ABACUS v3.5.1 is available for download!
Time:2024-01-15
Feature: Quasiatomic Orbital implementation
Feature: autoset efield related parameters
Feature: pythonization of two-center integral module
Feature: enable using spherical Bessel coefficients as an alternative to numerical atomic orbital file
Feature: add cg method for lcao basis
More information about latest updates (e.g. Test, Refactor, Bug fix and Documentation) can be found on our Github or Gitee repositories