CAS OpenIR

Browse/Search Results:  1-10 of 778 Help

Selected(0)Clear Items/Page:    Sort:
Structure of aqueous sodium acetate solutions by X-Ray scattering and density functional theory 期刊论文
PURE AND APPLIED CHEMISTRY, 2020, 卷号: 92, 期号: 10, 页码: 1627-1641
Authors:  Wang, GG;  Zhou, YQ;  Lin, H;  Jing, ZF;  Liu, HY;  Zhu, FY
View  |  Adobe PDF(1456Kb)  |  Favorite  |  View/Download:2/0  |  Submit date:2021/09/06
RADIAL-DISTRIBUTION FUNCTIONS  ALKALI-METAL IONS  MOLECULAR-DYNAMICS  BASIS-SETS  HYDRATION  DIFFRACTION  WATER  CARBOXYLATE  STABILITY  ANION  
Water-Mediated Spontaneously Dynamic Oxygen Migration on Graphene Oxide with Structural Adaptivity for Biomolecule Adsorption* 期刊论文
CHINESE PHYSICS LETTERS, 2020, 卷号: 37, 期号: 6, 页码: -
Authors:  Tu, YS;  Zhao, L;  Sun, JJ;  Wu, YY;  Zhou, XJ;  Chen, L;  Lei, XL;  Fang, HP;  Shi, GS
View  |  Adobe PDF(4565Kb)  |  Favorite  |  View/Download:3/0  |  Submit date:2021/09/06
COVALENT CHEMISTRY  DEVICES  SERIES  BOND  
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
View  |  Adobe PDF(1537Kb)  |  Favorite  |  View/Download:3/0  |  Submit date:2021/09/06
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  
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
View  |  Adobe PDF(2165Kb)  |  Favorite  |  View/Download:4/1  |  Submit date:2021/09/06
DENSITY-FUNCTIONAL THEORY  HIGH-TEMPERATURE NMR  BIS(TRIFLUOROMETHANESULFONYL) IMIDE ANION  IONIC LIQUID  VIBRATIONAL-SPECTRA  RARE-EARTH  MOLECULAR-DYNAMICS  LOCAL-STRUCTURE  BINARY MELTS  BASIS-SET  
Probing NaCl hydrate formation from aqueous solutions by terahertz time-domain spectroscopy 期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2020, 卷号: 22, 期号: 32, 页码: 17791-17797
Authors:  Chen, LG;  Ren, GH;  Liu, LY;  Guo, P;  Wang, ED;  Zhu, ZJ;  Yang, JR;  Shen, JX;  Zhang, ZC;  Zhou, L;  Zhang, JB;  Yang, B;  Zhang, WL;  Gao, Y;  Zhao, HW;  Han, JG
View  |  Adobe PDF(4532Kb)  |  Favorite  |  View/Download:2/0  |  Submit date:2021/09/06
X-RAY  MOLECULAR-DYNAMICS  WATER-STRUCTURE  THZ SPECTRA  ICE  IONS  HYSTERESIS  PRINCIPLES  SCATTERING  PHASE  
Local Coordination and Ordering Engineering to Design Efficient Core-Shell Oxygen Reduction Catalysts 期刊论文
JOURNAL OF THE ELECTROCHEMICAL SOCIETY, 2020, 卷号: 167, 期号: 14, 页码: -
Authors:  Chen, HQ;  Zheng, TL;  He, QG;  Shang, LA;  Wang, GJ;  Wang, Q;  Wang, XJ;  Shi, XB;  Gu, M;  Jiang, Z
View  |  Adobe PDF(1839Kb)  |  Favorite  |  View/Download:1/0  |  Submit date:2021/09/06
HIGH-PERFORMANCE  PLATINUM  ALLOY  AUCU  ELECTROCATALYSTS  NANOPARTICLES  CONVERSION  STABILIZATION  PT3NI  SKIN  
Single-atom Rh/N-doped carbon electrocatalyst for formic acid oxidation 期刊论文
NATURE NANOTECHNOLOGY, 2020, 卷号: 15, 期号: 5, 页码: 390-+
Authors:  Xiong, Y;  Dong, JC;  Huang, ZQ;  Xin, PY;  Chen, WX;  Wang, Y;  Li, Z;  Jin, Z;  Xing, W;  Zhuang, ZB;  Ye, JY;  Wei, X;  Cao, R;  Gu, L;  Sun, SG;  Zhuang, L;  Chen, XQ;  Yang, H;  Chen, C;  Peng, Q;  Chang, CR;  Wang, DS;  Li, YD
View  |  Adobe PDF(3214Kb)  |  Favorite  |  View/Download:2/0  |  Submit date:2021/09/06
INITIO MOLECULAR-DYNAMICS  OXYGEN REDUCTION  PALLADIUM NANOSHEETS  CATALYSTS  IDENTIFICATION  TRANSITION  GRAPHENE  ELECTROOXIDATION  DECOMPOSITION  CONVERSION  
Selectivity Regulation in Au-Catalyzed Nitroaromatic Hydrogenation by Anchoring Single-Site Metal Oxide Promoters 期刊论文
ACS CATALYSIS, 2020, 卷号: 10, 期号: 4, 页码: 2837-2844
Authors:  Zhao, JX;  Chen, CQ;  Xing, CH;  Jiao, ZF;  Yu, MT;  Mei, BB;  Yang, J;  Zhang, BY;  Jiang, Z;  Qin, Y
Adobe PDF(2633Kb)  |  Favorite  |  View/Download:4/1  |  Submit date:2021/09/06
ATOMIC LAYER DEPOSITION  NITRO-COMPOUNDS  CHEMOSELECTIVE HYDROGENATION  ORGANIC FRAMEWORKS  REDUCTION  NANOPARTICLES  CO  OXIDATION  NANOSTRUCTURES  NITROARENES  
Selectivity mechanism of magnesium and calcium in cation-binding pocket structures of phosphotyrosine 期刊论文
PHYSICAL REVIEW E, 2020, 卷号: 101, 期号: 2, 页码: -
Authors:  Tu, YS;  Liu, HD;  Shi, GS;  Zhang, FM;  Su, T;  Wu, YY;  Sun, JJ;  Zhang, L;  Zhang, SL;  Fang, HP
View  |  Adobe PDF(1896Kb)  |  Favorite  |  View/Download:3/0  |  Submit date:2021/09/06
METAL-IONS  CRYSTAL-STRUCTURES  PI INTERACTIONS  DENSITY  ACTIVATION  WATER  
Self-Supported Nanoporous Au3Cu Electrode with Enriched Gold on Surface for Efficient Electrochemical Reduction of CO2 期刊论文
CHEMISTRY-A EUROPEAN JOURNAL, 2020, 卷号: 26, 期号: 18, 页码: 4143-4149
Authors:  Ma, XM;  Shen, YL;  Yao, S;  Shu, M;  Si, R;  An, CH
View  |  Adobe PDF(1344Kb)  |  Favorite  |  View/Download:2/0  |  Submit date:2021/09/06
OXYGEN REDUCTION  CARBON-DIOXIDE  ELECTROREDUCTION  ETHANOL  ELECTROCATALYST  NANOPARTICLES  SELECTIVITY  CATALYST