. Sin., 1993,9(06): 740-745
456. Luo Xiao-Ming; Han Qiao-Feng; Chen Yi; Han Shi-Ying; Jin Tong-Zheng; Sui Yun-Xia.The Study of Adsorbed Oxygen Species on the Surface of a Series of Na2SnO3 Catalysts by epr Experiments[J]. Acta Phys. -Chim. Sin., 1993,9(06): 746-751
457. Wang De-Min; Zhan Tao; Shi Ping; Zhu Min-Hui; Ye Xue-Qi.Simulation of Crystal Structure of Bismuth System Superconductor by Emprical Potential Energy Function[J]. Acta Phys. -Chim. Sin., 1993,9(05): 584-588
458. Xu Chi; Li Ming; Chen Nian-Yi.Computerized Simulation of the Structure of NaAlO2 Melts[J]. Acta Phys. -Chim. Sin., 1993,9(05): 627-629
459. Zhao Da-Qing; Zhang Jian-Guo; Wu Yi-Jie; Pei Feng-Kui; Qiu Shi-Lun; Pang Wen-Qin.Study on Framework Structure of SAPO-5 Molecular Sieve[J]. Acta Phys. -Chim. Sin., 1993,9(05): 706-708
460. Song Mo; Ding En-Yong; Jin Jie; Xu Li-Hua.Scaling Behaviour, Fractals and Monte Carlo Simulation of Spinodal Decomposition in Polymer Blends[J]. Acta Phys. -Chim. Sin., 1993,9(05): 617-621
461. Yang Da-Lin; Ling Yun; Ding Chuan-Fan; Zhou You; Zhu Qi-He.Methyl Iodide Multiphoton Ionization Via à State or C State[J]. Acta Phys. -Chim. Sin., 1993,9(04): 442-446
462. Cheng Zhao-Nian; Jia Zheng-Ming; Zhang Jing; Chen Nian-Yi.Radial Distribution Functions of Molten CaF2[J]. Acta Phys. -Chim. Sin., 1993,9(04): 438-441
463. Ou Jin-Ru; Yu Yun-Lu; Lin Bing-Cheng; Lin Bing-Chang.Comparision Between Experiment and Formula Related the Retention time to Injection Concentration[J]. Acta Phys. -Chim. Sin., 1993,9(01): 111-116
464. Shao Shu-Min; Xi Guang-Kang; Wang Jun-Rong; Li Sheng-Lin; Yang Xue-Zhu; Wang Jin-He; Zhou Zhi-Qiang; He Tian-Xi; Yu Bao-Xia.Activated Chemisorption of CH4 On Ni Surface and La Film[J]. Acta Phys. -Chim. Sin., 1992,8(06): 767-771
465. Shan Shao-Chun; Shen Shao-Bo; Huang Min-Ming.Introduction of Vanadium into High-Silica Zeolited by Solid-State ion Exchange[J]. Acta Phys. -Chim. Sin., 1992,8(03): 339-344
466. Wang Jiang; Zhen Kai-Ji; Wei Quan; Bi Ying-Li.The Surface Properties of LaAlO3 Perovskite Oxides and Their Catalytic Activities[J]. Acta Phys. -Chim. Sin., 1992,8(02): 247-250
467. Zhan Ming-Sheng; Zhou Shi-Kang; Chu Yan-Nan; Song Fang-Qing; Yang Xin; Li Fang-Lin.Chemiluminescence and Dynamics of the Reaction F(2P)+CH2Br2[J]. Acta Phys. -Chim. Sin., 1992,8(02): 274-278
468. Zhao Xin-Sheng; Nathanson, Gilbert M.; Lee Yuan-The.Modeling Simulation of Secondary Processes in Photofragment-Translational Spectroscopy[J]. Acta Phys. -Chim. Sin., 1992,8(01): 70-81
469. Shao Jun; Tang Zheng-Quan.The Microscopic Holes and the Transportation Properties in LiCl Quenching Process Based Upon the Molecular Dynamics Simulation[J]. Acta Phys. -Chim. Sin., 1991,7(05): 553-557
470. Shao Jun; Tang Zheng-Quan.A Computer Simulation on Local Structure in LiCl Quenching Process——The Computation of the Voronoi Polyhedron for the Simuiation Unit Cell Extended with Periodic Boundary Condition[J]. Acta Phys. -Chim. Sin., 1991,7(05): 571-576
471. Cheng Zhao-Nian; Zhang Jing; Jia Zheng-Ming; Chen Nian-Yi.Ca2+ Sublattice and F- Sublattice in Superionic Conductor CaF2[J]. Acta Phys. -Chim. Sin., 1991,7(04): 390-393
472. Zhao De-Chao; Ye Xing-Kai; Wu Yue.Biomimitics of Oxidase and Oxygenase The Electronic Spectra and the Oxygen Uptake Kintics for MPc and MTPP(M=Fe,Co,Cu,Pc and TPP-Are Dianions of Phthalocyanin and Tetraphenyl-Porphyrine, Respectively)[J]. Acta Phys. -Chim. Sin., 1991,7(04): 436-442
473. Guo Jing-Zhong; Gu Yue-Shu; Liu Chuan-Pu; Li Bao-Zhong; Yin Yong-Jia; Cai Ji-Ye; Cao De-Zhao.Study on the Structure Defect of Electrodeposited Tin Using Positron Annihilation Lifetime Spectroscopy[J]. Acta Phys. -Chim. Sin., 1991,7(02): 211-214
474. Gong Hua; Jiang Yong-Ji; Wang Yi; Chen Ming-Zhi; Zheng Guo-Kang.Excess Volumes for (Tetrachlorloromethane+Lewis Bases) and for (Trichloromethane+Lewis Bases)[J]. Acta Phys. -Chim. Sin., 1991,7(01): 49-56
475. DU Jun, WU Xiang-Ying, PAN Xing-Peng, YU Jiang.Oxygenation and Oxidation Desulfurization Property of CeO2/NaY Catalysts[J]. Acta Phys. -Chim. Sin., 0,(): 0-0
476. WANG Yuan-Yuan, XUE Qun-Xing, XIE Hua-Qing, WU Zi-Hua, XING Jiao-Jiao.Monte-Carlo Simulations of Surfactant Effect on Growth of Silver Dendritic Nanostructures[J]. Acta Phys. -Chim. Sin., 0,(): 0-0
477. SHEN Hong-Chen, DING Ji-Yong, LI Li, LIU Fu-Feng.Effect of Y220C Mutant on the Conformational Transition of p53C Probed by Molecular Dynamics Simulation[J]. Acta Phys. -Chim. Sin., 0,(): 0-0
478. LU Xiang, CHEN Xun, WANG Ya-Shun, TAN Yuan-Yuan, GAOMU Zi-Yuan.Molecular Dynamics Simulation of Gas Transport in Amorphous Polyisoprene[J]. Acta Phys. -Chim. Sin., 0,(): 0-0
479. Zhao Zhen-Chao, Zhang Wei-Ping.Two-Dimensional Layered Zeolite Precursors: Syntheses, Modifications and Catalytic Applications[J]. Acta Phys. -Chim. Sin., 0,(): 0-0
480. NIE Wang-Xin, ZOU Xiu-Jing, WANG Xue-Guang, DING Wei-Zhong, LU Xiong-Gang.Preparation of Highly-Dispersed Ni-Ce-Zr Oxides over Mesoporous γ-Alumina and Their Catalytic Properties for CO2 Methanation[J]. Acta Phys. -Chim. Sin., 0,(): 0-0
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