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科研机构
江苏大学 [36]
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期刊论文 [35]
会议论文 [1]
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2019 [4]
2018 [10]
2017 [5]
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专题:江苏大学
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Modulation the electronic property of 2D monolayer MoS2 by amino acid
期刊论文
APPLIED MATERIALS TODAY, 2019, 卷号: 14, 页码: 151-158
作者:
Zhang, Peng[1]
;
Wang, Zegao[2]
;
Liu, Lei[3]
;
Klausen, Lasse Hyldgaard[4]
;
Wang, Yin[5]
收藏
  |  
浏览/下载:9/0
  |  
提交时间:2019/12/24
MoS2
Amino acid
Density functional theory
Field effect transistors
Insight into the effect of co-doped to the photocatalytic performance and electronic structure of g-C3N4 by first principle
期刊论文
APPLIED CATALYSIS B-ENVIRONMENTAL, 2019, 卷号: 241, 页码: 319-328
作者:
Zhu, Zhi[1]
;
Tang, Xu[2]
;
Wang, Tianshuai[3]
;
Fan, Wenqian[4]
;
Liu, Zhi[5]
收藏
  |  
浏览/下载:10/0
  |  
提交时间:2019/12/24
Co-doped
Photoelectric properties
High-efficiency
Density functional theory
Photocatalytic degradation 2-mercaptobenzothiazole
Studying of Co-doped g-C3N4 and modified with Fe3O4 quantum dots on removing tetracycline
期刊论文
JOURNAL OF ALLOYS AND COMPOUNDS, 2019, 卷号: 775, 页码: 248-258
作者:
Zhu, Zhi[1]
;
Tang, Xu[2]
;
Fan, Wenqian[3]
;
Liu, Zhi[4]
;
Huo, Pengwei[5]
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2019/12/24
Density functional theory
Co-doped
Fe3O4-QDs
Photocatalytic degradation
Oxidation-reduction centre
Quantum effect
Edge modification induced giant rectification effect in armchair C2N-h2D nanoribbons
期刊论文
SOLID STATE COMMUNICATIONS, 2019, 卷号: 289, 页码: 61-66
作者:
He, Jing-Jing[1]
;
Guo, Yan-Dong[2]
;
Yan, Xiao-Hong[3]
;
Zeng, Hong-Li[4]
;
Ni, Yang[5]
收藏
  |  
浏览/下载:19/0
  |  
提交时间:2019/12/24
Electronic transport
Rectification effect
Density-functional theory
Nonequilibrium Greed's function
NO Adsorption and Oxidation on Mn-doped CeO2 (111) Surfaces: A DFT plus U Study
期刊论文
AEROSOL AND AIR QUALITY RESEARCH, 2018, 卷号: 18, 期号: 4, 页码: 1080-1088
作者:
Liu, Lu[1]
;
Zheng, Chenghang[2]
;
Wang, Junfeng[3]
;
Zhang, Yongxin[4]
;
Gao, Xiang[5]
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2019/12/24
Adsorption
Ceria
Manganese
NO
Density functional theory
A comprehensive theoretical study of structural optimization, interaction energies calculations and solvent effects between ractopamine and functional monomers in molecular imprinting polymers
期刊论文
POLYMER BULLETIN, 2018, 卷号: 75, 期号: 5, 页码: 1981-1996
作者:
Wu, Haiyan[1]
;
Li, Xin[2]
;
Meng, Suci[3]
;
Xu, Jicheng[4]
;
Zhang, Wenchi[5]
收藏
  |  
浏览/下载:6/0
  |  
提交时间:2019/12/24
Ractopamine
Functional monomers
Density functional theory
Molecular imprinting polymers
An accurate empirical method to predict the adsorption strength for pi-orbital contained molecules on two dimensional materials
期刊论文
JOURNAL OF MOLECULAR GRAPHICS & MODELLING, 2018, 卷号: 82, 页码: 93-100
作者:
Li, Hongping[1]
;
Wang, Changwei[2]
;
Xun, Suhang[3]
;
He, Jing[4]
;
Jiang, Wei[5]
收藏
  |  
浏览/下载:9/0
  |  
提交时间:2019/12/24
Adsorption strength
Density functional theory
Hexagonal boron nitride
Graphene
pi-orbital contained molecules
Nonmetal doping induced electronic and magnetic properties in MoSe2 monolayer
期刊论文
CHEMICAL PHYSICS LETTERS, 2018, 卷号: 692, 页码: 69-74
作者:
Li, Hongping[1]
;
Huang, Songlei[2]
;
Zhang, Quan[3]
;
Zhu, Zhipeng[4]
;
Li, Changsheng[5]
收藏
  |  
浏览/下载:12/0
  |  
提交时间:2019/12/24
Density functional theory
MoSe2 monolayer
Nonmetals doping
Electronic and magnetic properties
Adsorption properties of AlN on Si(111) surface: A density functional study
期刊论文
APPLIED SURFACE SCIENCE, 2018, 卷号: 436, 页码: 50-57
作者:
Yuan, Yinmei[1]
;
Zuo, Ran[2]
;
Mao, Keke[3]
;
Tang, Binlong[4]
;
Zhang, Zhou[5]
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2019/12/24
AlN
Si(111)
Adsorption
Electronic properties
Density functional theory
A relay identification fluorescence probe for Fe3+ and phosphate anion and its applications
期刊论文
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2018, 卷号: 191, 页码: 172-179
作者:
Tang, Xu[1]
;
Wang, Yun[2]
;
Han, Juan[3]
;
Ni, Liang[4]
;
Wang, Lei[5]
收藏
  |  
浏览/下载:11/0
  |  
提交时间:2019/12/24
Fluorescence
Ferric ion
Phosphate anion
Density functional theory calculations
Cell imaging
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