[Pw_forum] pwcnd2

ashkan shekaari shekaari at gmail.com
Tue Jul 12 05:43:14 CEST 2016

Dear experts,

Once I perform a pwcond.x calculation with     ikind=1 or 2

I receive the error below:

     task #         1
     from init_orbitals : error #         1
     Too big atomic spheres

What is that?

*Ashkan Shekaari*
*Plasma Physics Research Center*
*Science and Research Branch*
*I A U, 14778-93855 Tehran, Iran.*
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20160712/ba6ebbe3/attachment.html>

More information about the users mailing list