Skip to content

Commit

Permalink
Bumped version to 0.9.2. Updated CHANGELOG.
Browse files Browse the repository at this point in the history
  • Loading branch information
coltonbh committed Oct 2, 2024
1 parent 9470d7f commit c6625fe
Show file tree
Hide file tree
Showing 2 changed files with 9 additions and 2 deletions.
9 changes: 8 additions & 1 deletion CHANGELOG.md
Original file line number Diff line number Diff line change
Expand Up @@ -6,6 +6,12 @@ The format is based on [Keep a Changelog](https://keepachangelog.com/en/1.0.0/),

## [unreleased]

## [0.9.2] - 2024-10-01

### Added

- `energy`, `gradient`, `hessian`, and `optimization` support the the `CRESTAdapter`.

## [0.9.1] - 2024-09-12

### Added
Expand Down Expand Up @@ -309,7 +315,8 @@ The format is based on [Keep a Changelog](https://keepachangelog.com/en/1.0.0/),
- Created adapter for TeraChem.
- Exposed general purpose computing for any subprocess with `FileAdaptor`

[unreleased]: https://github.com/coltonbh/qcop/compare/0.9.1...HEAD
[unreleased]: https://github.com/coltonbh/qcop/compare/0.9.2...HEAD
[0.9.2]: https://github.com/coltonbh/qcop/releases/tag/0.9.2
[0.9.1]: https://github.com/coltonbh/qcop/releases/tag/0.9.1
[0.9.0]: https://github.com/coltonbh/qcop/releases/tag/0.9.0
[0.8.1]: https://github.com/coltonbh/qcop/releases/tag/0.8.1
Expand Down
2 changes: 1 addition & 1 deletion pyproject.toml
Original file line number Diff line number Diff line change
@@ -1,6 +1,6 @@
[tool.poetry]
name = "qcop"
version = "0.9.1"
version = "0.9.2"
description = "A package for operating Quantum Chemistry programs using qcio standardized data structures. Compatible with TeraChem, psi4, QChem, NWChem, ORCA, Molpro, geomeTRIC and many more."
authors = ["Colton Hicks <github@coltonhicks.com>"]
license = "MIT"
Expand Down

0 comments on commit c6625fe

Please sign in to comment.