Changelog
- Print atomic dispersion energies by @marvinfriede in #46
- Implementation of Actinides. by @lukaswittmann in #48
- Add config for RTD by @awvwgk in #51
- Update interface for gradient for PySCF 2.4 by @sunqm in #52
- Fix build workflow by @marvinfriede in #47
- Binary distribution for Python 3.12 by @tvogels in #55
- Update CI workflow by @awvwgk in #59
- Enable C language in case we link with MKL by @awvwgk in #58
- Update list of users and implementations by @awvwgk in #60
- Update codecov workflow and actions by @awvwgk in #61
- Remove unused BLAS dependency from project by @awvwgk in #63
- Add workflow based on cibuildwheels by @awvwgk in #65
- Add paper references for packages using s-dftd3 by @awvwgk in #66
- Add damping parameters for revDSD double hybrid functionals by @awvwgk in #71
- Fix periodic PySCF calculations by @aizvorski in #74
- Release version 1.1.0 by @awvwgk in #53
New Contributors
- @marvinfriede made their first contribution in #46
- @lukaswittmann made their first contribution in #48
- @sunqm made their first contribution in #52
- @tvogels made their first contribution in #55
- @aizvorski made their first contribution in #74
Full Changelog: v1.0.0...v1.1.0