Wierd Automatically generated KPOINT
Posted: Thu Sep 14, 2006 10:21 pm
I'm working with a double-wide GaAs 2x4 (i.e. 2 standard 2x4 unit cells) slab and found that when trying to generate a 2 2 1 Monkhorst-Pack k-mesh if gives me only one, non-Gamma point with a weight of 4 (0.25 0.25 0.00 4). This seems a bit odd to me, anyone know why it does this?