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ABACUS v3.3.3 is available for download!




Feature Updates

  • Feature: add paw_vnl_psi and test

  • Feature: design a new class DensityMatrix

  • Bug fix: support to output the electrostatic potential in OFDFT calculation

  • Bug fix: support cell-relax with OFDFT

  • Bug fix: PBE loop for HF calculation

More information about latest updates (e.g. Test, Refactor, Bug fix and Documentation) can be found on our Github or Gitee repositories