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Add an example for Henry's coefficient #46

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merged 1 commit into from
Aug 21, 2024

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KaihangShi
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Add an example for Henry's coefficient calculation. For this example, gRASPA yields Henry's coefficient of (in units in [mol/kg/Pa]):

8.3089e-05 +/- 1.745654103e-05

This is in agreement with RASPA2 results (8.4325e-05 +/- 2.67117e-07 mol/kg/Pa).

Add an example for Henry's coefficient calculation. For this example, gRASPA yields Henry's coefficient of in units in [mol/kg/Pa]):

8.3089e-05 +/- 1.745654103e-05

This is in agreement with RASPA2 results of 8.4325e-05 +/- 2.67117e-07
@Zhaoli2042 Zhaoli2042 merged commit 0c5b63a into snurr-group:main Aug 21, 2024
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