Default : | |
for TM and RRKJ | maximum cutoff radius found in Description section |
else | must be supplied |
Determines the core radius for the pseudopotential generation.
At the core radius the logarithmic derivatives of the
AE wave functions and the pseudo wave functions are matched.
For some schemes (TM and RRKJ) this core radius can be similar
to the cutoff radius
supplied in the Description section of the PSCTR file
11.4.11. For these schemes the pseudo wave function
is strictly the same as the AE wave function for
. This
is not the case for the BHS, VAN and XNC scheme. Here
RCORE must be supplied by the user and should be 1.5 times
as large as the maximum cutoff radius
.