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Commits on Dec 10, 2025

• Fix CI workflow for cross-runner library compatibility

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Commits on Dec 9, 2025

• Add pyproject.toml and update CI for reproducible Python environment

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• Fix test tolerances and expectations in export test suite

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• Document OpenMP parallelization in export README

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• Add OpenMP parallelization to LAMMPS ACE plugin

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• Add OpenMP-accelerated Python calculator wrapper

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• Fix MPI and threading tests for portable LAMMPS detection

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• Fix LAMMPS test issues and skip Julia ccall threading tests

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• Add comprehensive test infrastructure for export functionality

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• Refactor export feature into top-level export/ directory

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• Add LAMMPS plugin for loading ACE potential models

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• Add C interface and Python wrapper for ACE shared library

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• Add juliac --trim compilation tests for LAMMPS export

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Commits on Dec 3, 2025

• Merge pull request #304 from ACEsuit/dev-0.10

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• Revise Quick Start instructions in README.md

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• Revise version details and installation instructions

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Commits on Nov 20, 2025

• Document future Lux-based backend migration roadmap

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• Update bug fix notes: RMSE thresholds reverted to strict values

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• Document critical basis size bug fix from commit 0910f528

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• more conflict resolution

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• Revert "Update RMSE test thresholds with scientific baseline methodology"

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Commits on Nov 19, 2025

• fix basis size bug

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Commits on Nov 16, 2025

• minor edits/cleanup

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Commits on Nov 15, 2025

• Merge pull request #303 from jameskermode/equivarient-tensors-port

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Commits on Nov 14, 2025

• Merge pull request #1 from jameskermode/claude/explore-repo-structure-011CV4PfXPf4MHS4ceHdoMQe

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• Bump version to 0.10.0

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Commits on Nov 13, 2025

• cleanup

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• Cleanup: Remove temporary files and update CLAUDE.md

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• Mark test_bugs.jl as known failure on Julia 1.12

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• Fix: Disable fast_evaluator due to SparseACEbasis incompatibility

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• Fix: Update fasteval.jl for SparseACEbasis (partial - fast_evaluator broken)

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• Refactor: Migrate to upstream SparseACEbasis from EquivariantTensors

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• Update RMSE test thresholds with scientific baseline methodology

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• Update CI to use Python 3.11 instead of EOL Python 3.8

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• Expand CI to test Julia 1.11 and 1.12 in parallel

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