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Structure constants in the Green's function method: a new analytic evaluation

GIANNOZZI, Paolo
•
Grosso G
•
Pastori Parravicini G.
1983
  • journal article

Periodico
PHYSICAL REVIEW. B, CONDENSED MATTER
Abstract
A new efficient procedure to calculate the structure constants in the Green's-function method is presented. The conventional algorithm in terms of the Ewald sums is replaced by alternate and quite convenient analytic expressions. As a specific test the conduction bands of solid neon are obtained. The relationship with the Segall-Yang approach is discussed.
DOI
10.1103/PhysRevB.27.7553
Archivio
http://hdl.handle.net/11390/680352
info:eu-repo/semantics/altIdentifier/scopus/2-s2.0-26144474567
http://link.aps.org/doi/10.1103/PhysRevB.27.7553
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metadata only access
Scopus© citazioni
3
Data di acquisizione
Jun 2, 2022
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Visualizzazioni
2
Data di acquisizione
Apr 19, 2024
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