<div dir="ltr">Dear <span style="font-family:arial,sans-serif;font-size:12.727272033691406px">Okoye</span><div><font face="arial, sans-serif">Thank you for your suggestion, I have tried this already and repeated it again with mixing factor 0.3, but the problem is still there. Any other suggestion Okoye and other Wien2k users please? </font></div>
<div><font face="arial, sans-serif"><br></font></div><div><font face="arial, sans-serif">Regards</font></div></div><div class="gmail_extra"><br><br><div class="gmail_quote">On Sat, Sep 7, 2013 at 9:36 PM, <span dir="ltr"><<a href="mailto:okoyecmi@yahoo.com" target="_blank">okoyecmi@yahoo.com</a>></span> wrote:<br>
<blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex">I think you should increase the mixing factor after some initial scf cycles. This is contained in the UG.<br>
Regards<br>
C M I Okoye<br>
Sent from my BlackBerry wireless device from MTN<br>
<br>
-----Original Message-----<br>
From: Muhammad Sajjad <<a href="mailto:sajjadpu@gmail.com">sajjadpu@gmail.com</a>><br>
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Date: Sat, 7 Sep 2013 21:29:42<br>
To: wien<<a href="mailto:Wien@zeus.theochem.tuwien.ac.at">Wien@zeus.theochem.tuwien.ac.at</a>><br>
Reply-To: A Mailing list for WIEN2k users <<a href="mailto:wien@zeus.theochem.tuwien.ac.at">wien@zeus.theochem.tuwien.ac.at</a>><br>
Subject: [Wien] About mBJ convergence<br>
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