calcoloscientifico:cluster:softwareapplicativo:orca
Differenze
Queste sono le differenze tra la revisione selezionata e la versione attuale della pagina.
| Entrambe le parti precedenti la revisioneRevisione precedenteProssima revisione | Revisione precedente | ||
| calcoloscientifico:cluster:softwareapplicativo:orca [12/04/2020 20:43] – fabio.spataro | calcoloscientifico:cluster:softwareapplicativo:orca [31/01/2023 09:50] (versione attuale) – federico.prost | ||
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| Linea 10: | Linea 10: | ||
| Several versions of ORCA are available: | Several versions of ORCA are available: | ||
| - | ^ ORCA ^ | + | ^ ORCA |
| - | | 4.1.1 | | + | | 4.1.1 | |
| - | | 4.2.1 | | + | | 4.2.1 | |
| + | | 5.0.3 | ||
| Compilation details: | Compilation details: | ||
| - | ^ ORCA ^ Compiler | + | ^ ORCA |
| - | | 4.1.1 | GNU 7.3.0 | OpenMPI 3.1.3 | | + | | 4.1.1 | GNU 7.3.0 | OpenMPI 3.1.3 | |
| - | | 4.2.1 | GNU 7.3.0 | OpenMPI 3.1.4 | | + | | 4.2.1 | GNU 7.3.0 | OpenMPI 3.1.4 | |
| + | | 5.0.3 | GNU 8.3.0 | OpenMPI 4.1.1 | | ||
| For example ORCA 4.2.1 was compiled with the GNU 7.3.0 tool chain and OpenMPI 3.1.4. | For example ORCA 4.2.1 was compiled with the GNU 7.3.0 tool chain and OpenMPI 3.1.4. | ||
| Linea 24: | Linea 26: | ||
| Environment modules: | Environment modules: | ||
| - | ^ ORCA ^ Prerequisites | + | ^ ORCA |
| - | | 4.1.1 | gnu7/7.3.0 openmpi3/ | + | | 4.1.1 | gnu7/7.3.0 openmpi3/ |
| - | | 4.2.1 | gnu7/7.3.0 openmpi3/ | + | | 4.2.1 | gnu7/7.3.0 openmpi3/ |
| + | | 5.0.3 | gnu8/ | ||
| === ORCA serial job === | === ORCA serial job === | ||
| Linea 44: | Linea 47: | ||
| #SBATCH --time=0-01: | #SBATCH --time=0-01: | ||
| #SBATCH --partition=vrt | #SBATCH --partition=vrt | ||
| + | #SBATCH --qos=vrt | ||
| #SBATCH --account=< | #SBATCH --account=< | ||
| Linea 87: | Linea 91: | ||
| == Execution of a ORCA parallel program == | == Execution of a ORCA parallel program == | ||
| - | Script '' | + | Script '' |
| - | <code bash slurm-orca-bdw.sh> | + | <code bash slurm-orca-cpu.sh> |
| #!/bin/bash | #!/bin/bash | ||
| #SBATCH --job-name=orca | #SBATCH --job-name=orca | ||
| Linea 98: | Linea 102: | ||
| #SBATCH --mem=16G | #SBATCH --mem=16G | ||
| #SBATCH --time=0-01: | #SBATCH --time=0-01: | ||
| - | #SBATCH --partition=bdw | + | #SBATCH --partition=cpu |
| + | #SBATCH --qos=cpu | ||
| #SBATCH --account=< | #SBATCH --account=< | ||
| Linea 132: | Linea 137: | ||
| </ | </ | ||
| - | Submitting '' | + | Submitting '' |
| < | < | ||
| - | sbatch slurm-orca-bdw.sh | + | sbatch slurm-orca-cpu.sh |
| </ | </ | ||
| [[https:// | [[https:// | ||
calcoloscientifico/cluster/softwareapplicativo/orca.1586716985.txt.gz · Ultima modifica: 12/04/2020 20:43 da fabio.spataro