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Efficient electrochemical reduction of CO to C-2 products on the transition metal and boron co-doped black phosphorene 期刊论文
CHINESE CHEMICAL LETTERS, 2022, 卷号: 33, 期号: 4, 页码: 2183-2187
Authors:  Kong, Lingyi;  Chen, Zhe;  Cai, Qinghai;  Yin, Lichang;  Zhao, Jingxiang
Favorite  |  View/Download：43/0  |  Submit date：2022/07/14
CO reduction  Electrocatalysis  Multi-carbon products  Density functional theory  2D black phosphorene  
Boosting electrocatalytic activity for CO2 reduction on nitrogen-doped carbon catalysts by co-doping with phosphorus 期刊论文
JOURNAL OF ENERGY CHEMISTRY, 2021, 卷号: 54, 页码: 143-150
Authors:  Chen, Shuo;  Liu, Tianfu;  Olanrele, Samson O.;  Lian, Zan;  Si, Chaowei;  Chen, Zhimin;  Li, Bo
Favorite  |  View/Download：106/0  |  Submit date：2021/03/15
Metal-free catalyst  CO2 reduction  Co-doping, DFT  
Theoretical investigation of optoelectronic and magnetic properties of Co-doped ZnS and (Al, Co) co-doped ZnS 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2020, 卷号: 174, 页码: 8
Authors:  Khan, Muhammad Sheraz;  Shi, Lijie;  Zou, Bingsuo;  Ali, Sajjad
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Dilute magnetic conductor  Semiconductor  Ferromagnetism  Spintronic  Optical properties  
Hollow CaTiO3 cubes modified by La/Cr co-doping for efficient photocatalytic hydrogen production 期刊论文
APPLIED CATALYSIS B-ENVIRONMENTAL, 2018, 卷号: 225, 页码: 139-147
Authors:  Wang, RN;  Ni, S;  Liu, G;  Xu, XX;  Xu, XX (reprint author), Tongji Univ, Shanghai Key Lab Chem Assessment & Sustainabil, Sch Chem Sci & Engn, 1239 Siping Rd, Shanghai 200092, Peoples R China.
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Visible-light Irradiation  H-2 Production  In-situ  Codoped Srtio3  Evolution  Chromium  Water  Driven  Tio2  Nanostructures  
Photocatalytic hydrogen production over Aurivillius compound Bi3TiNbO9 and its modifications by Cr/Nb co-doping 期刊论文
APPLIED CATALYSIS B-ENVIRONMENTAL, 2017, 卷号: 217, 页码: 342-352
Authors:  Jiang, Lu;  Ni, Shuang;  Liu, Gang;  Xu, Xiaoxiang;  Xu, XX (reprint author), Tongji Univ, Shanghai Key Lab Chem Assessment & Sustainabil, Sch Chem Sci & Engn, 1239 Siping Rd, Shanghai 200092, Peoples R China.
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Bi3tinbo9  Cr/nb Co-doping  Hydrogen Production  Photocatalysis  Dft Calculation  
Half-Metallicity in Co-Doped WSe2 Nanoribbons 期刊论文
AMER CHEMICAL SOC, 2017, 卷号: 9, 期号: 44, 页码: 38796-38801
Authors:  Xu, Runzhang;  Liu, Bilu;  Zou, Xiaolong;  Cheng, Hui-Ming;  Zou, XL (reprint author), Tsinghua Univ, Tsinghua Berkeley Shenzhen Inst, Low Dimens Mat & Devices Lab, Shenzhen 518055, Guangdong, Peoples R China.
Favorite  |  View/Download：74/0  |  Submit date：2018/01/10
Half-metal  Transition-metal Dichalcogenides  Doping Spintronics  Density Functional Theory Calculations  
Density functional study on size-dependent structures, stabilities, electronic and magnetic properties of AunM (M=Al and Si, n=1-9) clusters: comparison with pure gold clusters 期刊论文
Journal of Molecular Modeling, 2012, 卷号: 18, 期号: 7, 页码: 3061-3072
Authors:  Y. F. Li;  A. J. Mao;  Y. Li;  X. Y. Kuang
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Cluster  Density Functional Theory  Electronic Property  Geometric  Configuration  Relative Stability  Nanoclusters  Spectroscopy  Geometries  Oxidation  Energies  Cations  Silver  Co  
Probing the structural and electronic properties of lanthanide-metal-doped silicon clusters: M@Si(6) (M = Pr, Gd, Ho) 期刊论文
Physics Letters A, 2011, 卷号: 375, 期号: 30-31, 页码: 2836-2844
Authors:  H. F. Li;  X. Y. Kuang;  H. Q. Wang
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Density Functional Theory  M@si(6)(-) (m = Pr  Gd  Photoelectron Spectra  Ho) Clusters  Electronic Properties  Correlation-energy  Basis-sets  Si  Density  Pseudopotentials  Approximation  Exchange  Anions  Atoms  
Effect of carbon/hydrogen species incorporation on electronic structure of anatase-TiO(2) 期刊论文
Journal of Applied Physics, 2011, 卷号: 110, 期号: 7
Authors:  N. Li;  K. L. Yao;  L. Li;  Z. Y. Sun;  G. Y. Gao;  L. Zhu
Adobe PDF(1433Kb)  |  Favorite  |  View/Download：84/0  |  Submit date：2012/04/13
Generalized Gradient Approximation  Visible-light Photocatalysis  Doped  Tio2  
Bandgap narrowing of titanium oxide nanosheets: homogeneous doping of molecular iodine for improved photoreactivity 期刊论文
Journal of Materials Chemistry, 2011, 卷号: 21, 期号: 38, 页码: 14672-14679
Authors:  G. Liu;  C. H. Sun;  L. Z. Wang;  S. C. Smith;  G. Q. Lu;  H. M. Cheng
Adobe PDF(507Kb)  |  Favorite  |  View/Download：58/0  |  Submit date：2012/04/13
Visible-light Photocatalysis  Doped Tio2  Surface Science  Tantalum  Oxide  Photoactivity  Dioxide  Anatase  Degradation  Irradiation  Mechanisms