Correlation energies of inhomogeneous many-electron systems
Abstract
Using ideas from general density-functional theory, we generalize the uniform-gas correlation-energy formalism of Singwi, Tosi, Land, and Sj次nder to the case of an arbitrary inhomogeneous many-particle system. For jellium slabs of finite thickness with a self-consistent local-density approximation ground-state Kohn-Sham potential as input, our numerical results for the correlation energy agree well with diffusion Monte Carlo results. For a helium atom we also obtain a good correlation energy.Using ideas from general density-functional theory, we generalize the uniform-gas correlation-energy formalism of Singwi, Tosi, Land, and Sj次nder to the case of an arbitrary inhomogeneous many-particle system. For jellium slabs of finite thickness with a self-consistent local-density approximation ground-state Kohn-Sham potential as input, our numerical results for the correlation energy agree well with diffusion Monte Carlo results. For a helium atom we also obtain a good correlation energy.
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Journal Title
Physical Review B: Condensed Matter and Materials Physics
Volume
66
Copyright Statement
© 2002 American Physical Society. Reproduced in accordance with the copyright policy of the publisher. This journal is available online - use hypertext links.
Subject
Physical sciences
Chemical sciences
Engineering