Add KS2022 Random Solution Featurization#10

Merged

jwsiegel2510 merged 37 commits intomainfrom add_randomSolution

Nov 1, 2023

+978-84

Commits on Jul 26, 2023

- fix KS2022_dilute citation
amkrajewski
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- visual reformat of the feature calculators
amkrajewski
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ENH: simplified the calcualtion of stoichiometry attributes without changing the result
amkrajewski
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ENH: new descriptor calculator which takes a prototype structure (e.g., BCC) and a Composition; then it iteratively extends it with random occupancy until the feature vector and composition converg…
amkrajewski
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(KS2022_randomSolution) add convergence assertion before returning a value
amkrajewski
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(KS2022_randomSolution) supress Pandas performance warnings - seems like they are coming from plotly and there is a fix coming for that soon
amkrajewski
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(KS2022_randomSolution) added documentation for all parameters and the function as a whole
amkrajewski
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Commits on Jul 27, 2023

Commits on Aug 7, 2023

Commits on Oct 11, 2023

Merge remote-tracking branch 'origin/main' into add_randomSolution
amkrajewski
committed

Commits on Oct 17, 2023

Commits on Oct 24, 2023

- (randSol) removed the unnecessary pandas import
amkrajewski
committed

Commits on Oct 27, 2023