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ADD: QE workflow badges
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germann_e
2025-05-15 14:02:02 +02:00
parent 1757aad9ca
commit 46f256ce75
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pages/merlin7/05-Software-Support/quantum-espresso.md
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@ -86,6 +86,8 @@ spack:
### Environment modules
#### CPU
[![Pipeline](https://gitea.psi.ch/HPCE/spack-psi/actions/workflows/q-e_cpu_merlin7.yml/badge.svg?branch=main)](https://gitea.psi.ch/HPCE/spack-psi)
```bash
module purge
module use Spack
@ -100,6 +102,8 @@ cmake -DQE_ENABLE_MPI:BOOL=ON -DQE_ENABLE_OPENMP:BOOL=ON -DCMAKE_C_COMPILER:STRI
make [-jN]
```
#### A100
[![Pipeline](https://gitea.psi.ch/HPCE/spack-psi/actions/workflows/q-e_gpu_merlin7.yml/badge.svg?branch=main)](https://gitea.psi.ch/HPCE/spack-psi)
```bash
module purge
module use Spack
@ -115,6 +119,8 @@ make [-jN]
```
#### GH200
[![Pipeline](https://gitea.psi.ch/HPCE/spack-psi/actions/workflows/q-e_gh_merlin7.yml/badge.svg?branch=main)](https://gitea.psi.ch/HPCE/spack-psi)
Unfortunately this doesn't work with the develop version of Q-E, it fails at ~40% because of an internal compiler error. This could be solved with a new nvhpc compiler, but since PSI decided to go away from GH nodes I am not sure this is worth invastigating. Please go back to A100 if you absolutely want the develop version or try to go back to 7.4 for the fortran module that fail...
!! UPDATE: Actually it works with qe-7.4! So you can also just checkout from this branch and not development and add your changes to this branch !!