Atomic data files
You may download three types of recommended atomic data files :
You may produce your own atomic data files :
To use ABINIT in specific conditions it is recommended to produce your own atomic data sets.
This is the case, for example, if one wants to make simulations in specific thermodynamic conditions, or use specific exchange-correlation functionals, etc...
- Norm-conserving pseudo potential generators
- PAW atomic data file generators
You may download miscellaneous atomic data files
These include pseudopotentials without non-linear core correction (e.g. for metaGGA), or pseudopotentials needed to reproduce results obtained in old publications.