1． ZHANG Fan, YAO Ming-Fa.Three-Dimensional Direct Numerical Simulation of Partially Premixed Combustion in Engine-Related Conditions[J]. Acta Phys. -Chim. Sin., 2016,32(8): 1941-1949
2． YUAN Ping, WANG Hao, XUE Yan-Feng, LI Yan-Chun, WANG Kai, DONG Mei, FAN Wei-Bin, QIN Zhang-Feng, WANG Jian-Guo.Catalytic Properties of Different Crystal Sizes for ZSM-5 Zeolites on the Alkylation of Benzene with Methanol and Optimization of the Reaction Conditions[J]. Acta Phys. -Chim. Sin., 2016,32(7): 1775-1784
3． HU Si, ZHANG Qing, GONG Yan-Jun, ZHANG Ying, WU Zhi-Jie, DOU Tao.Deactivation and Regeneration of HZSM-5 Zeolite in Methanol-to-Propylene Reaction[J]. Acta Phys. -Chim. Sin., 2016,32(7): 1785-1794
4． LIU Xiao-Long, LI Xiao-Xia, HAN Song, QIAO Xian-Jie, ZHONG Bei-Jing, GUO Li.Initial Reaction Mechanism of RP-3 High Temperature Oxidation Simulated with ReaxFF MD[J]. Acta Phys. -Chim. Sin., 2016,32(6): 1424-1433
5． LI Xiao-Lei, TAO Shuo, LI Ke-Da, WANG Ya-Song, WANG Ping, TIAN Zhi-Jian.In situ Synthesis of ZIF-8 Membranes with Gas Separation Performance in a Deep Eutectic Solvent[J]. Acta Phys. -Chim. Sin., 2016,32(6): 1495-1500
6． WU Shao-Gui, FENG Dan.Free Energy Calculation for Base Pair Dissociation in a DNA Duplex[J]. Acta Phys. -Chim. Sin., 2016,32(5): 1282-1288
7． LIU Zi-Yu, LIAO Qi, JIN Zhi-Qiang, ZHANG Lei, ZHANG Lu.Effect of Electrolytes on the Interfacial Behavior of Nonionic-Anionic Surfactant Solutions Using Molecular Dynamics Simulations[J]. Acta Phys. -Chim. Sin., 2016,32(5): 1168-1174
8． LIU Xiao-Qing, LI Shi-Hui, SUN Meng-Ting, YU Cheng-Long, HUANG Bi-Chun.Preparation, Characterization and Low-Temperature NH₃-SCR Activity of MnO_x/SAPO-11 Catalysts[J]. Acta Phys. -Chim. Sin., 2016,32(5): 1236-1246
9． SUN Li-Yuan, ZHANG Ya-Fei, GONG Yan-Jun.Structural Features and Application of Micro-Microporous Composite Zeolites[J]. Acta Phys. -Chim. Sin., 2016,32(5): 1105-1122
10． XIE Wei, XU Ze-Ren, WANG Ming, XU Si-Chuan.Molecular Dynamics Simulation for Levo-Benzedrine to Transmit through Molecular Channels within D₃R[J]. Acta Phys. -Chim. Sin., 2016,32(4): 907-920
11． ZOU Jing, FAN Zhi-Lin, JIANG Li-Sha, ZHOU Dan-Hong.Theoretical Study of the Solvent Adsorption on Ti-Peroxo Active Center in Ti-MWW Zeolite[J]. Acta Phys. -Chim. Sin., 2016,32(4): 935-942
12． LI Qing, YANG Deng-Feng, WANG Jian-Hua, WU Qi, LIU Qing-Zhi.Biomimetic Modification and Desalination Behavior of (15,15) Carbon Nanotubes with a Diameter Larger than 2 nm[J]. Acta Phys. -Chim. Sin., 2016,32(3): 691-700
13． CUI Da-Chao, REN Wei-Tong, LI Wen-Fei, WANG Wei.Metadynamics Simulations of Mg²⁺ Transfer in the Late Stage of the Adenylate Kinase Catalytic Cycle[J]. Acta Phys. -Chim. Sin., 2016,32(2): 429-435
14． ZHAO Shu-Heng, LANG Lin, JIANG Jun-Fei, YIN Xiu-Li, WU Chuang-Zhi.Synthesis and Low-Temperature Detemplation of High-Silica MFI Zeolite Membranes[J]. Acta Phys. -Chim. Sin., 2016,32(2): 519-526
15． MENG Xian-Mei, ZHANG Shao-Long, ZHANG Qing-Gang .Effect of the Allosteric Inhibitor Efavirenz on HIV-1 Reverse Transcriptase by Molecular Dynamics Simulation[J]. Acta Phys. -Chim. Sin., 2016,32(2): 436-444
16． DU Niao-Feng, NING Hong-Bo, LI Ze-Rong, ZHANG Qi-Yi, LI Xiang-Yuan.Kinetic Calculation and Modeling Study of 1,3-Butadiene Pyrolysis[J]. Acta Phys. -Chim. Sin., 2016,32(2): 453-464
17． AO Bing-Yun, YE Xiao-Qiu, CHEN Pi-Heng.Progress in Theoretical Research on Plutonium-Based Solid-State Materials[J]. Acta Phys. -Chim. Sin., 2015,31(Suppl): 3-13
18． XU Zhen, LU Chun-Hai, CHEN Min, CHEN Wen-Kai, HUANG Shuo, ZHANG Qi.Simulation of Uranium Formed in Groundwater of a Low-Level Radioactive Waste Repository Site in Southwest China[J]. Acta Phys. -Chim. Sin., 2015,31(Suppl): 45-48
19． LI Rui-Wen, WANG Xiao-Lin, SHI Peng, JI He-Fei.Study on Strain Energy on the Hydride Growth Kinetics of U-Nb Alloys[J]. Acta Phys. -Chim. Sin., 2015,31(Suppl): 39-44
20． ZHAO Meng-Yao, YANG Xue-Ping, YANG Xiao-Ning.Molecular Dynamics Simulation of Water Molecules in Confined Slit Pores of Graphene[J]. Acta Phys. -Chim. Sin., 2015,31(8): 1489-1498
21． ZHANG Qiang, CHENG Cheng, ZHANG Xia, ZHAO Dong-Xia.Jump Rotational Mechanism of Ammonium Ion in Aqueous Solutions[J]. Acta Phys. -Chim. Sin., 2015,31(8): 1461-1467
22． WANG Hao, SONG Ling-Jun, LI Xing-Hu, YUE Li-Meng.Hydrogen Production from Partial Oxidation of Methane by Dielectric Barrier Discharge Plasma Reforming[J]. Acta Phys. -Chim. Sin., 2015,31(7): 1406-1412
23． XU Ke, CHENG Yi, SUN Bo, PEI Yan, YAN Shi-Run, QIAO Ming-Hua, ZHANG Xiao-Xin, ZONG Bao-Ning.Fischer-Tropsch Synthesis over Skeletal Co@HZSM-5 Core-Shell Catalysts[J]. Acta Phys. -Chim. Sin., 2015,31(6): 1137-1144
24． HUANG Yan, FU Min, HE Tao.Synthesis of g-C₃N₄/BiVO₄ Nanocomposite Photocatalyst and Its Application in Photocatalytic Reduction of CO₂[J]. Acta Phys. -Chim. Sin., 2015,31(6): 1145-1152
25． Lü Ye-Qing, ZHENG Shi-Li, WANG Shao-Na, DU Hao, ZHANG Yi.Structure and Diffusivity of Oxygen in Concentrated Alkali-Metal Hydroxide Solutions: A Molecular Dynamics Simulation Study[J]. Acta Phys. -Chim. Sin., 2015,31(6): 1045-1053
26． SHEN Zhuang-Lin, HE Gao-Hong, ZHANG Ning, HAO Ce.Molecular Dynamics Simulation of Reverse-Osmotic Salt Rejection and Water Transport through Double-Walled Carbon Nanotube[J]. Acta Phys. -Chim. Sin., 2015,31(6): 1025-1034
27． ZHANG Xiao-Qing, XU Yan YAN, YANG Chun-Hui, ZHANG Yan-Ping, YIN Yong-Xiang, SHANG Shu-Yong.In-situ Co-Precipitation of Ni-Mg-Al-LDH Catalytic Precursor on γ-Al₂O₃ for Dry Reforming of Methane: Synthesis and Evaluation[J]. Acta Phys. -Chim. Sin., 2015,31(5): 948-954
28． LEI Guang-Ping, LIU Chao, XIE Hui.Molecular Simulation of Adsorption and Separation Performances for CO₂/CH₄ Mixtures in Graphene/Nanotube Hybrid Structures[J]. Acta Phys. -Chim. Sin., 2015,31(4): 660-666
29． ZHAO Shu-Heng, LANG Lin, YIN Xiu-Li, YANG Wen-Shen, WU Chuang-Zhi.TPAOH Template Removal from High-Silica ZSM-5 by Low-Temperature Hydrocracking[J]. Acta Phys. -Chim. Sin., 2015,31(4): 793-799
30． ZHANG He, LU Jun-Rui, MU Jiang-Bei, LIU Jin-Biao, YANG Xu-Yun, WANG Mei-Jun, ZHANG Rui-Bo.Molecular Dynamics Simulation and Antibacterial Mechanism of 3MBA Derivatives as FtsZ Protein Inhibitors[J]. Acta Phys. -Chim. Sin., 2015,31(3): 566-575
31． WANG Bao-Wei, LIU Si-Han, HU Zong-Yuan, LI Zhen-Hua, MA Xin-Bin.Effect of H₂S Concentration on MoO₃/Al₂O₃ and CoO-MoO₃/Al₂O₃ Catalysts for Sulfur-Resistant Methanation[J]. Acta Phys. -Chim. Sin., 2015,31(3): 545-551
32． ZHANG Yu, WANG Hong-Ning, CHEN Ruo-Yu.In situ Synthesis of Cu-SSZ-13/Cordierite Monolithic Catalyst for the Selective Catalytic Reduction of NO with NH₃[J]. Acta Phys. -Chim. Sin., 2015,31(2): 329-336
33． ZHU Yu-Feng, CAO Zan-Xia, ZHAO Li-Ling, WANG Ji-Hua.Conformational Change Characteristics in the Intrinsically Disordered FlgM Protein from a Hyperthermophile at Two Different Temperatures[J]. Acta Phys. -Chim. Sin., 2015,31(2): 384-392
34． HE Zhi-Qiao, TONG Li-Li, ZHANG Zhi-Peng, CHEN Jian-Meng, SONG Shuang.Ag/Ag₂WO₄ Plasmonic Catalyst for Photocatalytic Reduction of CO₂ under Visible Light[J]. Acta Phys. -Chim. Sin., 2015,31(12): 2341-2348
35． WANG Tai-Yang, ZOU Chang-Jun, LI Dai-Xi, CHEN Zheng-Long, LIU Yuan, LI Xiao-Ke, LI Ming.Theoretical Investigation on Cyclodextrin Inclusion Complexes with Organic Phosphoric Acid as Corrosion Inhibitor[J]. Acta Phys. -Chim. Sin., 2015,31(12): 2294-2302
36． CHEN Feng, HUANG Bi-Chun, YANG Ying-Xin, LIU Xiao-Qing, YU Cheng-Long.Synthesis, Characterization and NH₃-SCR Activity of MnSAPO-34 Molecular Sieves[J]. Acta Phys. -Chim. Sin., 2015,31(12): 2375-2385
37． WANG Kun, LIU Juan-Fang, CHEN Qing-Hua.Molecular Dynamics Simulation of Pd Clusters Deposited on Pd/Ag Substrates[J]. Acta Phys. -Chim. Sin., 2015,31(11): 2091-2098
38． ZHANG Lan-Lan, SONG Yu, LI Guo-Dong, ZHANG Shao-Long, SHANG Yun-Shan, GONG Yan-Jun.ZSM-5 Zeolite with Micro-Mesoporous Structures Synthesized Using Different Templates for Methanol to Propylene Reaction[J]. Acta Phys. -Chim. Sin., 2015,31(11): 2139-2150
39． HU Gui-Xiang, LUO Cheng-Cai, PAN Shan-Fei, JIANG Yong-Jun, ZOU Jian-Wei.Predicting Retention and Separation Factors of Chiral Diarylmethane Derivates by QSPR Models[J]. Acta Phys. -Chim. Sin., 2015,31(1): 73-82
40． GAO Wen-Xiu, WANG Hong-Lei, LI Shen-Min.Molecular Dynamics Simulation Study of Structural and Transport Properties of Methanol-Water Mixture in Carbon Nanotubes[J]. Acta Phys. -Chim. Sin., 2014,30(9): 1625-1633
41． YU Da-Qi, TU Yu-Hai, LAI Lu-Hua.Molecular Interactions of Bacterial Chemoreceptor Assemblies[J]. Acta Phys. -Chim. Sin., 2014,30(7): 1347-1353
42． ZHANG Xiang-Xiong, CHEN Min.Influence of Homogeneous Electric Field on the Structure and Growth of Ice[J]. Acta Phys. -Chim. Sin., 2014,30(7): 1208-1214
43． BAI Shu, CHANG Ying, LIU Xiao-Juan, LIU Fu-Feng.Interactions between Trehalose and Amino Acids by Molecular Dynamics Simulations[J]. Acta Phys. -Chim. Sin., 2014,30(7): 1239-1246
44． GUO Jun-Jiang, HUA Xiao-Xiao, WANG Fan, TAN Ning-Xin, LI Xiang-Yuan.Systematic Approach to Automatic Construction of High-Temperature Combustion Mechanisms of Alkanes[J]. Acta Phys. -Chim. Sin., 2014,30(6): 1027-1041
45． LÜ Wen-Jie, HU Yao-Feng, ZHAN Bi-Cai, LIU Zhen-Hai, SHANG Ya-Zhuo, WANG Hua-Lin, LIU Hong-Lai.Study on Mechanism of Surfactant Influencing on Sludge Dewatering Performance：Molecular Dynamics Simulations of the Interaction between Gemini Surfactant and Polyelectrolyte[J]. Acta Phys. -Chim. Sin., 2014,30(5): 811-820
46． XU Bo-Shen, ZHAO Ying, SHEN Xian-Liang, CONG Yue, YIN Xiu-Mei, WANG Xin-Peng, YUAN Qing, YU Nai-Sen, DONG Bin.Dissipative Particle Dynamics Simulation of Multicompartment Micelles Self-Assembled from a Blend of Triblock Copolymers and Diblock Copolymers in an Aqueous Solution[J]. Acta Phys. -Chim. Sin., 2014,30(4): 646-653
47． YANG Jia-Ping, YU Hui-Yao, HE Yu-Xiu, XIE Jing-Xuan, BI Wen-Yan, GAO Qing-Yu.Model Simulation and Analysis of Spatiotemporal Dynamics for the Electro-Oxidation of Sulfide on Platinum[J]. Acta Phys. -Chim. Sin., 2014,30(4): 686-692
48． GUO Zhang-Long, HUANG Li-Qiong, CHU Wei, LUO Shi-Zhong.Effects of Promoter on NiMgAl Catalyst Structure and Performance for Carbon Dioxide Reforming of Methane[J]. Acta Phys. -Chim. Sin., 2014,30(4): 723-728
49． FAN Zhong-Xiang, HUANG Jian-Hua.Dissipative Particle Dynamics Simulation on Aggregation of Rod-Coil-Rod Triblock Copolymer in Dilute Solution[J]. Acta Phys. -Chim. Sin., 2014,30(3): 408-412
50． ZHANG Shao-Long, ZHANG Lan-Lan, WANG Wu-Gang, MIN Yuan-Yuan, MATong, SONG Yu, GONG Yan-Jun, DOU Tao.Methanol to Propylene over Nanosheets of HZSM-5 Zeolite[J]. Acta Phys. -Chim. Sin., 2014,30(3): 535-543
51． AI Yi-Xin, LU Jun-Rui, XIN Chun-Wei, MU Jiang-Bei, YANG Xu-Yun, ZHANG He.Simulated Mechanism of Triclosan in Modulating the Active Site and Loop of FabI by Computer[J]. Acta Phys. -Chim. Sin., 2014,30(3): 559-568
52． XIONG Hai-Ling, YANG Zhi-Min, LI Hang.Coupling Effects of Diffusive Model and Sticking Model on Aggregation Kinetics of Colloidal Particles：A Monte Carlo Simulation Study[J]. Acta Phys. -Chim. Sin., 2014,30(3): 413-422
53． SUN Meng-Meng, CAO Yi, LAN Li, ZOU Sha, FANG Zhi-Tao, CHEN Yao-Qiang.Selective Catalytic Oxidation of Ammonia to Nitrogen over Iron and Copper Bimetallic Catalysts[J]. Acta Phys. -Chim. Sin., 2014,30(12): 2300-2306
54． MEI Qing-Qing, HOU Min-Qiang, NING Hui, MA Jun, YANG De-Zhong, HAN Bu-Xing.Microstructure and Intermolecular Interactions of [Bmim][PF₆]+Water+ Alcohol Systems: A Molecular Dynamics Simulation Study[J]. Acta Phys. -Chim. Sin., 2014,30(12): 2210-2215
55． REN Xiu-Bin, ZHOU An-Ning, ZHANGJie-Bing.A Kinetic Monte Carlo Simulation on Forced Oscillations of Methane Partial Oxidation[J]. Acta Phys. -Chim. Sin., 2014,30(11): 2009-2014
56． SUN Qian, YANG Xiong-Bo, GAO Ya-Jun, ZHAO Jian-Wei.Molecular Dynamics Simulation of the Deformation Behavior of Ag Nanowires with Different Twin Boundary Density under Tension Loading[J]. Acta Phys. -Chim. Sin., 2014,30(11): 2015-2023
57． WU Xuan-Jun, ZHAO Peng, FANG Ji-Min, WANG Jie, LIU Bao-Shun, CAI Wei-Quan.Simulation on the Hydrogen Storage Properties of New Doping Porous Aromatic Frameworks[J]. Acta Phys. -Chim. Sin., 2014,30(11): 2043-2054
58． HE Wen-Ying, YAO Xiao-Jun, HUA Ying-Jie, HUANG Guo-Lei, WU Xiu-Li, LI Xiao-Bao, HAN Chang-Ri, SONG Xiao-Ping .Effect of Kolavenic Acid on the Structure of Human Serum Albumin[J]. Acta Phys. -Chim. Sin., 2014,30(11): 2142-2148
59． JIAO Zhi-Feng, DONG Li-Li, GUO Xiao-Ning, JIN Guo-Qiang, GUO Xiang-Yun, WANG Xiao-Min.Methane Catalytic Combustion over Ni/SiC, Fe/SiC and Co/SiC Modified by Zr_0.5Ce_0.5O₂ Solid Solution[J]. Acta Phys. -Chim. Sin., 2014,30(10): 1941-1946
60． BIAN Fu-Yong, ZHANG Ji-Wei, WANG Dan, XU Si-Chuan.Molecular Dynamics Simulation of the Permeation of Methyldopa through POPC Phospholipid Bilayer Membrane[J]. Acta Phys. -Chim. Sin., 2014,30(10): 1947-1956
61． ZHANG Ji-Wei, BIAN Fu-Yong, SHI Guo-Jun, XU Si-Chuan.Molecular Dynamics Simulation of Dopamine Diffusion within and Permeation through POPC Phospholipid Bilayer Membrane[J]. Acta Phys. -Chim. Sin., 2014,30(1): 183-193
62． SHAN Sheng-Sheng, YAN Chao, XU Liang.Dihedral Dynamics Analyses of the Polymorphic Properties of Zn²⁺-Bound Amyloid β40 (Aβ40) and β42 (Aβ42)[J]. Acta Phys. -Chim. Sin., 2013,29(12): 2630-2638
63． LIU Yuan, LONG Mei, XIE Meng-Xia.Mechanism of Interaction between Chrysin and Different Configurations of Human Serum Albumin[J]. Acta Phys. -Chim. Sin., 2013,29(12): 2647-2654
64． WANG Zhao-Yang, LI Gang, SUN Zhi-Guo.Denitrogenation through Adsorption to Sulfonated Metal-Organic Frameworks[J]. Acta Phys. -Chim. Sin., 2013,29(11): 2422-2428
65． WU Xuan-Jun, ZHENG Ji, LI Jiang, CAI Wei-Quan.Molecular Simulation on Hydrogen Storage Capacities of Porous Metal Organic Frameworks[J]. Acta Phys. -Chim. Sin., 2013,29(10): 2207-2214
66． LI Qi, HOU Yu-Hui, DONG Ling-Yu, HUANG Ming-Xiang, WENG Wei-Zheng, XIA Wen-Sheng, WAN Hui-Lin.Catalytic Behaviors and Stability of Aerogel Silica-Supported Ni Catalysts for the Partial Oxidation of Methane into Synthesis Gas[J]. Acta Phys. -Chim. Sin., 2013,29(10): 2245-2254
67． SUN Wei, ZHANG Jin-Jiang, ZHAO Jian-Wei.Molecular Dynamics Simulation of a Nanosized Device[J]. Acta Phys. -Chim. Sin., 2013,29(09): 1931-1936
68． SONG Hui, XU Xian-Zhi, LI Fen.Numerical Simulation of Discharge Process and Failure Mechanisms of Zinc Electrode[J]. Acta Phys. -Chim. Sin., 2013,29(09): 1961-1974
69． WANG Wu-Gang, ZHANG Shao-Long, ZHANG Lan-Lan, WANG Yan, LIU Xiao-Ling, GONG Yan-Jun, DOU Tao.Synthesis and Characterization of Nanosheet ZSM-5 Zeolites with Different SiO₂/Al₂O₃ Molar Ratios[J]. Acta Phys. -Chim. Sin., 2013,29(09): 2035-2040
70． WU Xiao-Min, YUAN Xiao-Hui, XUE Shu-Lei, ZHA Ling-Sheng, WANG Guang-Li, ZHANG Hai-Jun.Research Progress of the Trp-Cage Formation and Its Folding Mechanism[J]. Acta Phys. -Chim. Sin., 2013,29(09): 1842-1850
71． ZHANG Ning, LI Wei-Zhong, CHEN Cong, ZUO Jian-Guo.Evaluation of the Application of Hydrogen Bonding Criteria to DMSO Aqueous Solution[J]. Acta Phys. -Chim. Sin., 2013,29(09): 1891-1899
72． GE Zhen-Peng, SHI Yan-Chao, LI Xiao-Yi.Effects of Orthogonal Electric Field on Water Flux through a Carbon Nanotube[J]. Acta Phys. -Chim. Sin., 2013,29(08): 1655-1660
73． LU Jun-Ran, LI Yi, YU Ji-Hong, LU Ying.Predicting Hypothetical Zeolite Frameworks Using Program FraGen[J]. Acta Phys. -Chim. Sin., 2013,29(08): 1661-1665
74． ZHANG Xiao-Tong, YU Wen-Guang, QIN Yu-Cai, DONG Shi-Wei, PEI Ting-Ting, WANG Lin, SONG Li-Juan.Influence of Surface Acidity of Y Zeolites on the Adsorption of Organic Molecules by In situ Fourier Transform Infrared Spectroscopy[J]. Acta Phys. -Chim. Sin., 2013,29(06): 1273-1280
75． ZHANG Jin-Gui, QIAN Wei-Zhong, TANG Xiao-Ping, SHEN Kui, WANG Tong, HUANG Xiao-Fan, WEI Fei.Influence of Catalyst Acidity on Dealkylation, Isomerization and Alkylation in MTA Process[J]. Acta Phys. -Chim. Sin., 2013,29(06): 1281-1288
76． CHEN Hong-Li, DING Jian, WANG Yi-Meng.Synthesis of Hierarchical MgO-Containing Silicalite-1 Zeolites with High Hydrothermal Stability[J]. Acta Phys. -Chim. Sin., 2013,29(05): 1035-1040
77． BAI Shu, LI Hao, ZHANG Lin.Standing Orientation of Lysozymes Induced by Electrostatically Repulsive Surface[J]. Acta Phys. -Chim. Sin., 2013,29(04): 849-857
78． SUN Wei-Qi, ZHANG Ji-Long, ZHENG Qing-Chuan, SUN Zhi-Wei, ZHANG Hong-Xing.Molecular Dynamics Simulations of the Unbinding of Phenylsulfonamide from Carbonic Anhydrase II[J]. Acta Phys. -Chim. Sin., 2013,29(04): 843-848
79． SONG Fenhong, LIU Chao, ZHOU Xuan.Molecular Dynamics Simulation of Heterogeneous Nucleation of Argon Vapor onto a Spherical Solid Particle[J]. Acta Phys. -Chim. Sin., 2013,29(04): 715-722
80． YUAN Rui, LI Ying, FANG Hong-Bo, WANG Wei.Relationship between Molecular Configuration and Phase Behavior of Partially Hydrolyzed Hydrophobically Modified Polyacrylamide[J]. Acta Phys. -Chim. Sin., 2013,29(04): 706-714
81． YING Xiao, LI Hong-Gang, LIU Hai-Yang, WANG Hui, JI Liang-Nian.Optically Active Sum Frequency Generation of Amino Acid Molecules[J]. Acta Phys. -Chim. Sin., 2013,29(04): 731-736
82． SHI Ji-Pei, ZHAO Juan, YANG Fan, WANG Jian-Ping.Femtosecond Two-Dimensional Infrared Spectroscopy of N-Ethypropionamide[J]. Acta Phys. -Chim. Sin., 2013,29(04): 695-700
83． BAI Shu, ZHOU Rong, LIU Fu-Feng.Rational Design of Affinity Ligand for the Oriented Immobilization of Trypsin[J]. Acta Phys. -Chim. Sin., 2013,29(02): 439-448
84． WANG Xiao-Juan, LI Zhi-Yi, LIU Zhi-Jun.Molecular Dynamics Simulations on Hydrolysis of Zinc Acetate in Supercritical Water[J]. Acta Phys. -Chim. Sin., 2013,29(01): 23-29
85． JIN Wei-Yang, CHENG Dang-Guo, CHEN Feng-Qiu, ZHAN Xiao-Li.Synthesis of MFI-Type Zeolite Membrane Encapsulated Activated Carbon Particles Using a Modified Seeded Method[J]. Acta Phys. -Chim. Sin., 2013,29(01): 139-143
86． GE Song, CHEN Min.Effects of Surface Charge and Electric Field on the Interfacial Thermal Resistance at Liquid/Solid Interfaces[J]. Acta Phys. -Chim. Sin., 2012,28(12): 2939-2943
87． GUO Yan, FU Ying-Qiang, SUN Yin-Lu, CHEN Tian-Nan, ZHAO Jian-Wei.Theoretical Simulation on the Chromatographic System Based on the Random Diffusion of the Separating Particles[J]. Acta Phys. -Chim. Sin., 2012,28(12): 2797-2802
88． YUAN Shuai, MA Jing, ZHANG Wen-Ying, SHU Kun-Xian, DOU Yu-Sheng.Semiclassical Dynamics Simulation and CASSCF Calculation for 5-Methyl Cytosine and Cytosine[J]. Acta Phys. -Chim. Sin., 2012,28(12): 2803-2808
89． DONG Xiao-Yan, DU Wen-Jie, LIU Fu-Feng.Molecular Dynamics Simulation and Binding Free Energy Calculation of the Conformational Transition of Amyloid Peptide 42 Inhibited by Peptide Inhibitors[J]. Acta Phys. -Chim. Sin., 2012,28(11): 2735-2744
90． WANG Ding, TIAN Guo-Cai.Simulation Study of the Effect ofMethanol on the Structure and Properties of 1-Butyl-3-methylimidazolium Tetrafluoroborate Ionic Liquid[J]. Acta Phys. -Chim. Sin., 2012,28(11): 2558-2566
91． HUANG Yong-Qi, KANG Xue, XIA Bing, LIU Zhi-Rong.Mechanism of 3D Domain Swapping for M^pro-C: Clues from Molecular Simulations[J]. Acta Phys. -Chim. Sin., 2012,28(10): 2411-2417
92． GAO Shuai, WU Yong-Quan, SHEN Tong, ZHANG Ning, LAI Li-Shan.Analysis of Zn-Mg Alloy Structure and Phases Distribution of Zn-Mg Diffusion System[J]. Acta Phys. -Chim. Sin., 2012,28(09): 2037-2043
93． YUE Ming-Bo, YANG Na, WANG Yi-Meng.Synthesis of Shaped ZSM-5 Zeolites by Dry-Gel Conversion with Seed Gel as Directing Agent[J]. Acta Phys. -Chim. Sin., 2012,28(09): 2115-2121
94． LEI Ze, SUN Yi, HAN Min-Fang, WANG Qi-Bao.Preparation, Characterization and Catalytic Activities of La_0.8Sr_0.2Fe_1-xSc_xO_3-δ Catalysts for Methane Combustion[J]. Acta Phys. -Chim. Sin., 2012,28(09): 2129-2134
95． YAO Min, HU Si, WANG Jian, DOU Tao, WU Yong-Ping.Size Effect of HZSM-5 Zeolite on Catalytic Conversion of Methanol to Propylene[J]. Acta Phys. -Chim. Sin., 2012,28(09): 2122-2128
96． LUO Fang, GAO Jian, CHENG Yuan-Hua, CUI Wei, JI Ming-Juan.Interaction Mechanisms of Inhibitors of Glucoamylase by Molecular Dynamics Simulations and Free Energy Calculations[J]. Acta Phys. -Chim. Sin., 2012,28(09): 2191-2201
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 Ce_0.45Zr_0.45Y_0.07La_0.03O_1.95/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.NO_x 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-MO_x (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
Carlo Method[J]. Acta Phys. -Chim. Sin., 2008,24(08): 1493-1497
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 La_0.8Sr_0.2FeMn_1.5Al_9.5O_19-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 Pd_n(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 W_xC/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 Na_nZSM-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-S_MFI 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 Ba_1－xLa_xFeAl₁₁O_19－δ 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 Ca^2＋[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 NO_x 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 FeO_χ 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