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@CasperWA CasperWA released this 04 Sep 14:21
· 20 commits to main since this release

Changelog

v0.6.0.dev0 (2024-09-04)

Full Changelog

Support modern session handling in OTEAPI Core

From OTEAPI Core v0.7.0, sessions are handled differently in strategies, leading to signature changes in the strategy methods.
This development release version matches the current development release version(s) of OTEAPI Core (and OTELib).

Single entity OPTIMADE Structure Resource

A single entity has been added to parse an OPTIMADE Structure resource.
The DLite parse strategy has been updated to support this new entity.

Furthermore, utility/helper functions to parse the resulting species and assemblies data are available at oteapi_optimade.parse_species() and oteapi_optimade.parse_assemblies(), respectively.

DX updates

The permanent dependencies branch has been removed in favor of using Dependabot's groups feature and merging everything directly into main.

Implemented enhancements:

  • Stop using the permanent dependencies branch #254
  • Support new OTEAPI session handling #213
  • Minimize SOFT data model to a single file #195

Merged pull requests:

* This Changelog was automatically generated by github_changelog_generator