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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 !221
parents b0f0bb67 4c514e86
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5 merge requests!368Update prace.md to document the change from qprace to qprod as the default...,!367Update prace.md to document the change from qprace to qprod as the default...,!366Update prace.md to document the change from qprace to qprod as the default...,!323extended-acls-storage-section,!221RT#16611
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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 ...@@ -111,7 +111,7 @@ You also need to edit the previously used PBS submission file. You have to speci
#PBS -q qexp #PBS -q qexp
ml ORCA/4.0.1.2 ml ORCA/4.0.1.2
${EBROOTORCA}/orca orca_parallel.inp ${EBROOTORCA}/orca orca_parallel.inp > output.out
``` ```
!!! note !!! note
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