WIEN2k: An APW+lo program for calculating the properties of solids

The WIEN2k program is based on the augmented plane wave plus local orbitals (APW+lo) method to solve the Kohn-Sham equations of density functional theory. The APW+lo method, which considers all electrons (core and valence) self-consistently in a full-potential treatment, is implemented very efficien...

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Bibliographic Details

Published in:	The Journal of chemical physics Vol. 152; no. 7; p. 074101
Main Authors:	Blaha, Peter, Schwarz, Karlheinz, Tran, Fabien, Laskowski, Robert, Madsen, Georg K H, Marks, Laurence D
Format:	Journal Article
Language:	English
Published:	United States 21.02.2020
ISSN:	1089-7690, 1089-7690
Online Access:	Get more information
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