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ABACUS v3.3.1 is available for download!




Feature Updates

  • Feature: new method to dynamicaly change symmetry_prec during cell-relax

  • Feature: add energy output in lj/dp

  • Bug fix: output HexxR errors for few k-points

  • Bug fix: update code for S(t+dt/2)

  • Bug fix: charge extrapolation in sdft-md

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