Merge branch 'release-0.1.2'

CHANGELOG.md

@@ -6,16 +6,14 @@ The format is based on [Keep a Changelog](https://keepachangelog.com/en/1.0.0/),
 
 ## [unreleased]
 
+## [0.1.2]
+
 ### Changed
 
 - Wrapped `qcng.compute` and `qcng.compute_procedure` directly with `bigqc.task` rather than redefining each function
 - Simplified settings by removing `get_settings` function in favor of globally defined `settings` object. (No advantage to using a callable since we are not using dependency injection of a settings callable.)
 - Updated app name to `bigqc` from `tasks` in `app.py`.
 
-### Added
-
-### Removed
-
 ## [0.1.1]
 
 ### Changed
@@ -36,6 +34,7 @@ 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/coltonbh/bigqc/compare/0.1.1...HEAD
+[unreleased]: https://github.com/coltonbh/bigqc/compare/0.1.2...HEAD
+[0.1.2]: https://github.com/coltonbh/bigqc/releases/tag/0.1.2
 [0.1.1]: https://github.com/coltonbh/bigqc/releases/tag/0.1.1
 [0.1.0]: https://github.com/coltonbh/bigqc/releases/tag/0.1.0

bigqc/__init__.py

@@ -0,0 +1 @@
+__version__ = "0.1.2"

pyproject.toml

@@ -1,6 +1,6 @@
 [tool.poetry]
 name = "bigqc"
-version = "0.1.1"
+version = "0.1.2"
 description = "A distributed system for scaling and parallelizing quantum chemistry calculations"
 authors = ["Colton Hicks <[email protected]>"]
 license = "MIT"