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科研机构
厦门大学 [68]
内容类型
期刊论文 [64]
学位论文 [4]
发表日期
2014 [3]
2013 [4]
2012 [2]
2011 [2]
2010 [3]
2009 [1]
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专题:厦门大学
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A Chiral Gold Nanocluster Au-20 Protected by Tetradentate Phosphine Ligands
期刊论文
http://dx.doi.org/10.1002/anie.201308599, 2014
Wan, Xian-Kai
;
Yuan, Shang-Fu
;
Lin, Zhi-Wei
;
Wang, Quan-Ming
;
王泉明
收藏
  |  
浏览/下载:7/0
  |  
提交时间:2015/07/22
OPTICAL-PROPERTIES
CRYSTAL-STRUCTURE
CLUSTERS
NANOPARTICLE
AU-38
The V state of ethylene: valence bond theory takes up the challenge
期刊论文
http://dx.doi.org/10.1007/s00214-013-1441-x, 2014
Wu, Wei
;
Zhang, Huaiyu
;
Braida, Benoit
;
Shaik, Sason
;
Hiberty, Philippe C.
;
吴玮
收藏
  |  
浏览/下载:15/0
  |  
提交时间:2015/07/22
VERTICAL EXCITATION-ENERGIES
COUPLED-CLUSTER CALCULATIONS
EXCITED-STATES
CONFIGURATION-INTERACTION
WAVE-FUNCTIONS
DYNAMIC CORRELATION
BREATHING ORBITALS
BASIS-SETS
PI
ASTERISK
A chiral gold nanocluster Au20 protected by tetradentate phosphine ligands
期刊论文
http://dx.doi.org/10.1002/anie.201308599, 2014
Wan, Xian-Kai
;
Yuan, Shang-Fu
;
Lin, Zhi-Wei
;
Wang, Quan-Ming
;
林志为
;
王泉明
收藏
  |  
浏览/下载:2/0
  |  
提交时间:2015/07/22
Crystal symmetry
Dichloromethane
Ligands
Nanoclusters
Nanostructures
Phosphorus compounds
Probing the electronic properties of W3Ox -/0 (x = 0-2) and W32- clusters: The aromaticity of W3 and W32-
期刊论文
http://dx.doi.org/10.1021/jp400673s, 2013
Lin, Shu-Juan
;
Zhang, Xian-Hui
;
Xu, Lei
;
Wang, B
;
Zhang, Yong-
;
Huang,
;
张先徽
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  |  
浏览/下载:4/0
  |  
提交时间:2015/07/22
Aromatization
Chemical bonds
Density functional theory
Molecular orbitals
Negative ions
Oxygen
Mechanistic Insights Revealed by the Crystal Structure of a Histidine Kinase with Signal Transducer and Sensor Domains
期刊论文
http://dx.doi.org/10.1371/journal.pbio.1001493, 2013
Wang, Chen
;
Sang, Jiayan
;
Wang, Jiawei
;
Su, Mingyan
;
Downey, Jennifer S.
;
Wu, Qinggan
;
Wang, Shida
;
Cai, Yongfei
;
Xu, Xiaozheng
;
Wu, Jun
;
Senadheera, Dilani B.
;
Cvitkovitch, Dennis G.
;
Chen, Lin
;
Goodman, Steven D.
;
Han, Aidong
;
韩爱东
收藏
  |  
浏览/下载:6/0
  |  
提交时间:2015/07/22
ESCHERICHIA-COLI
HAMP DOMAIN
PAS DOMAIN
STREPTOCOCCUS-PNEUMONIAE
RESPONSE-REGULATOR
ALPHA-HELICES
CONFORMATIONAL-CHANGES
MOLECULAR-GRAPHICS
BIOFILM FORMATION
2-COMPONENT
Exohedrally stabilized C70 isomer with adjacent pentagons characterized by crystallography
期刊论文
http://dx.doi.org/10.1039/c3sc50141h, 2013
Tan, Yuan-Zhi
;
Li, Jia
;
Du, Ming-Yue
;
Lin, Shui-Chao
;
Xie, Su-Yuan
;
Lu, Xin
;
Huang, Rong-Bin
;
Zheng, Lan-Sun
;
谢素原
;
黄荣彬
;
郑兰荪
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  |  
浏览/下载:3/0
  |  
提交时间:2015/07/22
Crystallography
Molecular graphics
X ray diffraction analysis
Control of the Charge Distribution and Modulation of the Class II-III Transition in Weakly Coupled Mo-2-Mo-2 Systems
期刊论文
http://dx.doi.org/10.1021/ic4017855, 2013
Xiao, Xuan
;
Liu, Chun Y.
;
He, Qiao
;
Han, Mei Juan
;
Meng, Miao
;
Lei, Hao
;
Lu, Xin
;
何桥
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2015/07/22
CONNECTING DIMOLYBDENUM REDOX
ELECTRON-TRANSFER REACTIONS
MIXED-VALENCE
QUADRUPLE BONDS
CHROMOPHORIC CENTERS
RUTHENIUM AMMINES
MOLECULAR PAIR
COMPLEXES
UNITS
ENERGY
Enumerating tree-like polyphenyl isomers
期刊论文
http://dx.doi.org/10.1088/1742-5468/2012/12/P12018, 2012
Deng, Kecai
;
Qian, Jianguo
;
Zhang, Fuji
;
张福基
;
钱建国
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2013/12/12
WIENER INDEXES
POLYCHLORINATED-BIPHENYLS
P-POLYPHENYL
CHAINS
POLYMERIZATION
MOLECULES
BENZENE
SYSTEMS
NUMBER
Chemical/Physical Pressure Tunable Spin-Transition Temperature and Hysteresis in a Two-Step Spin Crossover Porous Coordination Framework
期刊论文
2012
Lin, Jian-Bin
;
Xue, Wei
;
Wang, Bao-Ying
;
Tao, Jun
;
陶军
;
Zhang, Wei-Xiong
;
Zhang, Jie-Peng
;
Chen, Xiao-Ming
收藏
  |  
浏览/下载:2/0
  |  
提交时间:2013/01/22
FE(II) COMPLEXES
HALOGENATED ETHYLTETRAZOLES
THEORETICAL DESCRIPTION
MOLECULAR-INTERACTIONS
COMPOUND
POLYMER
STATE
2D
TRANSFORMATIONS
SYSTEMS
Electronic levels and electrical response of periodic molecular structures from plane-wave orbital-dependent calculations
期刊论文
http://dx.doi.org/10.1103/PhysRevB.84.155127, 2011
Li, Yanli
;
Dabo, Ismaila
;
李艳丽
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2015/07/22
DENSITY-FUNCTIONAL APPROXIMATIONS
TOTAL-ENERGY CALCULATIONS
LONG-RANGE INTERACTIONS
AB-INITIO
HARTREE-FOCK
BOUNDARY-CONDITIONS
EXACT EXCHANGE
SYSTEMS
CHAINS
POLARIZABILITIES
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