Dear all, I use the orderN to calculate of two quite large systems of atoms:
Nanodot: 762 atoms of the Si46 clathrate nanowire: 1762 atoms in a unit cell of the Si46 clathrate I have a problem with convergence of the siesta run with only periodic system (i.e :nanowire). Does "orderN" option only works for isolated systems? i would be thankful for any advice. Thanks a lot before, Karim
