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Add ppafm codes to daint.cscs.ch computer (#25)
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yakutovicha authored Jul 9, 2024
1 parent 885bbe2 commit f4d5c09
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18 changes: 18 additions & 0 deletions daint.cscs.ch/gpu/codes/ppafm.yaml
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---
label: '{{ code_name }}'
description: PPAFM code https://github.com/Probe-Particle/ppafm.git
default_calc_job_plugin: nanotech_empa.afm
filepath_executable: /users/cpi/aiida-soft/run_{{ code_name }}.sh
prepend_text: |
export PATH="/users/cpi/miniconda3/bin:$PATH"
eval "$(conda shell.posix hook)"
econda activate /users/cpi/miniconda3/envs/env-{{ code_name }}
append_text: ''
metadata:
template_variables:
code_name:
type: list
key_display: Code name
options:
- ppafm
- 2ppafm

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