scnc
/
conquest
mirror of https://github.com/OrderN/CONQUEST-release.git
1
0
Fork 0
Code Issues Packages Projects Releases Wiki Activity
conquest/pseudo-and-pao/GTH_LDA/S_q6/Conquest_ion_input

13 lines
169 B
Plaintext
Raw Permalink Blame History

General.NumberOfSpecies 1
General.PSFormat hgh
%block SpeciesLabels
1 S
%endblock
%block S
Atom.PseudopotentialFile S.hgh
Atom.ZetaForm com
Atom.Cutoffs en
%endblock
Reference in New Issue View Git Blame Copy Permalink