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新疆理化技术研究所 [20]
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期刊论文 [18]
学位论文 [2]
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2021 [1]
2020 [3]
2019 [1]
2018 [4]
2017 [3]
2016 [1]
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Physics [3]
Materials ... [2]
Chemistry [1]
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Prediction of Novel van der Waals Boron Oxides with Superior Deep-Ultraviolet Nonlinear Optical Performance
期刊论文
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 2021, 卷号: 60, 期号: 19, 页码: 10791-10797
作者:
Li, H (Li, Hao)[ 1,2,3 ]
;
Min, JM (Min, Jingmei)[ 1 ]
;
Yang, ZH (Yang, Zhihua)[ 1,2 ]
;
Wang, ZH (Wang, Zhenhai)[ 3,4 ]
;
Pan, SL (Pan, Shilie)[ 1,2 ]
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  |  
浏览/下载:81/0
  |  
提交时间:2021/05/06
boron oxides
crystal structure prediction
deep-ultraviolet nonlinear optical material
theoretical calculations
van der Waals
Influence of Ce doping on catalytic oxidation of NO on LaCoO3 (011) surface: A DFT study
期刊论文
APPLIED SURFACE SCIENCE, 2020, 卷号: 499, 期号: 1, 页码: 1-9
作者:
Li, XC (Li, Xiaochen)[ 2 ]
;
Gao, HW (Gao, Hongwei)[ 1 ]
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浏览/下载:123/0
  |  
提交时间:2020/01/03
DFT calculations
Adsorption energy
Oxygen chemistry
NO oxidation
Ce doping
Ba-3(BO3)(CO3)F: The First Borate Carbonate Fluoride Synthesized by the High-Temperature Solution Method
期刊论文
CHEMISTRY-A EUROPEAN JOURNAL, 2020, 卷号: 26, 期号: 70, 页码: 16628-16632
作者:
Huang, CM (Huang, Chunmei)[ 1,2 ]
;
Zhang, FF (Zhang, Fangfang)[ 1,2 ]
;
Cheng, SC (Cheng, Shichao)[ 1 ]
;
Yang, ZH (Yang, Zhihua)[ 1,2 ]
;
Li, H (Li, Hao)[ 1,2 ]
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  |  
浏览/下载:52/0
  |  
提交时间:2021/01/05
borate carbonate
borate fluoride
first-principle calculations
synthesis
Norcolocynthenins A and B, two cucurbitane 3-nor-Triterpenoids from Citrullus colocynthis and their cytotoxicity
期刊论文
BIOORGANIC CHEMISTRY, 2020, 卷号: 101, 期号: 8, 页码: 1-5
作者:
Liu, YS (Liu, Yushuang)[ 1,2,4 ]
;
Zhang, L (Zhang, Lu)[ 1 ]
;
Xue, JJ (Xue, Jingjing)[ 3 ]
;
Wang, KB (Wang, Kaibo)[ 4 ]
;
Hua, HM (Hua, Huiming)[ 3 ]
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  |  
浏览/下载:19/0
  |  
提交时间:2020/09/09
Citrullus colocynthis
Cucurbitane nortriterpenoid
Theoretical calculations
Cytotoxicity
DFT Analysis of NO Adsorption on the Undoped and Ce-Doped LaCoO3 (011) Surface
期刊论文
MATERIALS, 2019, 卷号: 12, 期号: 9, 页码: 1-15
作者:
Li, XC (Li, Xiaochen)[ 1,2 ]
;
Gao, HW (Gao, Hongwei)[ 3 ]
收藏
  |  
浏览/下载:43/0
  |  
提交时间:2019/06/28
DFT calculations
LaCoO3 (011) surface
Ce doping
electron transfer
adsorption energy
Influence of Fluorine on Electronic Structures and Nonlinear Optical Effects of A Series of Borate Crystals
学位论文
北京: 中国科学院大学, 2018
作者:
Beenish Bashir
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浏览/下载:20/0
  |  
提交时间:2018/07/06
D10-cation Systems
Borate Fluorides
Fluorooxoborates
First-principles Calculations
Structure-property Relationship
Influence of Fluorine on Electronic Structures and Nonlinear Optical Effects of A Series of Borate Crystals
学位论文
中国科学院新疆理化技术研究所: 中国科学院大学, 2018
作者:
Beenish Bashir
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  |  
浏览/下载:15/0
  |  
提交时间:2018/07/06
D10-cation Systems
Borate Fluorides
Fluorooxoborates
First-principles Calculations
Structure-property Relationship
Two noncentrosymmetric polyphosphates featuring infinite one-dimensional (PO3)(infinity), chain, LiMP2O6 (M = Rb, Cs): Synthesis, structure and optical properties
期刊论文
JOURNAL OF SOLID STATE CHEMISTRY, 2018, 卷号: 266, 期号: 10, 页码: 150-154
作者:
Baiheti, T (Baiheti, Tuohetijiang)[ 1,2 ]
;
Li, H (Li, Hao)[ 1,2 ]
;
Yang, ZH (Yang, Zhihua)[ 1 ]
;
Han, SJ (Han, Shujuan)[ 1 ]
;
Wang, Y (Wang, Ying)[ 1 ]
收藏
  |  
浏览/下载:23/0
  |  
提交时间:2018/10/19
Polyphosphates
Structural Analysis
X-ray Diffraction
Theoretical Calculations
The First Examples of Lithium-Containing Mixed-Alkali Strontium Borates with Different Dimensional Anionic Architectures and Short Cutoff Edges
期刊论文
CHEMISTRY-A EUROPEAN JOURNAL, 2018, 卷号: 24, 期号: 57, 页码: 15355-15364
作者:
Ma, RR (Ma, Ruru)[ 1,2 ]
;
Yang, Y (Yang, Yun)[ 1 ]
;
Hu, C (Hu, Cong)[ 1,2 ]
;
Yang, ZH (Yang, Zhihua)[ 1 ]
;
Pan, SL (Pan, Shilie)[ 1 ]
收藏
  |  
浏览/下载:21/0
  |  
提交时间:2018/10/30
Alkali Metals
Borates
Density Functional Calculations
Strontium
Structure Elucidation
Orientations of nonlocal vibrational modes from combined experimental and theoretical sum frequency spectroscopy
期刊论文
CHEMICAL PHYSICS LETTERS, 2017, 卷号: 683, 期号: 9, 页码: 199-204
作者:
Chase, HM (Chase, Hilary M.)
;
Chen, SL (Chen, Shunli)
;
Fu, L (Fu, Li)
;
Upshur, MA (Upshur, Mary Alice)
;
Rudshteyn, B (Rudshteyn, Benjamin)
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  |  
浏览/下载:22/0
  |  
提交时间:2017/12/05
Sum Frequency Generation
Orientation Analysis
Interfaces
Dft Calculations
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