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Ignore PCET vdW families for surface coverage test
PCET families have to be skipped since the SurfaceChargeTransfer and SurfaceChargeTransferBEP classes have no attribute "coverage_dependence"
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Lines changed: 5 additions & 2 deletions

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arkane/encorr/ae.py

Lines changed: 3 additions & 2 deletions
Original file line numberDiff line numberDiff line change
@@ -74,8 +74,9 @@
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'Methyl',
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'Ammonia',
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'Chloromethane',
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'Lithium Hydride',
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'Lithium Fluoride'
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# Lithium species shall be uncommented after we reconcile the difference in AECs and BACs
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# 'Lithium Hydride',
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# 'Lithium Fluoride'
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]
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test/database/databaseTest.py

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@@ -132,7 +132,9 @@ def test_kinetics(self):
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), "Kinetics surface family {0}: entries have surface attributes?".format(family_name)
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if family_name not in {
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"Surface_Proton_Electron_Reduction_Alpha",
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"Surface_Proton_Electron_Reduction_Alpha_vdW",
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"Surface_Proton_Electron_Reduction_Beta",
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"Surface_Proton_Electron_Reduction_Beta_vdW",
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"Surface_Proton_Electron_Reduction_Beta_Dissociation",
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}:
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with check:

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