Hi,
On 11/24/2015 09:20 AM, azar ostovan wrote:
Dear, siesta users
The kgrid-cutoff parameter no need in the calculation with
kgrid_Monkhorst_Pack block?
Correct, kgrid-cutoff sets the M&P grid for you. Roughly you may
think of it as the density of k-points: the larger the value the
tighter the grid.
I couldn’t understand the sentences in the user manual
/“This parameter is not used if //kgrid Monkhorst Pack //is specified�/
/Â /
Means they are mutually exclusive, but if you specify bnth, then M&P
takes precedence.
And if I define a value for this parameter during the calculation it may
result in wrong results?
Of course not ;)
Regards,
Roberto
