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easyscience
diffraction-lib
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Add initial support for anisotropic ADPs
- #152
#152
Merged
AndrewSazonov
merged 14 commits into
develop
easyscience/diffraction-lib:develop
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adp
easyscience/diffraction-lib:adp
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Apr 13, 2026
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Add initial support for anisotropic ADPs
#152
AndrewSazonov
merged 14 commits into
develop
easyscience/diffraction-lib:develop
from
adp
easyscience/diffraction-lib:adp
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Commits
Commits on Apr 11, 2026
Create implementation details
AndrewSazonov
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8dd4990
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Rename b_iso to adp_iso and expand adp_type to four values
AndrewSazonov
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44ffc14
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Add adp_iso_as_b property and use it in calculator bridges
AndrewSazonov
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3aaf263
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Add AtomSiteAniso sibling collection with iso-ani conversion
AndrewSazonov
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920b733
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Commits on Apr 12, 2026
Continue implementing ADPs
AndrewSazonov
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2e04a16
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Commits on Apr 13, 2026
Continue implementing ADPs
AndrewSazonov
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b648a10
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Skip diagnostics for private attrs in GuardedBase.__getattr__
AndrewSazonov
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5772c50
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Update SG tutorial
AndrewSazonov
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Apply formatting, etc.
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Update tutorials
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More fixes for the notebooks
AndrewSazonov
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Guard B/U convention consistency across structure atoms
AndrewSazonov
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Fix ADP type assertion in mixed types test to reflect auto-conversion
AndrewSazonov
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5093cc1
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Add CIF loop tag consistency validation in serializer
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0b0a59f
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