Published May 31, 2026 | Version v1.2.9
Software Open

quacc – The Quantum Accelerator

Authors/Creators

  • 1. Department of Chemical and Biological Engineering, Princeton University

Description

What's Changed

  • Bump phonopy from 3.5.1 to 4.0.1 by @dependabot[bot] in https://github.com/Quantum-Accelerators/quacc/pull/3246
  • Bump pymatgen from 2025.10.7 to 2026.5.4 by @dependabot[bot] in https://github.com/Quantum-Accelerators/quacc/pull/3244
  • Bump fairchem-core from 2.19.0 to 2.20.0 by @dependabot[bot] in https://github.com/Quantum-Accelerators/quacc/pull/3245
  • Bump prefect from 3.7.0 to 3.7.1 by @dependabot[bot] in https://github.com/Quantum-Accelerators/quacc/pull/3247
  • Bump parsl from 2026.5.11 to 2026.5.18 by @dependabot[bot] in https://github.com/Quantum-Accelerators/quacc/pull/3248
  • Bump monty from 2026.2.18 to 2026.5.18 by @dependabot[bot] in https://github.com/Quantum-Accelerators/quacc/pull/3243
  • Add auto_ispin parameter to matpes.py by @Andrew-S-Rosen in https://github.com/Quantum-Accelerators/quacc/pull/3250
  • Bump prefect from 3.7.1 to 3.7.2 by @dependabot[bot] in https://github.com/Quantum-Accelerators/quacc/pull/3254
  • Bump phonopy from 4.0.1 to 4.1.0 by @dependabot[bot] in https://github.com/Quantum-Accelerators/quacc/pull/3253
  • Replace monty serialization with ruamel.yaml for loading by @Andrew-S-Rosen in https://github.com/Quantum-Accelerators/quacc/pull/3255
  • Bump tblite from 0.4.0 to 0.6.0 by @dependabot[bot] in https://github.com/Quantum-Accelerators/quacc/pull/3241
  • Bump matgl from 3.0.3 to 4.0.0 by @dependabot[bot] in https://github.com/Quantum-Accelerators/quacc/pull/3251
  • Update pyproject.toml by @Andrew-S-Rosen in https://github.com/Quantum-Accelerators/quacc/pull/3256
  • Bump sella from 2.3.5 to 2.4.2 by @dependabot[bot] in https://github.com/Quantum-Accelerators/quacc/pull/3189

Full Changelog: https://github.com/Quantum-Accelerators/quacc/compare/v1.2.8...v1.2.9

Notes

Please cite this work as follows if you use quacc.

Files

Quantum-Accelerators/quacc-v1.2.9.zip

Files (34.5 MB)

Name Size Download all
md5:28a4c980cd7a66366a6d264f439ef8bc
34.5 MB Preview Download

Additional details

Related works

Is supplement to
Software: https://github.com/Quantum-Accelerators/quacc/tree/v1.2.9 (URL)

Software

Repository URL
https://github.com/Quantum-Accelerators/quacc