If I remember correctly the charge density of the self-consistent calculation is not overwritten by a non-scf calculation.
Paol On Mon, Oct 26, 2015 at 2:40 AM, Jiqiang Li <[email protected]> wrote: > Dear all, > can anybody tell me whether the charge density from scf calculation > would be overrided in a nscf calculation? > Thanks in advance! > > Jiqiang Li > > ------------------------------ > > _______________________________________________ > Pw_forum mailing list > [email protected] > http://pwscf.org/mailman/listinfo/pw_forum > -- Paolo Giannozzi, Dept. Chemistry&Physics&Environment, Univ. Udine, via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222
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