[Pw_forum] R: Re: Error in routine calbec
Paolo Giannozzi
paolo.giannozzi at uniud.it
Tue Nov 4 15:47:42 CET 2014
On Tue, 2014-11-04 at 12:18 +0000, Carlo Motta wrote:
> However, it seems that if I want to do calculations with Pb,
> I am forced to set
> lspinorb = .true.,
> noncolin = .true.,
> otherwise I get errors.
?
--
Paolo Giannozzi, Dept. 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