In this case I don't understand why lapw0 is hanging. Can you
send the subroutine brj.f?
On Tuesday 2016-10-25 12:18, Dr. K. C. Bhamu wrote:
Date: Tue, 25 Oct 2016 12:18:41
From: Dr. K. C. Bhamu <kcbham...@gmail.com>
Reply-To: A Mailing list for WIEN2k users <wien@zeus.theochem.tuwien.ac.at>
To: A Mailing list for WIEN2k users <wien@zeus.theochem.tuwien.ac.at>
Subject: Re: [Wien] regarding hanging of job and mBJ
Probably your are using an old version of WIEN2k with the old
scheme
to find the solution of the nonlinear equation in brj.f. You
should get
the new version brj.f which avoids such problems.
No, I am using latest version of Wien2k with mkl+ifort.
It is not for all case. It happens for few cases and it doesn't matter that
which case I am running.
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