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福州大学 [42]
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期刊论文 [42]
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2019 [3]
2018 [6]
2017 [2]
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The Mechanism for the Half-Metal to Insulator Transition at the Fe3O4/ZnAl2O4 Interface
期刊论文
PHYSICA STATUS SOLIDI B-BASIC SOLID STATE PHYSICS, 2019, 卷号: 256
作者:
Jin, Zhejunyu
;
Li, Zongxiao
;
Pu, Xiaohua
;
Zhao, Weiwei
;
Ding, Kaining
收藏
  |  
浏览/下载:17/0
  |  
提交时间:2019/11/21
interface
electronic structure
phonon dispersion
Verwey transition
ordering parameters
Improvement of photocatalytic activity of g-C3N4 by five-membered heterocyclic small molecule modifications: A theoretical prediction
期刊论文
APPLIED SURFACE SCIENCE, 2019, 卷号: 478, 页码: 119-127
作者:
Zhang, Yongli
;
Ren, Chunjin
;
Zhang, Yongfan
;
Lin, Wei
;
Ding, Kaining
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2019/11/21
Theoretical Design of Layered AlGaS3 as a New Nonlinear Optical Material with a Strong Second Harmonic Generation Response Published as part of a Crystal Growth and Design virtual special issue on Crystalline Functional Materials in Honor of Professor Xin-Tao Wu
期刊论文
CRYSTAL GROWTH & DESIGN, 2019, 卷号: 19, 页码: 1632-1639
作者:
Lin, Jing
;
Huang, Jiajia
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  |  
浏览/下载:2/0
  |  
提交时间:2019/11/21
Effects of ligand functionalization on the photocatalytic properties of titanium-based MOF: A density functional theory study
期刊论文
AIP ADVANCES, 2018, 卷号: 8
作者:
Li, Yi
;
Fu, Yuqing
;
Ni, Bilian
;
Ding, Kaining
;
Chen, Wenkai
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2019/11/21
Electrochemical fabrication of shape-controlled Cu2O with spheres, octahedrons and truncated octahedrons and their electrocatalysis for ORR
期刊论文
NEW JOURNAL OF CHEMISTRY, 2018, 卷号: 42, 页码: 458-464
作者:
Zhang, Xiaofeng
;
Zhang, Yi
;
Huang, Huodi
;
Cai, Jiannan
;
Ding, Kaining
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2019/11/21
Different Atomic Terminations Affect the Photocatalytic Nitrogen Fixation of Bismuth Oxybromide: A First Principles Study
期刊论文
CHEMISTRY-AN ASIAN JOURNAL, 2018, 卷号: 13, 页码: 799-808
作者:
Liu, Hongxian
;
Fang, Zhenxing
;
Su, Yongfei
;
Suo, Yuanli
;
Huang, Shuping
收藏
  |  
浏览/下载:9/0
  |  
提交时间:2019/11/21
photocatalysis
nitrogen fixation
atomic termination
bismuth oxybromide
density functional theory
Indium selenide monolayer: a two-dimensional material with strong second harmonic generation
期刊论文
CRYSTENGCOMM, 2018, 卷号: 20, 页码: 2573-2582
作者:
Lin, Jing
;
Fang, Zhenxing
;
Tao, Huilin
;
Li, Yi
;
Huang, Xin
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2019/11/21
Toward improving CO2 dissociation and conversion to methanol via CO-hydrogenation on Cu(100) surface by introducing embedded Co nanoclusters as promoters: A DFT study
期刊论文
APPLIED SURFACE SCIENCE, 2018, 卷号: 427, 页码: 837-847
作者:
Qiu, Mei
;
Tao, Huilin
;
Li, Yali
;
Li, Yi
;
Ding, Kaining
收藏
  |  
浏览/下载:11/0
  |  
提交时间:2019/11/21
Methanol synthesis
Bimetallic alloys
CO2 reduction
Density functional theory
The functionalization effect of benzoic acid and anisole on the photocatalytic activity of monolayer MoS2
期刊论文
APPLIED SURFACE SCIENCE, 2018, 卷号: 437, 页码: 314-320
作者:
Suo, Yuanli
;
Liu, Hongxian
;
Huang, Shuping
;
Zhang, Yongfan
;
Ding, Kaining
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2019/11/21
Anisole
DFT
The functionalization
Benzoic acid
Monolayer MoS2
The photocatalytic activity
Why does F-doping enhance the photocatalytic water-splitting performance of mBiVO(4)? - a density functional theory study
期刊论文
NEW JOURNAL OF CHEMISTRY, 2017, 卷号: 41, 页码: 1094-1102
作者:
Wen, Lili
;
Ding, Kaining
;
Huang, Shuping
;
Zhang, Yongfan
;
Lia, Yi
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2019/11/21
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