SOAP Kernel for IAP#246

Merged

bwpriest merged 44 commits intollnl:developfrom

gsallaberry:iap_develop

Sep 26, 2025

Commits on Jun 25, 2025

Base setup for SOAP Kernel
gsallaberry
committed

Commits on Jun 26, 2025

Restructured SOAP kernel implementation for consistency
gsallaberry
committed

Commits on Jun 27, 2025

Fix style so CI stops yelling at me
gsallaberry
committed

Commits on Jul 1, 2025

correct Kout shape
gsallaberry
committed

Commits on Jul 7, 2025

Add kernel tests
gsallaberry
committed

Commits on Jul 9, 2025

Commits on Jul 22, 2025

Change similarity tensor math to broadcasting. Updated test
gsallaberry
committed

Commits on Jul 25, 2025

Update similarity tensor calculation to produce correct organization of axes
gsallaberry
committed

Commits on Jul 28, 2025

Commits on Aug 7, 2025

Commits on Aug 11, 2025

More shape experimentation
gsallaberry
committed

Commits on Sep 2, 2025

Commits on Sep 12, 2025

Commits on Sep 23, 2025

Syntax and style fixes
gsallabe
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Modify Kout to match new workflow
gsallabe
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Add imports for test functions
gsallabe
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import for Kout
gsallabe
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Commits on Sep 24, 2025

Add jax support for SOAP related fns
gsallabe
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Add NotImplemented errors to kernel backends
gsallabe
committed

Commits on Sep 25, 2025

Raise correct errors for non-implemented backends
gsallabe
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fix typos
gsallabe
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Example notebook
gsallabe
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Commits on Sep 26, 2025

Test infrastructure
gsallabe
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Typo corrections
gsallabe
committed