Version 1.4.1
Important change
EA-vc
- The number of atoms operated on in addition, elimination, and substitution can now be changed. The number is randomly selected up to 3 by default (in 1.4.0, it was always 1).
Added
Charge neutral condition
- It is now possible to impose a charge neutrality condition during structure generation in EA-vc.
Subcommand
- cryspy-Eplot: (CrySPY > Features > Re-plot convex hull )