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科研机构
北京大学 [6]
内容类型
期刊论文 [5]
其他 [1]
发表日期
2016 [1]
2013 [1]
2009 [1]
2006 [2]
1999 [1]
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专题:北京大学
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Big picture of relativistic molecular quantum mechanics
期刊论文
NATIONAL SCIENCE REVIEW, 2016
Liu, Wenjian
收藏
  |  
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
Multiscale studies of the three-dimensional dayside X-line
期刊论文
journal of atmospheric and solar terrestrial physics, 2013
Moore, T. E.
;
Burch, J. L.
;
Daughton, W. S.
;
Fuselier, S. A.
;
Hasegawa, H.
;
Petrinec, S. M.
;
Pu, Zuyin
收藏
  |  
浏览/下载:2/0
  |  
提交时间:2015/11/12
Reconnection
Magnetosphere
Multiscale
Plasma
Magnetic
MAGNETIC RECONNECTION
CLUSTER OBSERVATIONS
MAGNETOPAUSE
FIELD
BOUNDARY
Exact two-component Hamiltonians revisited
期刊论文
journal of chemical physics, 2009
Liu, Wenjian
;
Peng, Daoling
收藏
  |  
浏览/下载:2/0
  |  
提交时间:2015/11/10
Dirac equation
mathematical operators
matrix algebra
relativistic quantum mechanics
Schrodinger equation
NONRELATIVISTIC METHODS
RELATIVISTIC THEORY
DIRAC-EQUATION
ONE-ELECTRON
A novel infinite-order quasirelativistic density functional theory
其他
2006-01-01
Liu, Wenjian
;
Peng, Daoling
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  |  
浏览/下载:3/0
  |  
提交时间:2015/11/13
lnfinite order quasirelativistic theory
Kohn-Sham
Dirac-Kohn-Sham
NONRELATIVISTIC METHODS
DIRAC-EQUATION
APPROXIMATION
ENERGY
Infinite-order quasirelativistic density functional method based on the exact matrix quasirelativistic theory
期刊论文
journal of chemical physics, 2006
Liu, Wenjian
;
Peng, Daoling
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浏览/下载:4/0
  |  
提交时间:2015/11/10
DOUGLAS-KROLL TRANSFORMATION
NONRELATIVISTIC METHODS
MOLECULAR CALCULATIONS
QUANTUM-CHEMISTRY
PROGRAM PACKAGE
DIRAC-EQUATION
APPROXIMATION
HAMILTONIANS
FOUNDATIONS
4-COMPONENT
Redox behavior of the molybdenum and tungsten metallafullerenes M(eta(2)-C-60)(CO)(2)(phen)(dbm) (phen = 1,10-phenanthroline; dbm = dibutyl maleate): (spectro)electrochemistry and theoretical considerations
期刊论文
journal of the chemical society dalton transactions, 1999
Zanello, P
;
Laschi, F
;
Fontani, R
;
Mealli, C
;
Ienco, A
;
Tang, KL
;
Jin, XL
;
Li, L
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2015/11/11
STRUCTURAL CHARACTERIZATION
BUCKMINSTERFULLERENE C-60
ELECTROCHEMICAL DETECTION
METAL DERIVATIVES
CLUSTER COMPLEXES
APROTIC-SOLVENTS
MO
ELECTROREDUCTION
COORDINATION
TEMPERATURE
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