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Revealing the role of tellurium in palladium-tellurium catalysts for the direct synthesis of hydrogen peroxide 期刊论文
JOURNAL OF CATALYSIS, 2020, 卷号: 385, 页码: 21-29
Authors:  Tian, PF;  Xuan, FZ;  Ding, DD;  Sun, Y;  Xu, XY;  Li, W;  Si, R;  Xu, J;  Han, YF
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NEAR-ATMOSPHERIC PRESSURES  TOTAL-ENERGY CALCULATIONS  FINDING SADDLE-POINTS  DIRECT H2O2 SYNTHESIS  AT-PD SURFACES  ULTRAHIGH-VACUUM  ACTIVE-SITES  CO OXIDATION  H-2  O-2  
Real-time atomistic simulation of the Ostwald ripening of TiO(2)supported Au nanoparticles 期刊论文
NANOSCALE, 2020, 卷号: 12, 期号: 37, 页码: 19142-19148
Authors:  Zhu, BE;  Qi, R;  Yuan, LN;  Gao, Y
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TRANSMISSION ELECTRON-MICROSCOPY  PARTICLE-SIZE  CATALYSTS  NANOCLUSTERS  CRYSTALS  GROWTH  GOLD  
Solving Burnup Equations by Numerical Inversion of the Laplace Transform Using Pade Rational Approximation 期刊论文
NUCLEAR SCIENCE AND ENGINEERING, 2020, 卷号: 194, 期号: 12, 页码: 1143-1161
Authors:  Xia, SP;  Cheng, MS;  Dai, ZM
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MATRIX  COMPUTE  
Role of local coordination in bimetallic sites for oxygen reduction: A theoretical analysis 期刊论文
JOURNAL OF ENERGY CHEMISTRY, 2020, 卷号: 44, 页码: 131-137
Authors:  Yang, YQ;  Zhang, H;  Liang, ZF;  Yin, YR;  Mei, BB;  Song, F;  Sun, FF;  Gu, SQ;  Jiang, Z;  Wu, YE;  Zhu, ZY
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TOTAL-ENERGY CALCULATIONS  ACTIVE-SITES  ELECTROCATALYSTS  CATALYSTS  DESIGN  IDENTIFICATION  PERFORMANCE  CARBON  CON4  
Engineering unsymmetrically coordinated Cu-S1N3 single atom sites with enhanced oxygen reduction activity 期刊论文
NATURE COMMUNICATIONS, 2020, 卷号: 11, 期号: 1, 页码: -
Authors:  Shang, HS;  Zhou, XY;  Dong, JC;  Li, A;  Zhao, X;  Liu, QH;  Lin, Y;  Pei, JJ;  Li, Z;  Jiang, ZL;  Zhou, DN;  Zheng, LR;  Wang, Y;  Zhou, J;  Yang, ZK;  Cao, R;  Sarangi, R;  Sun, TT;  Yang, X;  Zheng, XS;  Yan, WS;  Zhuang, ZB;  Li, J;  Chen, WX;  Wang, DS;  Zhang, JT;  Li, YD
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METAL-ORGANIC-FRAMEWORK  TOTAL-ENERGY CALCULATIONS  FE-N-C  RATIONAL DESIGN  ELECTROCATALYSTS  EVOLUTION  CATALYSTS  COPPER  CARBON  IDENTIFICATION  
Atomic-Level Construction of Tensile-Strained PdFe Alloy Surface toward Highly Efficient Oxygen Reduction Electrocatalysis 期刊论文
NANO LETTERS, 2020, 卷号: 20, 期号: 2, 页码: 1403-1409
Authors:  Li, X;  Li, XX;  Liu, CX;  Huang, HW;  Gao, PF;  Ahmad, F;  Luo, LH;  Ye, YF;  Geng, ZG;  Wang, GX;  Si, R;  Ma, C;  Yang, JL;  Zeng, J
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MEMBRANE FUEL-CELLS  CATALYTIC-ACTIVITY  PLATINUM  NANOCRYSTALS  EVOLUTION  SHAPE  NANOPARTICLES  DURABILITY  CHALLENGES  STABILITY  
Discovery of main group single Sb-N(4)active sites for CO(2)electroreduction to formate with high efficiency 期刊论文
ENERGY & ENVIRONMENTAL SCIENCE, 2020, 卷号: 13, 期号: 9, 页码: 2856-2863
Authors:  Jiang, ZL;  Wang, T;  Pei, JJ;  Shang, HS;  Zhou, DN;  Li, HJ;  Dong, JC;  Wang, Y;  Cao, R;  Zhuang, ZB;  Chen, WX;  Wang, DS;  Zhang, JT;  Li, YD
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CO2 REDUCTION  CARBON-DIOXIDE  FORMIC-ACID  ELECTROCHEMICAL REDUCTION  TIN  CATALYSTS  CONVERSION  NANOWIRES  
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  
Coalescence of Au Nanoparticles without Ligand Detachment 期刊论文
PHYSICAL REVIEW LETTERS, 2020, 卷号: 124, 期号: 6, 页码: -
Authors:  Guo, P;  Gao, Y
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SELF-ASSEMBLED MONOLAYERS  GOLD NANOPARTICLES  FORCE-FIELD  GROWTH  NANOCRYSTALS  WATER  DYNAMICS  NANOCLUSTERS  SIMULATION  ATTACHMENT  
An oxygen vacancy-rich two-dimensional Au/TiO2 hybrid for synergistically enhanced electrochemical N2 activation and reduction 期刊论文
Journal of Materials Chemistry A, 2020, 卷号: 8, 期号: 14, 页码: 6586-6596
Authors:  Zhao, Sen;  Liu, Han-Xuan;  Qiu, Yu;  Liu, Shuang-Quan;  Diao, Jin-Xiang;  Chang, Chun-Ran;  Si, Rui;  Guo, Xiao-Hui
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Gold compounds  Ammonia  Catalyst selectivity  Chemical activation  Electrocatalysts  Electronic structure  Nitrogen  Oxide minerals  Oxygen  Oxygen vacancies  Reduction  Titanium dioxide  Electrocatalytic activity  Electron  donating effects  Faradaic efficiencies  Nitrogen reduction  Rate  limiting steps  Reversible hydrogen electrodes  Technical challenges  Theoretical calculations