Code

WIP : Sphericart Integration#81

Code

Merged

cortner merged 12 commits intomainACEsuit/Polynomials4ML.jl:mainfrom lz/sphericartACEsuit/Polynomials4ML.jl:lz/sphericartCopy head branch name to clipboardJan 16, 2024

+272-1

Commits

Commits on Nov 9, 2023

• WIP: Interface for SpheriCart - clean-up and tests still missing

  zhanglw0521

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  bd06fac

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• basic tests without laplacian and zygote tests

  zhanglw0521

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  01c0927

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• Clean up + tests added

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  zhanglw0521

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• add natural_indices for SYlmbasis & update Project.toml

  zhanglw0521

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  111468f

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• Fix Typos

  zhanglw0521

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Commits on Nov 10, 2023

• debug pullback, add tests

  zhanglw0521

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• Merge branch 'ACEsuit:main' into SpheriCart_Ylm

  zhanglw0521

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Commits on Jan 11, 2024

• ad hoc change for serial evaluation

  zhanglw0521

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Commits on Jan 12, 2024

• Merge pull request #76 from zhanglw0521/SpheriCart_Ylm

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  cortner

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• cleanup whitespaces

  

  cortner

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Commits on Jan 16, 2024

• fix version bounds

  

  cortner

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• Merge branch 'main' into lz/sphericart

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  cortner

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