Many-electron atom confinement by a penetrable spherical box

International Journal of Quantum Chemistry

Volumn 108, Issue 9, 2008, Pages 1572-1588

  Diaz Garcia C ^a   Cruz, S A ^a  

^a DEPARTAMENTO DE QUÍMICA   (Mexico)

Author keywords

Confined atom; Density functional theory; Electron escape; Finite barrier height; High pressures; Thomas Fermi Dirac Weizs cker; Variational optimization

Indexed keywords

DENSITY FUNCTIONAL THEORY; FERMI LEVEL; GROUND STATE; MOLECULAR DYNAMICS;

CONFINED ATOM; ELECTRON ESCAPE; FINITE BARRIER HEIGHT; THOMAS-FERMI-DIRAC-WEIZSACKER; VARIATIONAL OPTIMIZATION;

ELECTRONIC STRUCTURE;

EID: 43949097595     PISSN: 00207608     EISSN: 1097461X     Source Type: Journal    
DOI: 10.1002/qua.21670     Document Type: Article

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