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v0.10.2

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@github-actions github-actions released this 05 Oct 20:09
· 113 commits to main since this release

v0.10.2 (2026-10-05)

This release is published under the MIT License.

Bug Fixes

  • Use the full Slurm task count for PySCF Hessian threads (f27cc1e)

A default tasks of 1 hid tasks_per_node, so Hessian nodes ran on one thread. Apply that count before the molecule is built and to the BLAS pools.

Co-authored-by: Cursor cursoragent@cursor.com


Detailed Changes: v0.10.1...v0.10.2