AiiDA plugin with more advanced workflows for the Quantum ESPRESSO PHonon code ph.x.
Install the package following the instructions in the documentation.
Go through the main tutorial to understand the basics.
The matrix below assumes the user always install the latest patch release of the specified minor version, which is recommended.
| Plugin | AiiDA | Python | Quantum ESPRESSO |
|---|---|---|---|
0.1 < 1.0 |
 |
 |
 |
For the compatibility of older aiida-quantumespresso-ph versions, we refer to the documentation.
Great that you want to contribute! See the developer guide in the documentation for instructions.
The aiida-quantumespresso-ph plugin package is released under a special academic license.
See the LICENSE.txt file for more details.
We acknowledge support from:
| NCCR MARVEL funded by the Swiss National Science Foundation |  |
| EU Centre of Excellence "MaX – Materials Design at the Exascale"(Horizon 2020 EINFRA-5, Grant No. 676598; H2020-INFRAEDI-2018-1, Grant No. 824143; HORIZON-EUROHPC-JU-2021-COE-1, Grant No. 101093374) |  |
| Swissuniversities P-5 project "Materials Cloud" |  |
| U Bremen Excellence Chairs program |  |
| MAPEX Center for Materials and Processes |  |