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crest version 3.0.2

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@pprcht pprcht released this 25 Aug 20:33
· 16 commits to master since this release

CREST version 3.0.2 🛡️

Build updates and fixes 🛠️

What's Changed

  • 🪲 Minor bug fixes for MSREACT mode by @gorges97 in #309
  • 🪲 Circumvent segfault due to optional arg in gcc build in #318
  • 🪲 Fix for #320 in #322
  • 🔒 Safer toml input parsing in #325 Unrecognized keywords will now throw a warning and stop the program immediately
  • 🛠️ Maintenance of submodules in #328
  • ⚙️ Update of GitHub workflows in #335
  • 🛠️ Safer (but unfortunately still not fixed) MKL handling for ifort builds in #331
  • 🌊 Fixing implicit solvation in tblite submodule in #331 (most important change, should now be consistent with xtb)
  • 📦 Added a GNU/CMake static build for the continuous release, alongside the Intel build:
    Download (GNU)

Full Changelog: v3.0.1...v3.0.2