Density Functional Calculations for Strongly Correlated Systems View Full Text


Ontology type: schema:Chapter     


Chapter Info

DATE

1989

AUTHORS

O. Gunnarsson , O. K. Andersen , A. Svane

ABSTRACT

For atoms and small molecules there are rather accurate ab initio many-body methods, like the configuration interaction method. For solids such methods are often too complicated, and there are relatively few ab initio many-body calculations. These have usually been performed for rather simple systems, such as diamond and Si and free electron like material. These calculations have usually been based on the “local approach”,1 the GW approximation,2 or Monte Carlo methods.3 For more complicated systems many-body calculations have almost exclusively been based on model Hamiltonian approaches. The density functional formalism provides an alternative method for including many-body effects in ab initio calculations. This formalism requires the solution of a one-particle equation and the calculations are therefore relatively simple. It is therefore possible to treat complicated systems with, say, 50 atoms per unit cell without shape approximations for the potential.4 Calculations have been made for interfaces,4 impurities5 and amorphous solids.6 More... »

PAGES

139-150

Book

TITLE

Interacting Electrons in Reduced Dimensions

ISBN

978-1-4612-7869-6
978-1-4613-0565-1

Identifiers

URI

http://scigraph.springernature.com/pub.10.1007/978-1-4613-0565-1_17

DOI

http://dx.doi.org/10.1007/978-1-4613-0565-1_17

DIMENSIONS

https://app.dimensions.ai/details/publication/pub.1022530174


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curl -H 'Accept: application/n-triples' 'https://scigraph.springernature.com/pub.10.1007/978-1-4613-0565-1_17'

Turtle is a human-readable linked data format.

curl -H 'Accept: text/turtle' 'https://scigraph.springernature.com/pub.10.1007/978-1-4613-0565-1_17'

RDF/XML is a standard XML format for linked data.

curl -H 'Accept: application/rdf+xml' 'https://scigraph.springernature.com/pub.10.1007/978-1-4613-0565-1_17'


 

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