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Add code duplication check to pre-commit

Status: Open.

#79 In Liam-Deacon/CLEED;

· Liam-Deacon opened on Jan 9, 2026

chore(packaging): add Homebrew cask for deployment bundles

Status: Open.

#77 In Liam-Deacon/CLEED;

· Liam-Deacon opened on Jan 9, 2026

chore: C99/C11 modernization for readability

Status: Open.

#74 In Liam-Deacon/CLEED;

· Liam-Deacon opened on Jan 7, 2026

ci: add test coverage to SonarCloud analysis

Status: Open.

#73 In Liam-Deacon/CLEED;

· Liam-Deacon opened on Jan 7, 2026

TODO: benchmark example runs fail with crfac energy mismatch

Status: Open.

#70 In Liam-Deacon/CLEED;

· Liam-Deacon opened on Dec 31, 2025

Switch CLEED IO to phaseshifts adapters

Status: Open.

#54 In Liam-Deacon/CLEED;

· Liam-Deacon opened on Dec 21, 2025

[Feature Request] Modernize Input: Support for POSCAR/ASE Structures via Python Bridge

Status: Open.

#51 In Liam-Deacon/CLEED;

· Liam-Deacon opened on Dec 20, 2025

docs(io): Thoroughly document CLEED input formats (.inp/.bul/.ctr) + cleedpy YAML alternative

Status: Open.

#50 In Liam-Deacon/CLEED;

· Liam-Deacon opened on Dec 18, 2025

feat(cpp): Bring in cleed++ library and ensure C/C++ interop (as in develop)

Status: Open.

#48 In Liam-Deacon/CLEED;

· Liam-Deacon opened on Dec 18, 2025

chore(ci): Collect and publish code coverage reports in CI/CD

Status: Open.

#46 In Liam-Deacon/CLEED;

· Liam-Deacon opened on Dec 17, 2025

docs(examples): Add Jupyter notebook examples for CLEED workflows

Status: Open.

#45 In Liam-Deacon/CLEED;

· Liam-Deacon opened on Dec 17, 2025

feat(phaseshifts): Integrate phaseshifts Python package for phase shift generation

Status: Open.

#44 In Liam-Deacon/CLEED;

· Liam-Deacon opened on Dec 17, 2025