[1] |
Miao TAN,Lei ZHANG,Wanzhen LIANG.
Theoretical Study on Intrinsic Structures and Properties of vdW Heterostructures of Transition Metal Dichalcogenides (WX2) and Effect of Strains
[J]. Acta Physico-Chimica Sinica, 2019, 35(4): 385-393.
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[2] |
Chunxing REN,Xiaoxia LI,Li GUO.
Reaction Mechanisms in the Thermal Decomposition of CL-20 Revealed by ReaxFF Molecular Dynamics Simulations
[J]. Acta Phys. -Chim. Sin., 2018, 34(10): 1151-1162.
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[3] |
Zi-Min WANG,Mo ZHENG,Yong-Bing XIE,Xiao-Xia LI,Ming ZENG,Hong-Bin CAO,Li GUO.
Molecular Dynamics Simulation of Ozonation of p-Nitrophenol at Room Temperature with ReaxFF Force Field
[J]. Acta Phys. -Chim. Sin., 2017, 33(7): 1399-1410.
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[4] |
Yuan ZHAO,Ze-Xing CAO.
Global Simulations of Enzymatic Catalysis
[J]. Acta Phys. -Chim. Sin., 2017, 33(4): 691-708.
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[5] |
Xiao-Long LIU,Xiao-Xia LI,Song HAN,Xian-Jie QIAO,Bei-Jing ZHONG,Li GUO.
Initial Reaction Mechanism of RP-3 High Temperature Oxidation Simulated with ReaxFF MD
[J]. Acta Phys. -Chim. Sin., 2016, 32(6): 1424-1433.
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[6] |
Lin. SHI,Wei. HUANG,Shu-Zheng. SONG,Zhi-Bo. LI,Shuang-Qiang. LIU.
Effect of the Fluorine Addition Method on the Hydrodesulfurization Performance of NiMo Catalysts over Slurry Bed
[J]. Acta Phys. -Chim. Sin., 2015, 31(8): 1559-1566.
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[7] |
YIN Hai-Feng, XIANG Gong-Zhou, YUE Li, ZHANG Hong.
Plasmon Excitation in Silicene Quantum Dots
[J]. Acta Phys. -Chim. Sin., 2015, 31(1): 67-72.
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[8] |
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.
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[9] |
ZENG Yong-Ping, SHI Rong, YANG Zheng-Hua.
Ab Initio Molecular Dynamics Simulations of Structural Properties of Be2+ in Water, Methanol and Ethanol
[J]. Acta Phys. -Chim. Sin., 2013, 29(10): 2180-2186.
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[10] |
CHEN Xue-Song, LU Peng-Fei, DONG Yu-Hui, XIE Ju.
Theoretical Study of Calix[4]pyrrole Complexes with Halide and AmmoniumIons
[J]. Acta Phys. -Chim. Sin., 2013, 29(10): 2187-2197.
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[11] |
ZHANG Cui-Mei, ZHANG Zhi-Guo, HUANG Cun-Shun, ZHANG Qun, CHEN Yang.
Photodissociation Dynamics of Carbonyl Sulfide in Helium Droplets
[J]. Acta Phys. -Chim. Sin., 2013, 29(09): 1886-1890.
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[12] |
YUE Yan, XU Hui-Xia, HAO Yu-Ying, XIE Xiao-Dong, QU Li-Tao, WANG Hua, XU Bing-She.
Synthesis and Photoelectrical Properties of Room-Temperature Phosphorescent (ppy)2Ir(pybi) Complex
[J]. Acta Phys. -Chim. Sin., 2012, 28(07): 1593-1598.
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[13] |
ZENG Yong-Ping, ZHU Xiao-Min, YANG Zheng-Hua.
Car-Parrinello Molecular Dynamics Simulations of Microstructure Properties of Liquid Water, Methanol and Ethanol
[J]. Acta Phys. -Chim. Sin., 2011, 27(12): 2779-2785.
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[14] |
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.
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[15] |
ZHANG Qiao-Bao, FENG Zeng-Fang, HAN Nan-Nan, LIN Ling-Ling, ZHOU Jian-Zhang, LIN Zhong-Hua.
Preparation and Photoeletrochemical Performance of CdS Quantum Dot Sensitized ZnO Nanorod Array Electrodes
[J]. Acta Phys. -Chim. Sin., 2010, 26(11): 2927-2934.
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