diff --git a/CHANGELOG.md b/CHANGELOG.md index 6f9e40c..a283842 100644 --- a/CHANGELOG.md +++ b/CHANGELOG.md @@ -6,6 +6,8 @@ The format is based on [Keep a Changelog](https://keepachangelog.com/en/1.0.0/), ## [unreleased] +## [0.8.1] - 2024-07-12 + ### Added - `release.py` script. @@ -254,7 +256,8 @@ The format is based on [Keep a Changelog](https://keepachangelog.com/en/1.0.0/), - Initial release of core BigQC feature set. Tasks for `compute` (single point energy, gradient, hessian, and properties calculations) and `compute_procedure` (geometry optimization routine). Algorithms for distributed hessian and normal mode analysis with their associated tasks. -[unreleased]: https://github.com/mtzgroup/bigchem/compare/0.8.0...HEAD +[unreleased]: https://github.com/mtzgroup/bigchem/compare/0.8.1...HEAD +[0.8.1]: https://github.com/mtzgroup/bigchem/releases/tag/0.8.1 [0.8.0]: https://github.com/mtzgroup/bigchem/releases/tag/0.8.0 [0.7.2]: https://github.com/mtzgroup/bigchem/releases/tag/0.7.2 [0.7.1]: https://github.com/mtzgroup/bigchem/releases/tag/0.7.1 diff --git a/pyproject.toml b/pyproject.toml index e635c80..98c0f81 100644 --- a/pyproject.toml +++ b/pyproject.toml @@ -1,6 +1,6 @@ [tool.poetry] name = "bigchem" -version = "0.8.0" +version = "0.8.1" description = "A distributed system for scaling and parallelizing quantum chemistry calculations" authors = ["Colton Hicks "] readme = "README.md"