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Fix isUnsafe

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This commit is contained in:
Mickaël Véril 2020-08-06 18:24:42 +02:00
parent 6ca8c57086
commit 52d334e367
2 changed files with 2 additions and 2 deletions
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2
docs/examples/other/FCI2-Si.tex
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@ -112,7 +112,7 @@
Cyclopropenone &$^1B_1 (\Val; n \ra \pis)$ & 4.26 &4.27 &4.01 &4.53& 4.18 &4.28 &4.31 &4.21 &3.88 \\
&$^1A_2 (\Val; n \ra \pis)$ & 5.55 &5.65 &5.65 &5.40& &5.59 &5.59 &5.57 &5.47 \\
&$^1B_2 (\mathrm{R}; n \ra 3s)$ & 6.34 &6.32 &5.84 &6.44& 6.36 &6.35 &6.38 &6.32 &5.79 \\
&$^1B_2 (\Val; \pi \ra \pis$) & 6.54 &6.60 &6.46 &6.82& &6.59 &6.61 &6.54 &6.33 \\
&$^1B_2 (\Val; \pi \ra \pis)$ & 6.54 &6.60 &6.46 &6.82& &6.59 &6.61 &6.54 &6.33 \\
&$^1B_2 (\mathrm{R}; n \ra 3p)$ & 6.98 &6.48 &6.56 &7.09& 7.07 &6.98 & &6.96 &6.43 \\
&$^1A_1 (\mathrm{R}; n \ra 3p)$ & 7.02 &6.54 &6.47 &7.12& &7.02 &7.06 &7.00 &6.41 \\
&$^1A_1 (\Val; \pi \ra \pis)$ & 8.28 &8.22 &8.28 &8.35& 8.19 &8.29 & &8.28 &8.10 \\

2
tools/lib/data.py
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@ -214,6 +214,6 @@ class excitationBase:
class excitationValue(excitationBase):
def __init__(self,initial, final, value, type=None, T1=None,isUnsafe=False,oscilatorForces=None):
super(excitationValue,self).__init__(initial, final,type=type,T1=T1,isUnsafe=False)
super(excitationValue,self).__init__(initial, final,type=type,T1=T1,isUnsafe=isUnsafe)
self.value = value
self.oscilatorForces = oscilatorForces