Skip to content

v0.0.21

Latest
Compare
Choose a tag to compare
@github-actions github-actions released this 05 Jun 16:42

Bug Fixes 🐛

  • switch to CONTCAR read for LOBSTERTaskDoc by @naik-aakash in #1204
  • cover cases where optimizer does additional steps even though step is set to 0 or 1 for writing xyz files by @JaGeo in #1207
  • Remove walrus operator to avoid unassigned vmax by @Jonas-Finkler in #1203

Enhancements 🛠

  • add file output xyz file including final atoms object to ase and forcefield jobs by @JaGeo in #1206

Documentation 📖

  • Add video tutorials to README by @JaGeo in #1191
  • be more concrete for tutorial video names in readme by @JaGeo in #1192
  • Adding download statistics to readme by @JaGeo in #1209

New Contributors

Full Changelog: v0.0.20...v0.0.21