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科研机构
北京大学 [150]
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期刊论文 [150]
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2017 [14]
2016 [23]
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内容类型:期刊论文
专题:北京大学
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On the shuttling mechanism of a chlorine atom in a chloroaluminum phthalocyanine based molecular switch
期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2017
Song, Huanjun
;
Fu, Cenfeng
;
Li, Na
;
Zhu, Hao
;
Peng, Zhantao
;
Zhao, Wenhui
;
Dai, Jingxin
;
Xing, Lingbo
;
Huang, Zhichao
;
Chen, Wei
;
Wang, Yongfeng
;
Yang, Jinlong
;
Wu, Kai
收藏
  |  
浏览/下载:7/0
  |  
提交时间:2017/12/03
SCANNING-TUNNELING-MICROSCOPY
TOTAL-ENERGY CALCULATIONS
AUGMENTED-WAVE METHOD
SINGLE-MOLECULE
ADSORBED PHTHALOCYANINE
CYCLIC CARBONATES
BASIS-SET
CONDUCTANCE
MANIPULATION
ADSORPTION
In Situ Electron Driven Carbon Nanopillar-Fullerene Transformation through Cr Atom Mediation
期刊论文
NANO LETTERS, 2017
Zhao, Liang
;
Ta, Huy Q.
;
Dianat, Arezoo
;
Soni, Akash
;
Fediai, Artem
;
Yin, Wajian
;
Gemming, Thomas
;
Trzebicka, Barbara
;
Cuniberti, Gianaurelio
;
Liu, Zhongfan
;
Bachmatiuk, Alicja
;
Rummeli, Mark H.
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2017/12/03
In situ TEM
pillared graphene
Cr atoms
carbon nanotube
dynamic transformations
SPACE GAUSSIAN PSEUDOPOTENTIALS
C-60 INTERCALATED GRAPHITE
PILLARED GRAPHENE
IRRADIATION
NANOTUBES
PEAPODS
DIAMOND
NANOSTRUCTURES
DYNAMICS
ONIONS
Prediction of Two-Dimensional Phase of Boron with Anisotropic Electric Conductivity
期刊论文
JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 2017
Cui, Zhi-Hao
;
Jimenez-Izal, Elisa
;
Alexandrova, Anastassia N.
收藏
  |  
浏览/下载:6/0
  |  
提交时间:2017/12/03
SHEETS
NANOTUBES
SURFACE
GROWTH
RISE
Organocopper(III) Spiro Complexes: Synthesis, Structural Characterization, and Redox Transformation
期刊论文
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2017
Liu, Liang
;
Zhu, Miaomiao
;
Yu, Hai-Tao
;
Zhang, Wen-Xiong
;
Xi, Zhenfeng
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2017/12/03
C-H ACTIVATION
CROSS-COUPLING REACTIONS
SUBGROUP METAL-COMPOUNDS
N-CONFUSED PORPHYRINS
MOLECULAR-STRUCTURE
REDUCTIVE ELIMINATION
BOND FORMATION
COPPER(III) COMPLEXES
CHEMISTRY
MECHANISM
Gas-Flow Tailoring Fabrication of Graphene-like Co-Nx-C Nanosheet Supported Sub-10 nm PtCo Nanoalloys as Synergistic Catalyst for Air-Cathode Microbial Fuel Cells
期刊论文
ACS APPLIED MATERIALS & INTERFACES, 2017
Cao, Chun
;
Wei, Liling
;
Zhai, Qiran
;
Ci, Jiliang
;
Li, Weiwei
;
Wang, Gang
;
Shen, Jianquan
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2017/12/03
microbial fuel cells
graphene-like carbon
synergistic catalyst
N/Co-dual doping
PtCo nanoalloys
OXYGEN REDUCTION REACTION
PROTON-EXCHANGE MEMBRANE
HIGH-PERFORMANCE
DOPED CARBON
ALLOY NANOPARTICLES
EFFICIENT CATALYST
ACTIVATED CARBON
HIGHLY EFFICIENT
ORR ACTIVITY
SINGLE-ATOM
Evidence for Ultralow-Energy Vibrations in Large Organic Molecules
期刊论文
NANO LETTERS, 2017
Chen, Hui
;
Pope, Thomas
;
Wu, Zhuo-Yan
;
Wang, Dongfei
;
Tao, Lei
;
Bao, De-Liang
;
Xiao, Wende
;
Zhang, Jun-Long
;
Zhang, Yu-Yang
;
Du, Shixuan
;
Gao, Song
;
Pantelides, Sokrates T.
;
Hofer, Werner A.
;
Gao, Hong-Jun
收藏
  |  
浏览/下载:9/0
  |  
提交时间:2017/12/03
Organic molecules
inelastic electron tunneling spectroscopy
ultralow-energy vibrations
Kondo resonance
KONDO RESONANCE
SINGLE
LIGANDS
ATOM
Combining the spin-separated exact two-component relativistic Hamiltonian with the equation-of-motion coupled-cluster method for the treatment of spin-orbit splittings of light and heavy elements
期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2017
Cao, Zhanli
;
Li, Zhendong
;
Wang, Fan
;
Liu, Wenjian
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2017/12/03
MOLECULAR QUANTUM-MECHANICS
ANO BASIS-SETS
CONFIGURATION-INTERACTION
WAVE-FUNCTIONS
FOCK-SPACE
PROGRAM PACKAGE
SHELL SYSTEMS
DENSITY
STATES
CHEMISTRY
Temperature-Triggered Sulfur Vacancy Evolution in Monolayer MoS2/Graphene Heterostructures
期刊论文
SMALL, 2017
Liu, Mengxi
;
Shi, Jianping
;
Li, Yuanchang
;
Zhou, Xiebo
;
Ma, Donglin
;
Qi, Yue
;
Zhang, Yanfeng
;
Liu, Zhongfan
收藏
  |  
浏览/下载:9/0
  |  
提交时间:2017/12/03
SINGLE-LAYER MOS2
AUGMENTED-WAVE METHOD
MOLYBDENUM-DISULFIDE
AU FOILS
ATOMIC DEFECTS
BANDGAP
GROWTH
SEMICONDUCTOR
NANOSHEETS
STATES
Selenium doping NaCl-type superconductor: SnAs1-xSex (x=0-0.13)
期刊论文
JOURNAL OF SOLID STATE CHEMISTRY, 2017
He, Jianqiao
;
Zhang, Xian
;
Lai, Xiaofang
;
Huang, Fuqiang
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2017/12/03
SnAs1-xSex
Superconductivity
Compressive strain
HIGH-PRESSURE
TEMPERATURE
SNAS
Low-temperature hydrogen production from water and methanol using Pt/alpha-MoC catalysts
期刊论文
NATURE, 2017
Lin, Lili
;
Zhou, Wu
;
Gao, Rui
;
Yao, Siyu
;
Zhang, Xiao
;
Xu, Wenqian
;
Zheng, Shijian
;
Jiang, Zheng
;
Yu, Qiaolin
;
Li, Yong-Wang
;
Shi, Chuan
;
Wen, Xiao-Dong
;
Ma, Ding
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2017/12/03
MOLYBDENUM CARBIDE CATALYSTS
TOTAL-ENERGY CALCULATIONS
AUGMENTED-WAVE METHOD
GAS SHIFT
CARBON-DIOXIDE
SINGLE-ATOM
FUEL-CELLS
BASIS-SET
STEAM
HYDROCARBONS
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