Added info to DebyeHuckel. It's getting to be near a documented state. test suite fix: fixed Makefile.in's. The .depends were not being included in the Makefiles. It should now be more stable. |
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|---|---|---|
| .. | ||
| .cvsignore | ||
| Gex_standalone.cpp | ||
| HMW_graph_GvT.cpp | ||
| HMW_NaCl_sp1977_alt.xml | ||
| Makefile.in | ||
| NaCl_Solid.xml | ||
| output_blessed.txt | ||
| README | ||
| runtest | ||
| sortAlgorithms.cpp | ||
| sortAlgorithms.h | ||
| TemperatureTable.h | ||
Notes on this calculation
Silverster and Pitzer have the following numbers for equilibrium at 25C
Delta_G0 = -9.0416 kJ gmol-1
m_sat = 6.146
meanAC_moll = 1.008
This table is meant to run through that calculation. at 298.15.
Thus Delta_G(298.15) should be 0.0. It's -0.00487 kJ/gmol -> very close =).