Changelog
- replace deprecated
make_directory
withfile(MAKE_DIRECTORY)
by @e-kwsm in #18 - Update install-mod.py by @kjelljorner in #19
- Fix finding of MKL for Intel 2021 and newer by @awvwgk in #20
- Add support for BLAS/LAPACK ILP64 libraries by @dmejiar in #16
- Added actinide parameters. by @lukaswittmann in #24
- Fix issue #27: Charge Handling by @lukaswittmann in #28
- Fix continuous integration by @marcelmbn in #31
- Treat Intel LLVM compiler as standard Intel compiler. by @hongyi-zhao in #32
- Provide support for JSON output in
tblite
flavour by @marcelmbn in #29 - Make flags for gradient evaluation more consistent by @marcelmbn in #33
- Update to version 0.3.0 by @awvwgk in #34
New Contributors
- @kjelljorner made their first contribution in #19
- @dmejiar made their first contribution in #16
- @lukaswittmann made their first contribution in #24
- @marcelmbn made their first contribution in #31
- @hongyi-zhao made their first contribution in #32
Full Changelog: v0.2.0...v0.3.0