Hi Rob,
You might be interested in the Atomic Pseudopotential Engine (search the
web). Don't ask me anything, I've never used it, but it seems to ba
capable of doing what you want.
Regards,
Roberto
On Tue, 20 Jul 2010, Koch, Robert J wrote:
Hello all,
Does anyone have access to the c
Hello all,
Does anyone have access to the code used in PRB 68, (2003): "First-principles
norm-conserving pseudopotential with explicit incorporation of semicore states"
(Carlos L. Reis, J. M. Pacheco, and Jose Luıs Martins)
Their paper says it is freely available fromRB http://aloof.cii.fc.ul.p
