Dear List,
I would like to announce a new version of the SIESTA calculator for the
Atomic Simulation Environment(ASE) <https://wiki.fysik.dtu.dk/ase/>. It
is now in the development version of ASE.
Improved features from previous implementation:
1. Improved flexibility of pseudopotential input.
2. Easier handling of ghost atoms and fine-grained basis sets.
3. Improved input control and error handling.
4. Greater compatibility with ASE functionality.
Reasons to use ASE:
1. Great constraint functionality.
2. Easy to set up structures.
3. Consistent interface to many codes.
If you try to use and find any bugs, please report to me.
Mads Engelund