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金属研究所 [2]
青海盐湖研究所 [2]
大连化学物理研究所 [2]
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厦门大学 [1]
江苏大学 [1]
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期刊论文 [10]
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Effect of ceramic coating thickness on fracture behaviour of coating structure under thermal shock cycles
期刊论文
CERAMICS INTERNATIONAL, 2022, 卷号: 48, 期号: 8, 页码: 11435-11444
作者:
Liang LH(梁立红)
;
Liu XH
;
Chen LF
;
Wei YG(魏悦广)
收藏
  |  
浏览/下载:27/0
  |  
提交时间:2022/05/17
Coatings
Thermal shock
Fracture
Thickness
Stress
Natural periodicity of electrohydrodynamic spraying in ethanol
期刊论文
JOURNAL OF AEROSOL SCIENCE, 2018, 卷号: 117, 页码: 127-138
作者:
Wang, Zhentao[1]
;
Xia, Lei[2]
;
Tian, Lin[3]
;
Wang, Junfeng[4]
;
Zhan, Shuiqing[5]
收藏
  |  
浏览/下载:9/0
  |  
提交时间:2019/12/24
Electrohydrodynamic spraying
Periodic characteristics
High-speed microscopy
Spraying modes
Electric Bond number
Dielectric properties of pyridine derivative-water clusters: Molecular dynamics simulation
期刊论文
JOURNAL OF MOLECULAR LIQUIDS, 2017, 卷号: 241, 页码: 984-991
作者:
Liu, Jianchuan
;
Jia, Guozhu
;
Lu, Zhou
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  |  
浏览/下载:20/0
  |  
提交时间:2018/06/15
Dielectric Properties
Derivative-water
Md Simulation
Hydrogen-bond
Dielectric properties of pyridine derivative-water clusters: Molecular dynamics simulation
期刊论文
JOURNAL OF MOLECULAR LIQUIDS, 2017, 卷号: 241, 页码: 984-991
作者:
Liu, Jianchuan
;
Jia, Guozhu
;
Lu, Zhou
收藏
  |  
浏览/下载:12/0
  |  
提交时间:2017/12/19
Dielectric properties
Derivative-water
MD simulation
Hydrogen-bond
Dielectric properties of pyridine derivative-water clusters: Molecular dynamics simulation
期刊论文
JOURNAL OF MOLECULAR LIQUIDS, 2017, 卷号: 241, 页码: 984-991
作者:
Liu, Jianchuan
;
Lu, Zhou
;
Jia, Guozhu
收藏
  |  
浏览/下载:16/0
  |  
提交时间:2017/12/19
Dielectric properties
Derivative-water
MD simulation
Hydrogen-bond
Molecular properties of excited electronic state: Formalism, implementation, and applications of analytical second energy derivatives within the framework of the time-dependent density functional theory/molecular mechanics
期刊论文
http://dx.doi.org/10.1063/1.4863563, 2014
Zeng, Qiao
;
Liu, Jie
;
Liang, WanZhen
;
刘婕
;
梁万珍
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  |  
浏览/下载:6/0
  |  
提交时间:2015/07/22
ORBITAL GHO METHOD
INTERMOLECULAR POTENTIAL FUNCTION
TAMM-DANCOFF APPROXIMATION
RED FLUORESCENT PROTEINS
CONSISTENT-FIELD METHOD
DIELS-ALDER REACTIONS
GAUSSIAN-TYPE BASIS
LARGE STOKES SHIFT
QM/MM SIMULATIONS
GEOMETRY OPTIMIZATIONS
Correlations between B-11 NMR parameters and structural characters in borate and borosilicate minerals investigated by high-resolution MAS NMR and ab initio calculations
期刊论文
PHYSICS AND CHEMISTRY OF MINERALS, 2012, 卷号: 39, 期号: 5, 页码: 363-372
作者:
Zhou, Bing
;
Sun, Zhaohua
;
Yao, Yefeng
;
Pan, Yuanming
收藏
  |  
浏览/下载:12/0
  |  
提交时间:2018/06/19
Ultra High Field
High-resolution Solid-state Nmr
Borates
Borosilicates
Ab Initio Calculations
Bridging Oxygen
Nnn Cations
Fbb Symmetry
Bond Valence
Correlation
Correlations between B-11 NMR parameters and structural characters in borate and borosilicate minerals investigated by high-resolution MAS NMR and ab initio calculations
期刊论文
PHYSICS AND CHEMISTRY OF MINERALS, 2012, 卷号: 39, 期号: 5, 页码: 363-372
作者:
Zhou, Bing
;
Sun, Zhaohua
;
Yao, Yefeng
;
Pan, Yuanming
收藏
  |  
浏览/下载:15/0
  |  
提交时间:2018/06/19
Ultra High Field
High-resolution Solid-state Nmr
Borates
Borosilicates
Ab Initio Calculations
Bridging Oxygen
Nnn Cations
Fbb Symmetry
Bond Valence
Correlation
Mechanism of the influence of the interaction between interstitial H atom and doped atom on the dehydrogenation performance of LiNH2
期刊论文
ACTA PHYSICA SINICA, 2011, 卷号: 60, 期号: 11, 页码: 5
作者:
Lu Guang-Xia
;
Zhang Hui
;
Zhang Guo-Ying
;
Liang Ting
;
Li Dan
收藏
  |  
浏览/下载:25/0
  |  
提交时间:2021/02/02
hydrogen storage materials
first-principles calculation
defect
dehydrogenation mechanics
Mechanism of the influence of the interaction between interstitial H atom and doped atom on the dehydrogenation performance of LiNH(2)
期刊论文
Acta Physica Sinica, 2011, 卷号: 60, 期号: 11
G. X. Lu
;
H. Zhang
;
G. Y. Zhang
;
T. Liang
;
D. Li
;
S. L. Zhu
收藏
  |  
浏览/下载:11/0
  |  
提交时间:2012/04/13
hydrogen storage materials
first-principles calculation
defect
dehydrogenation mechanics
hydrogen-storage materials
1st-principles
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