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兰州大学 [9]
广州能源研究所 [1]
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期刊论文 [10]
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2015 [2]
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physics [10]
chemistry [2]
materials ... [2]
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Kinetic and potential parts of nuclear symmetry energy: the role of Fock terms
期刊论文
JOURNAL OF PHYSICS G-NUCLEAR AND PARTICLE PHYSICS, 2015, 卷号: 42, 期号: 9
作者:
Zhao, Q
;
Sun, BY
;
Long, WH
收藏
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浏览/下载:3/0
  |  
提交时间:2017/01/13
symmetry energy
nuclear matter
covariant density functional theory
relativistic Hartree-Fock theory
Magnetic spin moment reduction in photoexcited ferromagnets through exchange interaction quenching: beyond the rigid band approximation
期刊论文
JOURNAL OF PHYSICS-CONDENSED MATTER, 2015, 卷号: 27, 期号: 20
作者:
Zhang, GP
;
Si, MS
;
Bai, YH
;
George, TF
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  |  
浏览/下载:2/0
  |  
提交时间:2017/01/13
magnetism
first-principles
density functional theory
A theoretical study of thiophenic compounds adsorption on cation-exchanged Y zeolites
期刊论文
APPLIED SURFACE SCIENCE, 2011, 卷号: 257, 期号: 17
-
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  |  
浏览/下载:3/0
  |  
提交时间:2014/12/05
Adsorption desulfurization
Cation-exchanged zeolites
Thiophenic compounds
Density functional theory (DFT)
Density functional theory study of the chemisorption of CO on Ir/MgO(100)
期刊论文
APPLIED SURFACE SCIENCE, 2011, 卷号: 257, 期号: 15
-
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  |  
浏览/下载:3/0
  |  
提交时间:2014/12/05
Heterogeneous catalysis
Adsorption
Iridium
Density functional theory
Carbon monoxide
Density functional calculation of transition metal adatom adsorption on graphene
期刊论文
PHYSICA B-CONDENSED MATTER, 2010, 卷号: 405, 期号: 16, 页码: 3337-3341
-
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浏览/下载:3/0
  |  
提交时间:2015/05/25
Adsorption on graphene
Density-functional theory
Metal-nonmetal contacts
Electron density of states
W-doped anatase TiO(2) transparent conductive oxide films: Theory and experiment
期刊论文
journal of applied physics, 2010, 卷号: 107, 期号: 6, 页码: 4
作者:
Chen, De-ming
;
Xu, Gang
;
Miao, Lei
;
Chen, Li-hua
;
Nakao, Setsuo
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浏览/下载:22/0
  |  
提交时间:2014/12/24
conduction bands
density functional theory
Fermi level
sputter deposition
thin films
titanium compounds
transparency
X-ray photoelectron spectra
First-principles calculations on the electronic and vibrational properties of beta-V2O5
期刊论文
CHINESE PHYSICS B, 2009, 卷号: 18, 期号: 11, 页码: 4988-4994
作者:
Zhou, B
;
Su, Q
;
He, DY
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浏览/下载:61/0
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提交时间:2015/05/25
ab initio
beta-V2O5
density functional perturbation theory
Raman spectrum
Electronic properties of MgO nanotube clusters studied with density functional theory
期刊论文
ACTA PHYSICA SINICA, 2009, 卷号: 58, 期号: 3, 页码: 1603-1607
作者:
Chen, L
;
Xu, C
;
Zhang, XF
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浏览/下载:5/0
  |  
提交时间:2015/05/25
MgO
Nanotube cluster
density functional theory(DFT)
electronic structure
Theoretical investigation on molecular rectification on the basis of asymmetric substitution and proton transfer reaction
期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2008, 卷号: 129, 期号: 22
-
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浏览/下载:6/0
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提交时间:2014/12/05
bonds (chemical)
chemical exchanges
density functional theory
Fermi level
Theoretical study on the hydrogen bond interaction between adrenaline and dimethyl sulphoxide
期刊论文
CHINESE JOURNAL OF CHEMICAL PHYSICS, 2004, 卷号: 17, 期号: 2
-
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  |  
浏览/下载:4/0
  |  
提交时间:2014/12/05
adrenaline
dimethyl sulphoxide
density functional theory
hydrogen bond
structure
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