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LibRPA v0.8.0

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@minyez minyez released this 23 Sep 08:59
· 20 commits to master since this release

LibRPA v0.8.0

Highlights:

  • Added experimental fixed-basis QSGW workflows.
  • Added dense binary NAO-basis EXX matrix exports.
  • Added input presets and a reusable file-reader API for external programs.
  • Improved LibRI work distribution and profiling.

Breaking changes:

  • output_gw_sigc_mat_kf exports changed from Matrix Market .mtx to dense binary .bin.
  • The default number of time/frequency points, nfreq, changed from 6 to 16.

See CHANGELOG.md for complete release notes.