Releases: libAtoms/QUIP
Releases · libAtoms/QUIP
v0.10.1
What's Changed
- Fix macOS wheel bundling by setting DYLD_LIBRARY_PATH for delocate by @jameskermode in #698
Full Changelog: v0.10.0...v0.10.1
v0.10.0
What's Changed
- [WIP] Fix memory leak when initializing GAP and vDW by @bernstei in #606
- updated module versions for archer2 makefile by @JPDarby in #612
- Update README.md by @computerscienceiscool in #629
- Update python and cibuildwheel versions by @ATM-Jahid in #649
- Omit manylinux2010 (EOL) from build-wheels by @ATM-Jahid in #650
- Make manylinux2014 the default in openblas_support by @ATM-Jahid in #651
- Update Dockerfile by @ATM-Jahid in #652
- Change rdkit-pypi to rdkit in Dockerfile by @ATM-Jahid in #654
- updating the version of GAP by @sujona in #653
- MAINT: Fix return type errors from macros by @HaoZeke in #658
- updating the version of GAP by @albapa in #659
- Arch file for ARM MacOS with OpenMPI by @stenczelt in #661
- Added SphericalIterative() and GradSphericalIterative() to angular_functions.f95 by @lraybould in #619
- update version bound on f90wrap by @jameskermode in #663
- Fix incorrect type in fgetc and fputc by @green-br in #683
- Complete meson-python build system migration with test fixes by @jameskermode in #694
- Complete meson-python build system migration with CI fixes by @jameskermode in #695
- Fix PyPI version override for tagged releases by @jameskermode in #697
New Contributors
- @computerscienceiscool made their first contribution in #629
- @ATM-Jahid made their first contribution in #649
- @sujona made their first contribution in #653
- @lraybould made their first contribution in #619
- @green-br made their first contribution in #683
Full Changelog: v0.9.14...v0.10.0
v0.9.14
Added Python 3.11 wheels
v0.9.13
Merge pull request #593 from albapa/public updating the version of GAP
v0.9.12
Merge pull request #540 from libAtoms/wheel_cli_executables re-add md and vasp_driver to executables in wheel
v0.9.11
Merge pull request #507 from Sideboard/xml_config_string GAP: Add config string to XML
v0.9.10
Merge branch 'public' of github.com:libAtoms/QUIP into public
v0.9.10-rc9
Merge branch 'public' of github.com:libAtoms/QUIP into public
v0.9.10-rc8
Merge pull request #470 from libAtoms/no_pip_exec Use python -m pip instead of the pip executable
v0.9.10-rc7
update GAP pointer to include compression PR