disable restart with set directive to keep same old output

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edoapra 2017-12-14 13:15:17 -08:00
parent ef33246a2a
commit d7c73c6d5f
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@ -1459,6 +1459,7 @@ geometry units au
symmetry Td
end
set hess:restart f
task scf freq
geometry units au
@ -1470,6 +1471,7 @@ geometry units au
symmetry D2
end
set hess:restart f
task scf freq
geometry units au
@ -1481,6 +1483,7 @@ geometry units au
symmetry S4
end
set hess:restart f
task scf freq
geometry units au
@ -1492,6 +1495,7 @@ geometry units au
symmetry C2
end
set hess:restart f
task scf freq
geometry units au
@ -1503,5 +1507,6 @@ geometry units au
symmetry C1
end
set hess:restart f
task scf freq