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Commit 349c3bcc authored by Pavel Jirásek's avatar Pavel Jirásek
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Merge branch 'orca' into 'master' 

RT#16611

See merge request sccs/docs.it4i.cz!221
parents b0f0bb67 4c514e86
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docs.it4i/software/chemistry/orca.md
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......@@ -111,7 +111,7 @@ You also need to edit the previously used PBS submission file. You have to speci
#PBS -q qexp
ml ORCA/4.0.1.2
${EBROOTORCA}/orca orca_parallel.inp
${EBROOTORCA}/orca orca_parallel.inp > output.out
```
!!! note
......
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