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Dynamic Activation of Adsorbed Intermediates via Axial Traction for the Promoted Electrochemical CO2 Reduction 期刊论文
Angewandte Chemie - International Edition, 2021, 卷号: 60, 期号: 8, 页码: 4192-4198
Authors:  Wang, Xinyue;  Wang, Yu;  Sang, Xiahan;  Zheng, Wanzhen;  Zhang, Shihan;  Shuai, Ling;  Yang, Bin;  Li, Zhongjian;  Chen, Jianmeng;  Lei, Lecheng;  Adli, Nadia Mohd;  Leung, Michael K. H.;  Qiu, Ming;  Wu, Gang;  Hou, Yang
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Nickel compounds  Atoms  Carbon dioxide  Coordination reactions  Electrocatalysts  Electronic structure  Nitrogen  Oxygen  Reduction  Adsorbed intermediates  Faradic efficiency  Local environments  Metal centers  Nitrogen ligand  Overall reactions  Potential windows  Traction effects  
Raman Spectroscopic and Theoretical Study of Scandium Fluoride and Oxyfluoride Anions in Molten FLiNaK 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY B, 2020, 卷号: 124, 期号: 30, 页码: 6671-6678
Authors:  Wang, CY;  Chen, XT;  Wei, R;  Gong, Y
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DENSITY-FUNCTIONAL THEORY  HIGH-TEMPERATURE NMR  BIS(TRIFLUOROMETHANESULFONYL) IMIDE ANION  IONIC LIQUID  VIBRATIONAL-SPECTRA  RARE-EARTH  MOLECULAR-DYNAMICS  LOCAL-STRUCTURE  BINARY MELTS  BASIS-SET  
Length feature of ssDNA adsorption onto graphene oxide with both large unoxidized and oxidized regions 期刊论文
NANOSCALE, 2020, 卷号: 12, 期号: 12, 页码: 6699-6707
Authors:  Lei, XL;  Ma, HS;  Fang, HP
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SINGLE-STRANDED-DNA  MOLECULAR-DYNAMICS  CARBON NANOTUBE  ATOMIC-STRUCTURE  MEMBRANES  BINDING  SURFACE  FUNCTIONALIZATION  NANOCOMPOSITES  SIMULATIONS  
Solubility of Cr2O3 in Molten Fluorides with Different ZrF4 Contents and Fluoroacidities 期刊论文
JOURNAL OF THE ELECTROCHEMICAL SOCIETY, 2020, 卷号: 167, 期号: 2, 页码: -
Authors:  Song, YL;  Shen, M;  Peng, H;  Wang, CY;  Zhao, SF;  Zuo, Y;  Xie, LD
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RAMAN-SPECTRA  CORROSION BEHAVIOR  LOCAL-STRUCTURE  REFERENCE ELECTRODE  SALT REACTORS  NMR APPROACH  OXIDE  MELTS  FLINAK  IONS  
Local structure of uranium in polycrystalline alpha-U2N3+delta film probed by X-ray absorption spectroscopy 期刊论文
JOURNAL OF NUCLEAR MATERIALS, 2020, 卷号: 542, 页码: -
Authors:  Bao, HL;  Zhong, HP;  Hu, Y;  Lin, J;  Yu, HS;  Ma, JY;  Tang, ZF;  Qian, Y;  Huang, YY;  Liu, KZ;  Wang, JQ
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ELECTRONIC-STRUCTURE  NITROGEN  NITRIDE  PHASE  METAL  CARBIDES  DENSITY  OXIDES  UN  
Insight into dynamic interaction of molten MgCl2-NaCl-KCl with impurity water via FPMD simulations 期刊论文
JOURNAL OF MOLECULAR LIQUIDS, 2020, 卷号: 314, 页码: -
Authors:  Li, XJ;  Liu, WH;  Tang, ZF;  Xu, TR;  Wang, JQ
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THERMAL-ENERGY STORAGE  NI-BASED ALLOYS  SOLAR POWER-PLANTS  MOLECULAR-DYNAMICS  CHLORIDE SALTS  CORROSION BEHAVIOR  LOCAL STRUCTURES  HEAT-TRANSFER  FLUORIDE  FLUIDS  
Covalent Triazine Framework Confined Copper Catalysts for Selective Electrochemical CO2 Reduction: Operando Diagnosis of Active Sites 期刊论文
ACS CATALYSIS, 2020, 卷号: 10, 期号: 8, 页码: 4534-4542
Authors:  Ma, LS;  Hu, WB;  Mei, BB;  Liu, H;  Yuan, B;  Zang, J;  Chen, T;  Zou, LL;  Zou, ZQ;  Yang, B;  Yu, Y;  Ma, JY;  Jiang, Z;  Wen, K;  Yang, H
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CARBON-DIOXIDE  ELECTROREDUCTION  HYDROCARBONS  COVERAGE  ELECTROCATALYSTS  MULTICARBON  CHALLENGES  ELECTRODES  EFFICIENCY  CONVERSION  
Broadband Terahertz Spectroscopy of Glutathione 期刊论文
CHINESE JOURNAL OF ANALYTICAL CHEMISTRY, 2020, 卷号: 48, 期号: 10, 页码: 1367-1374
Authors:  Guo, G;  Zhu, ZJ;  Shen, JX;  Zhang, ZC;  Zhang, JB;  Zhao, DM;  Zhao, HW
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TIME-DOMAIN SPECTROSCOPY  CRYSTAL-STRUCTURE  DIELECTRIC-SPECTROSCOPY  INFRARED-SPECTROSCOPY  GAS-PHASE  DYNAMICS  FORM  PROTEINS  SPECTRA  
Unexpected Roles of Alkali-Metal Cations in the Assembly of Low-Valent Uranium Sulfate Molecular Complexes 期刊论文
INORGANIC CHEMISTRY, 2020, 卷号: 59, 期号: 4, 页码: 2348-2357
Authors:  Yue, ZH;  Guo, XF;  Feng, ML;  Lin, YJ;  Ju, Y;  Lin, X;  Zhang, ZH;  Guo, XJ;  Lin, J;  Huang, YY;  Wang, JQ
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STATE STRUCTURAL CHEMISTRY  DIMENSIONAL REDUCTION  CRYSTAL-STRUCTURE  FISSION-PRODUCTS  CLUSTER  HEXANUCLEAR  COORDINATION  SPECIATION  HYDROLYSIS  SELENITES  
Unrevealing the thermophysical properties and microstructural evolution of MgCl2-NaCl-KCl eutectic: FPMD simulations and experimental measurements 期刊论文
SOLAR ENERGY MATERIALS AND SOLAR CELLS, 2020, 卷号: 210, 页码: -
Authors:  Li, XJ;  Li, N;  Liu, WH;  Tang, ZF;  Wang, JQ
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MOLECULAR-DYNAMICS SIMULATIONS  TOTAL-ENERGY CALCULATIONS  TRANSPORT-PROPERTIES  LOCAL STRUCTURES  THERMAL-CONDUCTIVITY  CORROSION BEHAVIOR  MOLTEN CHLORIDE  SHEAR VISCOSITY  SALTS