[cig-commits] [commit] add_thermodynamic_potentials: Started benchmarking document to test solid solutions (6328247)

[cig_noreply at geodynamics.org]

Repository : https://github.com/geodynamics/burnman

On branch  : add_thermodynamic_potentials
Link       : https://github.com/geodynamics/burnman/compare/2e5646d93cedbbf8eae54cc37cffc14e0aa85180...d5ddad03ff9f30f5a4efaddb4e3ec585ea1a7c51

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commit 63282475a8b423f338167451fdf51c4ee039a32d
Author: Bob Myhill <myhill.bob at gmail.com>
Date:   Tue Sep 2 23:12:40 2014 +0200

    Started benchmarking document to test solid solutions


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63282475a8b423f338167451fdf51c4ee039a32d
 burnman/test_solidsolution_benchmarks.py | 27 +++++++++++++++++++++++++++
 1 file changed, 27 insertions(+)

diff --git a/burnman/test_solidsolution_benchmarks.py b/burnman/test_solidsolution_benchmarks.py
new file mode 100644
index 0000000..6c19d31
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+++ b/burnman/test_solidsolution_benchmarks.py
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+# Benchmarks for the solid solution class
+
+'''
+Solvus shapes (a proxy for Gibbs free energy checking
+'''
+
+# van Laar parameter
+# Figure 2a of Holland and Powell, 2003
+
+# Temperature dependence
+# Figure 2b of Holland and Powell, 2003
+
+# A specific solvus example: sanidine-high albite
+# Includes asymmetry and pressure, temperature dependence
+# Figure 3 of Holland and Powell, 2003
+
+
+'''
+Excess properties
+'''
+# Configurational entropy
+# Figure 3b of Stixrude and Lithgow-Bertelloni, 2011
+
+# Excess enthalpy of solution
+# Figure 5 of Stixrude and Lithgow-Bertelloni, 2011
+
+# Excess volume of solution