Add SPODI refinement tutorial and improve fitting controls - #227

Merged

AndrewSazonov merged 16 commits into

more-minor-fixes

Sep 22, 2026

Commits on Sep 15, 2026

Clarify unavailable correlation matrix warning
AndrewSazonov
committed
1c49dc7

Commits on Sep 22, 2026

Add n_free_parameters to tutorial baselines
AndrewSazonov
committed
68f701e
Update data index reference hash
AndrewSazonov
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23f608b
Add YAlO3+Al2O3 SPODI tutorial
AndrewSazonov
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eccfe07
Update YAP tutorial fit parameters
AndrewSazonov
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9054e67
Expose method-specific minimizer tolerances
AndrewSazonov
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b7e5915
Update YAP tutorial convergence setup
AndrewSazonov
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81c817a
Warn about unsupported ionic atom symbols
AndrewSazonov
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807509b
Avoid hard-wrapped notebook output
AndrewSazonov
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177a07a
Update PbSO4 tutorial charge example
AndrewSazonov
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d60ecc8
Use faster convergence tolerance in tutorials
AndrewSazonov
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73a4e48
Refine YAP tutorial index description
AndrewSazonov
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b240505
Update tutorial baselines after convergence changes
AndrewSazonov
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fdd933e
Update Si model in LBCO tutorial
AndrewSazonov
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958c2ac
Add auto-install check to LBCO tutorial
AndrewSazonov
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b24743c
Update LBCO Si tutorial baseline
AndrewSazonov
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297f6e1