- Feb 27, 2024
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Matthew Louis authored
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- Feb 25, 2024
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Matthew Louis authored
Added additional checks for hulls that may be coplanar, or otherwise problemmatic, and some other minor improvements
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- Feb 24, 2024
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Matthew Louis authored
Fully implemented plotting with filtering. The results are okay, but nowhere near as nice as the built-in plots. Also, the compositions appearing on the x-axis corresponding to the phase boundaries seem to be shifted by a constant factor from the reference - need to look at this further
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Matthew Louis authored
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Matthew Louis authored
Working prototype of binary phase diagram plotting tool. Have NOT tested it for 4 dimensional plane yet, just trying to recreate phase diagram of LiCl-PuCl3
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Matthew Louis authored
Added a function to pseudoBinaryDiagram class that gets all of the phase regions and all of the temperature composition points associated with a given phase region. Also added supporting functionality to thermoOut class.
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- Feb 23, 2024
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Matthew Louis authored
Added utility function for converting from element fractions to endmember fractions for a pseudo binary system. This code can probably be simplified significantly
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Matthew Louis authored
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- Feb 22, 2024
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Matthew Louis authored
Added ability to skip states which are missing data. Still not sure how these states arise - perhaps there's something incorrect with the calculation parameters. Also added annoying python .pyc binaries to the gitignore
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- Feb 21, 2024
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Matthew Louis authored
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Matthew Louis authored
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Matthew Louis authored
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Matthew Louis authored
Removed normalization, it is more convenient to do this on the caller side so that the proper mass labels can be created first
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Matthew Louis authored
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Matthew Louis authored
Added a phase inclusion tolerance, i.e. for below this tolerance, the phase fraction will be set to zero. The value was set to be the same as that in pseudoBinaryPhaseDiagramFunctions.py
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Matthew Louis authored
Must specify fuzzy stochiometry when generating input script, not when running it, as there is no such argument
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Matthew Louis authored
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Matthew Louis authored
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