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fix sigma value for HW in spce.xml
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daico007 committed Nov 28, 2023
1 parent c91b53c commit 93d501d
Showing 1 changed file with 1 addition and 1 deletion.
2 changes: 1 addition & 1 deletion gmso/utils/files/gmso_xmls/test_ffstyles/spce.xml
Original file line number Diff line number Diff line change
Expand Up @@ -15,7 +15,7 @@
<AtomType name="opls_117" element="H" mass="1.00800" charge="6.7900245189504e-20" atomclass="HW" definition="H">
<Parameters>
<Parameter name="epsilon" value="0.0"/>
<Parameter name="sigma" value="0.1"/>
<Parameter name="sigma" value="0.0"/>
</Parameters>
</AtomType>
</AtomTypes>
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