49 lines
1.2 KiB
XML
49 lines
1.2 KiB
XML
<?xml version="1.0"?>
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<ctml>
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<validate reactions="yes" species="yes"/>
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<phase dim="3" id="LiFixed">
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<elementArray datasrc="elements.xml">
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Li
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</elementArray>
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<speciesArray datasrc="#species_Li(Fixed)">
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LiFixed
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</speciesArray>
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<thermo model="FixedChemPot">
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<chemicalPotential units="J/kmol"> -2.3E7 </chemicalPotential>
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</thermo>
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<transport model="None"/>
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<kinetics model="none"/>
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</phase>
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<phase dim="3" id="mismatch">
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<elementArray datasrc="elements.xml">
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Li
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</elementArray>
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<speciesArray datasrc="#species_Li(Fixed)">
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LiFixed
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</speciesArray>
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<thermo model="StoichSubstance">
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<chemicalPotential units="J/kmol"> -2.3E7 </chemicalPotential>
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</thermo>
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<transport model="None"/>
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<kinetics model="none"/>
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</phase>
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<!-- species definitions -->
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<speciesData id="species_Li(Fixed)">
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<species name="LiFixed">
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<atomArray> Li:1 </atomArray>
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<thermo>
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<Shomate Pref="1 bar" Tmax="1075.0" Tmin="250.0">
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<floatArray size="7">
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50.72389, 6.672267, -2.517167,
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10.15934, -0.200675, -427.2115,
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130.3973
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</floatArray>
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</Shomate>
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</thermo>
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</species>
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</speciesData>
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</ctml>
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