[CP2K:6957] KPoint Implmentation in CP2K

S Ling lingsa... at gmail.com
Sun Sep 6 19:53:34 UTC 2015

Gamma point only.

On 6 Sep 2015 20:26, "Declan Scullion" <dec... at hotmail.co.uk> wrote:

> Hi
> Thanks for all the help! Just a quick (and maybe pointless) question.
> Prior to the KPOINTS implementation in CP2K how was the Brillioun zone
> sampled? Was a single KPOINT used (gamma point maybe) or was a set number
> of KPOINTS used?
> Regards,
> Declan
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