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科研机构
北京大学 [34]
内容类型
期刊论文 [33]
其他 [1]
发表日期
2017 [2]
2016 [5]
2015 [1]
2014 [3]
2013 [3]
2012 [6]
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专题:北京大学
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Valley-Polarized Quantum Anomalous Hall Effect in Ferrimagnetic Honeycomb Lattices
期刊论文
PHYSICAL REVIEW LETTERS, 2017
Zhou, Jian
;
Sun, Qiang
;
Jena, Puru
收藏
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浏览/下载:2/0
  |  
提交时间:2017/12/03
TOPOLOGICAL INSULATORS
EPITAXIAL-GROWTH
SPIN HALL
STM TIP
SURFACE
GRAPHENE
First-Principles Study: Tuning the Redox Behavior of Lithium-Rich Layered Oxides by Chlorine Doping
期刊论文
JOURNAL OF PHYSICAL CHEMISTRY C, 2017
Yan, Huijun
;
Li, Biao
;
Yu, Zhen
;
Chu, Wangsheng
;
Xia, Dingguo
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2017/12/03
HIGH-PRESSURE SYNTHESIS
MINIMUM ENERGY PATHS
ELASTIC BAND METHOD
LI-ION BATTERIES
CATHODE MATERIALS
ELECTROCHEMICAL PERFORMANCE
ELECTRONIC-STRUCTURE
ANIONIC REDOX
METAL-OXIDES
RECHARGEABLE BATTERIES
Hubbard interactions in iron-based pnictides and chalcogenides: Slater parametrization, screening channels, and frequency dependence
期刊论文
PHYSICAL REVIEW B, 2016
van Roekeghem, Ambroise
;
Vaugier, Loig
;
Jiang, Hong
;
Biermann, Silke
收藏
  |  
浏览/下载:6/0
  |  
提交时间:2017/12/03
MEAN-FIELD THEORY
STRONGLY CORRELATED SYSTEMS
ELECTRONIC-STRUCTURE
PHOTOEMISSION-SPECTROSCOPY
SUPERCONDUCTIVITY
SPECTRA
LIFEAS
FESE
GAP
Big picture of relativistic molecular quantum mechanics
期刊论文
NATIONAL SCIENCE REVIEW, 2016
Liu, Wenjian
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  |  
浏览/下载:4/0
  |  
提交时间:2017/12/04
relativistic quantum mechanics
quantum electrodynamics
relativistic Hamiltonian
electron correlation
magnetic property
DENSITY-FUNCTIONAL THEORY
COMPLEX-COORDINATE ROTATION
ORDER REGULAR APPROXIMATION
EXCITATION-ENERGIES
NMR PARAMETERS
HYLLERAAS-CI
ELECTRON
SYSTEMS
HAMILTONIANS
CHEMISTRY
Link between K absorption edges and thermodynamic properties of warm dense plasmas established by an improved first-principles method
期刊论文
PHYSICAL REVIEW B, 2016
Zhang, Shen
;
Zhao, Shijun
;
Kang, Wei
;
Zhang, Ping
;
He, Xian-Tu
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2017/12/03
FREE-ELECTRON-LASER
PSEUDOPOTENTIALS
SHIFTS
Extended application of Kohn-Sham first-principles molecular dynamics method with plane wave approximation at high energy-From cold materials to hot dense plasmas
期刊论文
PHYSICS OF PLASMAS, 2016
Zhang, Shen
;
Wang, Hongwei
;
Kang, Wei
;
Zhang, Ping
;
He, X. T.
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2017/12/03
ELECTRON-GAS
EXPERIMENTAL ASTROPHYSICS
FUNCTIONAL THEORY
LIQUID DEUTERIUM
TEMPERATURE
SIMULATIONS
HUGONIOT
LASERS
STATE
From intermolecular interactions to structures and properties of a novel cocrystal explosive: a first-principles study
期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2016
Zhang, Lei
;
Wu, Ji-Zhou
;
Jiang, Sheng-Li
;
Yu, Yi
;
Chen, Jun
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  |  
浏览/下载:5/0
  |  
提交时间:2017/12/04
GOOD COMPREHENSIVE PROPERTIES
ENERGETIC CO-CRYSTALS
SHOCK COMPRESSION
SENSITIVITY
CL-20
HNIW
2,4,6-TRINITROTOLUENE
CHEMISTRY
BTF
First-principles calculation of principal Hugoniot and K-shell X-ray absorption spectra for warm dense KCl
期刊论文
PHYSICS OF PLASMAS, 2015
Zhao, Shijun
;
Zhang, Shen
;
Kang, Wei
;
Li, Zi
;
Zhang, Ping
;
He, Xian-Tu
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2017/12/03
EQUATION-OF-STATE
SHOCK COMPRESSION
PHYSICS BASIS
PRESSURES
IGNITION
HYDROGEN
FUSION
GAIN
CODE
Experimental and theoretical investigations on high-pressure phase transition of Sr2Fe2O5
期刊论文
physics and chemistry of minerals, 2014
Zhu, Feng
;
Wu, Ye
;
Lai, Xiaojing
;
Qin, Shan
;
Yang, Ke
;
Liu, Jing
;
Wu, Xiang
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2015/11/10
Sr2Fe2O5
Pressure-induced phase transition
X-ray diffraction
Density functional theory
Electronic properties
AUGMENTED-WAVE METHOD
NEUTRON-DIFFRACTION
MAGNETIC-PROPERTIES
BROWNMILLERITE
TEMPERATURE
CRYSTAL
SYSTEM
SRFEOX
STATE
N=2
High-pressure behavior of Fe3P and the role of phosphorus in planetary cores
期刊论文
earth and planetary science letters, 2014
Gu, Tingting
;
Fei, Yingwei
;
Wu, Xiang
;
Qin, Shan
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2015/11/10
iron phosphides
schreibersite
first-principles calculation
phase transitions
planetary cores
high-pressure
EARTHS INNER-CORE
CRYSTAL-STRUCTURE
AB-INITIO
PHASE-RELATIONS
IRON
STATE
DIFFRACTION
CHONDRITES
TRANSITION
METEORITE
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