[Pw_forum] cpmd2upf.x for Norm Conserving pseudopotentials

Paolo Giannozzi giannozz at democritos.it
Sun Jan 20 18:40:53 CET 2013


On Jan 20, 2013, at 12:58 , Ali KACHMAR wrote:

> Is there any risk to take the max local= 1 in this case:

of course there isn't any: in the worst-case scenario, you
just get bad results. Just try and see what happens.

P.
---
Paolo Giannozzi, Dept of Chemistry&Physics&Environment,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222







More information about the users mailing list