conquest/pseudo-and-pao/LDA/Sb/Conquest_ion_input

12 lines
158 B
Plaintext

General.NumberOfSpecies 1
%block SpeciesLabels
1 Sb
%endblock
%block Sb
Atom.PseudopotentialFile Sb.in
Atom.VKBFile Sb.pot
Atom.BasisSize medium
%endblock