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中国科学院上海应用物理研究所机构知识库
Knowledge Management System Of Shanghai Institute of Applied Physics, CAS
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中科院上海应用物理... [39]
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Theoretical analyses of chemical bonding in terminal EThF2 (E = O, S, Se, Te)
期刊论文
NUCLEAR SCIENCE AND TECHNIQUES, 2019, 卷号: 30, 期号: 5, 页码: —
Authors:
Li, YL
;
Xiong, XG
;
Liu, HT
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Submit date:2019/12/30
SMALL-CORE PSEUDOPOTENTIALS
MATRIX INFRARED-SPECTRA
ELECTRONIC-STRUCTURE
SOLID ARGON
ACTINIDE
THORIUM
SPECTROSCOPY
LANTHANIDE
COVALENCY
ATOMS
Infrared Spectroscopic and Theoretical Studies of the 3d Transition Metal Oxyfluoride Molecules
期刊论文
INORGANIC CHEMISTRY, 2019, 卷号: 58, 期号: 15, 页码: 9796-9810
Authors:
Wei, R
;
Fang, ZT
;
Vasiliu, M
;
Dixon, DA
;
Andrews, L
;
Gong, Y
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Submit date:2020/10/16
DENSITY-FUNCTIONAL CALCULATIONS
2ND-ORDER PERTURBATION-THEORY
COUPLED-CLUSTER THEORY
MATRIX-ISOLATION
OXYGEN DIFLUORIDE
BENCHMARK CALCULATIONS
ELECTRONIC-STRUCTURE
VIBRATIONAL-SPECTRA
TRIPLE EXCITATIONS
CORRELATION-ENERGY
Synthesis of a dinuclear europium(III) complex through deprotonation and oxygen-atom transfer of trimethylamine N-oxide
期刊论文
DALTON TRANSACTIONS, 2019, 卷号: 48, 期号: 46, 页码: 17158-17162
Authors:
Li, YJ
;
Chen, XT
;
Gong, Y
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Submit date:2020/10/16
BASE INDUCED REDUCTIONS
S HYDROGEN-BONDS
C-H ACTIVATION
RARE-EARTH
LANTHANIDE COMPLEXES
COORDINATION POLYMERS
ELECTRONIC-STRUCTURE
STABILIZATION
DEOXYGENATION
REACTIVITY
Determination of interstitial oxygen atom position in U2N3+xOy by near edge structure study
期刊论文
JOURNAL OF NUCLEAR MATERIALS, 2018, 卷号: 504, 页码: 215-220
Authors:
Jiang, AK
;
Zhao, YW
;
Long, Z
;
Hu, Y
;
Wang, XF
;
Yang, RL
;
Bao, HL
;
Zeng, RG
;
Liu, KZ
Adobe PDF(1164Kb)
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Submit date:2018/09/06
X-ray-absorption
Initial Oxidation Behaviors
Transition-metal Oxides
Uranium-dioxide
K-edge
Electronic-structure
Fine-structure
Spectroscopy
Nitride
Spectra
Fabrication of NiSe2 by direct selenylation of a nickel surface
期刊论文
APPLIED SURFACE SCIENCE, 2018, 卷号: 428, 页码: 623-629
Authors:
Sun, HL
;
Liang, ZF
;
Shen, KC
;
Luo, M
;
Hu, JB
;
Huang, H
;
Zhu, ZY
;
Li, ZJ
;
Jiang, Z
;
Song, F
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Submit date:2018/09/06
Transition-metal-dichalcogenide
Sensitized Solar-cells
Solid-state Synthesis
Hydrothermal Synthesis
Electronic-structure
Nanowire Film
Thin-films
Efficient
Electrocatalyst
Growth
Unraveling the oxygen vacancy structures at the reduced CeO2(111) surface
期刊论文
PHYSICAL REVIEW MATERIALS, 2018, 卷号: 2, 期号: 3, 页码: -
Authors:
Han, ZK
;
Yang, YZ
;
Zhu, BE
;
Ganduglia-Pirovano, MV
;
Gao, Y
Adobe PDF(5553Kb)
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Submit date:2018/09/06
Scanning-tunneling-microscopy
Gas Shift Reaction
Co Oxidation
Electronic-structure
Defect Structure
Ceria
Catalysts
Water
Nanoparticles
Gold
Thiolate-Protected Hollow Gold Nanospheres
期刊论文
ACTA PHYSICO-CHIMICA SINICA, 2018, 卷号: 34, 期号: 7, 页码: 770-775
Authors:
Xu, WW
;
Gao, Y
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Submit date:2018/09/06
Effective Core Potentials
X-ray Crystallography
Crystal-structure
Optical-properties
Molecular Calculations
Theoretical-analysis
Electronic-properties
Structural Evolution
Nanoparticles
Nanoclusters
Structures and physical properties of two magnetic Fe-based metallic glasses
期刊论文
JOURNAL OF ALLOYS AND COMPOUNDS, 2018, 卷号: 747, 页码: 636-639
Authors:
Zhang, JL
;
Shan, GC
;
Li, J
;
Wang, YM
;
Shek, CH
Adobe PDF(894Kb)
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Submit date:2018/09/06
Absorption Fine-structure
Electronic-structure
Alloys
Roles
Anion photoelectron spectroscopy and chemical bonding of ThO2- and ThO3-
期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2018, 卷号: 148, 期号: 24, 页码: -
Authors:
Li, YL
;
Zou, JH
;
Xiong, XG
;
Xie, H
;
Tang, ZC
;
Ge, M
;
Zhao, YF
;
Liu, HT
Adobe PDF(1743Kb)
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Submit date:2019/12/17
2-ELECTRON VALENCE INDEXES
ELECTRONIC-STRUCTURE
INFRARED-SPECTRA
ROTATIONAL ANALYSIS
ACTINIDE COMPLEXES
URANIUM-OXIDES
BAND SYSTEMS
BASIS-SETS
MATRIX
UO2
Atomic-level insight into super-efficient electrocatalytic oxygen evolution on iron and vanadium co-doped nickel (oxy)hydroxide
期刊论文
NATURE COMMUNICATIONS, 2018, 卷号: 9, 期号: -, 页码: -
Authors:
Jiang, J
;
Sun, FF
;
Zhou, S
;
Hu, W
;
Zhang, H
;
Dong, JC
;
Jiang, Z
;
Zhao, JJ
;
Li, JF
;
Yan, WS
;
Wang, M
Adobe PDF(4119Kb)
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Submit date:2019/12/17
RAY-ABSORPTION SPECTROSCOPY
WATER OXIDATION ELECTROCATALYST
DOUBLE HYDROXIDE NANOSHEETS
ELECTRONIC-STRUCTURE
ELECTROCHEMICAL EVOLUTION
REACTION DYNAMICS
OXIDE CATALYSTS
REDOX STATES
METAL
SURFACES