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Fixed misplaced curly bracket
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BvB93 committed Mar 7, 2019
1 parent 8458ff6 commit f0e10f8
Showing 1 changed file with 3 additions and 2 deletions.
5 changes: 3 additions & 2 deletions src/qmflows/data/templates/geometry.json
Original file line number Diff line number Diff line change
Expand Up @@ -9,8 +9,9 @@
"iterations": 100},
"geometry": {"optim": "delocal"} },
"ams": {"ams": {
"Task": "GeometryOptimization"},
"GeometryOptimization": {"MaxIterations": 500} },
"Task": "GeometryOptimization",
"GeometryOptimization": {"MaxIterations": 500} }
},
"dftb": {
"task": {"runtype": "GO"},
"dftb": {"resourcesdir": "DFTB.org/3ob-3-1"} },
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