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Added a simple check of symmetries obeyed by the interactions.
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#!/bin/bash | ||
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# Download data from public repo | ||
#curl -X GET "https://nomad-lab.eu/prod/v1/api/v1/uploads/5b-c4JYRSG6qitMFjFUUzQ/raw/?offset=0&length=-1&compress=true" -o 3C-SiC.zip | ||
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#Extract data | ||
#unzip 3C-SiC.zip | ||
#rm 3C-SiC.zip | ||
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workdir="./3C-SiC_test_output" | ||
datadir="./3C-SiC/elphbolt_input_data" | ||
inputdir="./test/3C-SiC" | ||
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#mkdir -p $workdir | ||
#cp $datadir/* $workdir | ||
#cp $inputdir/input.nml $workdir | ||
#rm -r 3C-SiC | ||
cd $workdir | ||
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#gcc+opencoarrays | ||
cafrun -n 1 ../build/caf_*/test/check_interactions_symmetries | tee 3C_SiC_test.output | ||
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cd .. |
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