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Effects of vacancy on the electronic and optical properties of beta-Si3N4 by first-principles
期刊论文
MODERN PHYSICS LETTERS B, 2019, 卷号: 33, 期号: 36
作者:
Lu, Xuefeng
;
Luo, Jianhua
;
Yang, Panfeng
;
Ren, Junqiang
;
Guo, Xin
收藏
  |  
浏览/下载:9/0
  |  
提交时间:2020/06/02
beta-Si3N4
first principles
vacancy
electronic structure
optical properties
Simultaneous Anionic and Cationic Redox in the Mo3S11 Polymer Electrode of a Sodium-Ion Battery
期刊论文
JOURNAL OF PHYSICAL CHEMISTRY C, 2019, 卷号: 123, 期号: 51, 页码: 30856-30862
作者:
Hung, Nguyen T.
;
Yin, Li-Chang
;
Tran, Phong D.
;
Saito, Riichiro
收藏
  |  
浏览/下载:18/0
  |  
提交时间:2021/02/02
Formation of hydroxylated polybrominated diphenyl ethers and hydroxylated polybrominated biphenyls during the adsorption of bromophenols by reduced graphene oxide
期刊论文
CHEMICAL ENGINEERING JOURNAL, 2019, 卷号: 378, 页码: -
作者:
Xie, Jieli
;
Li, Lingyun
;
Sun, Lixiang
;
Pei, Zhiguo
;
Yang, Yanting
收藏
  |  
浏览/下载:63/0
  |  
提交时间:2020/09/10
Reduced graphene oxide
Bromophenol
Oxidative coupling
Hydroxylated polybrominated diphenyl ethers
Hydroxylated polybrominated biphenyls
First-principles investigation of the effects of Re (La, Ce, Pr and Nd) doping on the diopside phase of glass-ceramics
期刊论文
JOURNAL OF NON-CRYSTALLINE SOLIDS, 2019, 卷号: 526, 页码: 7
作者:
Gao, Xueyun
;
Wang, Haiyan
;
Wang, Chengmeng
;
Chen, Shuming
;
Zhao, Ming
收藏
  |  
浏览/下载:38/0
  |  
提交时间:2021/02/02
Diopside
Rare earth
Doping
First-principles
Anisotropy
Reconsider the fluorescence properties of 5-ASA and its sensing mechanism for iodide ion
期刊论文
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2019, 卷号: 223, 页码: 8
作者:
Liu, Lei
;
Sun, Bingqing
;
Pen, Jiancheng
;
Mao, Yueyuan
;
Ding, Ran
收藏
  |  
浏览/下载:226/0
  |  
提交时间:2019/12/02
I- detecting
Potential energy surface
Transition state
Charge transfer
Proton transfer
Thermoelectric performance of a metastable thin-film Heusler alloy
期刊论文
NATURE, 2019, 卷号: 576, 期号: 7785, 页码: 85-+
作者:
Hinterleitner, B.
;
Knapp, I.
;
Poneder, M.
;
Shi, Yongpeng
;
Mueller, H.
收藏
  |  
浏览/下载:20/0
  |  
提交时间:2021/02/02
Efficient activation of peroxymonosulfate by hollow cobalt hydroxide for degradation of ibuprofen and theoretical study
期刊论文
CHINESE CHEMICAL LETTERS, 2019, 卷号: 30, 期号: 12, 页码: 2191-2195
作者:
Ma, Mingfeng
;
Chen, Long
;
Zhao, Jingzhu
;
Liu, Wen
;
Ji, Haodong
收藏
  |  
浏览/下载:32/0
  |  
提交时间:2020/09/09
Cobalt hydroxid
Pharmaceuticals
Peroxymonosulfate
Activation
DFT calculation
Effect of Cu/Al doping on electronic structure and optical properties of ZnO
期刊论文
RESULTS IN PHYSICS, 2019, 卷号: 15
作者:
Dai, Jianfeng
;
Suo, Zhongqiang
;
Li, Zengpeng
;
Gao, Shanshan
收藏
  |  
浏览/下载:2/0
  |  
提交时间:2020/06/02
Cu/Al co-doped ZnO
Electronic structure
Conductivity
Optical properties
First principle study of Mn-doped and vacancy on the magnetism and optical properties of CdS
期刊论文
RESULTS IN PHYSICS, 2019, 卷号: 15
作者:
Suo, Zhongqiang
;
Dai, Jianfeng
;
Li, Zengpeng
;
Gao, Shanshan
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2020/06/02
Mn-doped and Vacancy
CdS
Magnetism
Optical properties
Density functional theory study on the electronic structures and related properties of Ag-doped CH3NH3PbI3 perovskite
期刊论文
RESULTS IN PHYSICS, 2019, 卷号: 15
作者:
Xu, Zi-Wei
;
Zhang, Cai-Rong
;
Wu, You-Zhi
;
Gong, Ji-Jun
;
Wang, Wei
收藏
  |  
浏览/下载:10/0
  |  
提交时间:2022/03/01
Density functional theory
Electronic structures
Perovskite CH3NH3PbI3
Doping
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