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Docker: Fix ASE test

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Ole Schütt 2020-08-11 23:18:59 +02:00 • committed by Ole Schütt
parent d158da078f
commit d9a7f716b1
1 changed files with 2 additions and 2 deletions
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4
tools/docker/scripts/test_ase.sh
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@ -36,8 +36,8 @@ mpiexec -np 2 /workspace/cp2k/exe/local/cp2k.pdbg "\$@"
EndOfMessage
chmod +x /usr/bin/cp2k
mkdir -p ~/.ase
echo '{"cp2k": "/usr/bin/cp2k_shell"}' > ~/.ase/executables.json
mkdir -p ~/.config/ase
echo -e "[executables]\ncp2k = /usr/bin/cp2k_shell\n" > ~/.config/ase/ase.conf
echo -e "\n========== Installing ASE =========="
cd /opt/ase/