Difference between revisions of "Exciting-code"
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{{software info | {{software info | ||
| − | |description=DFT | + | |description=full-potential all-electron density-functional-theory (DFT) package based on the linearized augmented plane-wave (LAPW) method |
|license=free | |license=free | ||
|fields=Computational materials science; Computational chemistry | |fields=Computational materials science; Computational chemistry | ||
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== Tips and tricks == | == Tips and tricks == | ||
| − | {{PAGENAME}} uses XML input and output. | + | The {{PAGENAME}} uses XML input and output. |
== License == | == License == | ||
Revision as of 10:58, 11 October 2011
Exciting-code is a full-potential all-electron density-functional-theory (DFT) package based on the linearized augmented plane-wave (LAPW) method.
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 |
Tips and tricks
The Exciting-code uses XML input and output.
License
License: Free.
Experts
These experts have registered specific competence on this subject:
| Field | AE FTE | General activities | ||
|---|---|---|---|---|
| Weine Olovsson (NSC) | NSC | Computational materials science | 90 | Application support, installation and help |
Links
- Main web page. The official website, here all information about Exciting-code can be found.
- Input reference. Explains the parameters in the input file.
- Exciting-code. Discussion forums, here you can ask questions about the code.
