Difference between revisions of "Elk"
(Created page with "{{software info |description=all-electron full-potential linearised augmented-plane wave (FP-LAPW) code with many advanced features. |license=free |fields=Computational materials...") |
|||
| (2 intermediate revisions by the same user not shown) | |||
| Line 1: | Line 1: | ||
{{software info | {{software info | ||
| − | |description=all-electron full-potential linearised augmented-plane wave (FP-LAPW) code with many advanced features | + | |description=all-electron full-potential linearised augmented-plane wave (FP-LAPW) code with many advanced features |
|license=free | |license=free | ||
|fields=Computational materials science; Computational chemistry | |fields=Computational materials science; Computational chemistry | ||
| Line 20: | Line 20: | ||
== Links == | == Links == | ||
* [http://elk.sourceforge.net Main web page]. The official website, here all information about {{PAGENAME}} can be found. | * [http://elk.sourceforge.net Main web page]. The official website, here all information about {{PAGENAME}} can be found. | ||
| − | * [http://elk.sourceforge.net/#documentation Documentation]. | + | * [http://elk.sourceforge.net/#documentation Documentation]. Here are links to {{PAGENAME}} documentation. |
| − | * [http://sourceforge.net/projects/elk/forums | + | * [http://sourceforge.net/projects/elk/forums Discussion forums]. In the discussion forums you can ask questions about the code. |
Latest revision as of 12:25, 14 October 2011
Elk is an all-electron full-potential linearised augmented-plane wave (FP-LAPW) code with many advanced features.
Contents
Availability
| Resource | Centre | Description |
|---|---|---|
| Kappa | NSC | throughput cluster resource of 26 TFLOPS |
| Matter | NSC | cluster resource of 37 TFLOPS dedicated to materials science |
| Triolith | NSC | Capability cluster with 338 TFLOPS peak and 1:2 Infiniband fat-tree |
License
License: Free.
Experts
These experts have registered specific competence on this subject:
| Field | AE FTE | General activities | ||
|---|---|---|---|---|
| Diana Iusan (UPPMAX) | UPPMAX | Computational materials science Performance tuning | 50 | Compilation, performance optimization, and best practice usage of electronic structure codes. |
| Weine Olovsson (NSC) | NSC | Computational materials science | 90 | Application support, installation and help |
Links
- Main web page. The official website, here all information about Elk can be found.
- Documentation. Here are links to Elk documentation.
- Discussion forums. In the discussion forums you can ask questions about the code.
