He probably means the number of basis functions for the wave function expansion.
Can be found using
grep :RKM case.scf
where both, the "effective " RKmax and the matrix size (number of APWs+LOs) is
given.
Am 18.12.2013 03:53, schrieb Gavin Abo:
Someone can correct me if I'm wrong, but I think they are referring to the "PLANE
WAVES GENERATED (INCLUDING FORBIDDEN H,K,L)" value in case.outputd.
On 12/17/2013 2:51 AM, kalsoom Khan wrote:
please dear all
i was studying one paper, in which i read "the calculations are converged with
respect to Rmt*Kmax up to 8.0 correspondinding to 29181 plane waves" so can some say
me
that how i can find the plane waves valve i.e .
with regards
kkhan
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