Folks, is there a way to convert a 'PRIMVEC' block (from xcrysden) into 'celldm' as understood by QE ? I don't seem to be able to figure it out myself.
thx., H
Folks, is there a way to convert a 'PRIMVEC' block (from xcrysden) into 'celldm' as understood by QE ? I don't seem to be able to figure it out myself.
thx., H