<html>
<head>
<style><!--
.hmmessage P
{
margin:0px;
padding:0px
}
body.hmmessage
{
font-size: 10pt;
font-family:Tahoma
}
--></style>
</head>
<body class='hmmessage'>
Hi Stefaan,<br><br> Thanks. I did notice the warning about R0 and before I sent my earlier email I reduced it to <br>0.00008 from the defalt value 0.0001 but the warning persited. But now I have reduced it <br>further to 0.00001 and its working. <br><br>Thanks again,<br>Fhokrul<br><br><br><br>> Date: Tue, 7 Sep 2010 15:20:31 +0200<br>> From: Stefaan.Cottenier@UGent.be<br>> To: wien@zeus.theochem.tuwien.ac.at<br>> Subject: Re: [Wien] core charge leakage in wien2k_10.1<br>> <br>> <br>> This error message is perhaps a bit misleading. Note that the actual <br>> message is about R0, not about RMT:<br>> <br>> > WARNING: R0 for atom 1 Z= 31.00 too big<br>> <br>> Stefaan<br>> _______________________________________________<br>> Wien mailing list<br>> Wien@zeus.theochem.tuwien.ac.at<br>> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien<br> </body>
</html>