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Fix a bug when absorption and fluorescences are mixing

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This commit is contained in:
Mickaël Véril 2019-12-17 14:22:32 +01:00
parent e5a47f7ed7
commit 295404548b
1 changed files with 2 additions and 1 deletions
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3
tools/lib/data.py
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@ -95,7 +95,8 @@ class dataFileBase(object):
data.molecule=mymolecule data.molecule=mymolecule
data.method=mymethod data.method=mymethod
data.excitations.append(excitationValue(firstState,finst[0],val,type=finst[2],isUnsafe=unsafe)) data.excitations.append(excitationValue(firstState,finst[0],val,type=finst[2],isUnsafe=unsafe))
datalist.append(data) for value in datacls.values():
datalist.append(value)
return datalist return datalist
elif format==Format.COLUMN: elif format==Format.COLUMN:
subtablesindex=list() subtablesindex=list()