Authors
Citation
S. Goedecker, TREATMENT OF SEMICORE STATES IN THE LINEARIZED AUGMENTED-PLANE-WAVE METHOD AND OTHER LINEARIZED ELECTRONIC-STRUCTURE METHODS, Physical review. B, Condensed matter, 47(15), 1993, pp. 9881-9883
Citations number
6
Categorie Soggetti
Physics, Condensed Matter
Journal title
ISSN journal
01631829
Volume
47
Issue
15
Year of publication
1993
Pages
9881 - 9883
Database
ISI
SICI code
0163-1829(1993)47:15<9881:TOSSIT>2.0.ZU;2-4
Abstract
We show that elements with semicore states can be treated by standard
linearized methods if the radius of the muffin-tin sphere is chosen sm
aller than in standard implementations and if appropriate radial basis
functions are used.