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ABACUS v2.3.4 is available for download!




Feature Updates

  • Feature: plot different contributions of atomic orbitals in PBANDS

  • Feature: add openmp in ORB_table_phi::cal_ST_Phi12_R()

  • Feature: log math lib info

  • Feature: build libxc in the absence of local install

  • Feature: add force correction for implicit solvation model

  • Performance: Optimize SDFT to use less Chebyshev expansions 

  • Performance: accelerate stochastic DOS

  • Feature: add dpgen autotest example

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