edoc

Treatment of Semicore States In the Linearized Augmented-plane-wave Method and Other Linearized Electronic-structure Methods

Goedecker, S.. (1993) Treatment of Semicore States In the Linearized Augmented-plane-wave Method and Other Linearized Electronic-structure Methods. Physical review B, 47 (15). pp. 9881-9883.

Full text not available from this repository.

Official URL: https://edoc.unibas.ch/73963/

Downloads: Statistics Overview

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 smaller than in standard implementations and if appropriate radial basis functions are used.
Faculties and Departments:05 Faculty of Science > Departement Physik > Physik > Physik (Goedecker)
UniBasel Contributors:Goedecker, Stefan
Item Type:Article, refereed
Article Subtype:Research Article
Publisher:American Physical Society
ISSN:0163-1829
e-ISSN: 2469-9969
Note:Publication type according to Uni Basel Research Database: Journal article
Identification Number:
Last Modified:16 Apr 2020 10:38
Deposited On:16 Apr 2020 10:38

Repository Staff Only: item control page