EXACT AND APPROXIMATE RELATIONS FOR THE SPIN-DEPENDENCE OF THE EXCHANGE ENERGY IN HIGH MAGNETIC FIELDS
Contribuinte(s) |
UNIVERSIDADE DE SÃO PAULO |
---|---|
Data(s) |
20/10/2012
20/10/2012
2009
|
Resumo |
The exchange energy of an arbitrary collinear-spin many-body system in an external magnetic field is a functional of the spin-resolved charge and current densities, E(x)[n(up arrow), n(down arrow), j(up arrow), j(down arrow)]. Within the framework of density-functional theory (DFT), we show that the dependence of this functional on the four densities can be fully reconstructed from either of two extreme limits: a fully polarized system or a completely unpolarized system. Reconstruction from the limit of an unpolarized system yields a generalization of the Oliver-Perdew spin scaling relations from spin-DFT to current-DFT. Reconstruction from the limit of a fully polarized system is used to derive the high-field form of the local-spin-density approximation to current-DFT and to magnetic-field DFT. |
Identificador |
INTERNATIONAL JOURNAL OF MODERN PHYSICS B, v.23, n.Dez/13, p.3004-3008, 2009 0217-9792 |
Idioma(s) |
eng |
Publicador |
WORLD SCIENTIFIC PUBL CO PTE LTD |
Relação |
International Journal of Modern Physics B |
Direitos |
restrictedAccess Copyright WORLD SCIENTIFIC PUBL CO PTE LTD |
Palavras-Chave | #Density-functional theory #exchange energy #orbital magnetism #DENSITY-FUNCTIONAL THEORY #ELECTRON-GAS #SYSTEMS #ATOMS #Physics, Applied #Physics, Condensed Matter #Physics, Mathematical |
Tipo |
article proceedings paper publishedVersion |