<div>Oh, I see! Thanks for your info!</div>
<div> </div>
<div>Yours,</div>
<div>Jaccob<br><br> </div>
<div><span class="gmail_quote">On 10/30/07, <b class="gmail_sendername">David Holec</b> <<a href="mailto:dh331@cam.ac.uk">dh331@cam.ac.uk</a>> wrote:</span>
<blockquote class="gmail_quote" style="PADDING-LEFT: 1ex; MARGIN: 0px 0px 0px 0.8ex; BORDER-LEFT: #ccc 1px solid">
<div>
<div dir="ltr" align="left"><span><font face="Arial" size="2">Dear Jaccob,</font></span></div>
<div dir="ltr" align="left"><span><font face="Arial" size="2"></font></span> </div>
<div dir="ltr" align="left"><span><font face="Arial" size="2">putting the attached file into SRC_dstart directory and recompiling only this program (using siteconfig -> recompile option) should do it for you. You don't need to reinstall the whole Wien2k.
</font></span></div>
<div dir="ltr" align="left"><span><font face="Arial" size="2"></font></span> </div>
<div dir="ltr" align="left"><span><font face="Arial" size="2">All the best,</font></span></div>
<div dir="ltr" align="left"><span><font face="Arial" size="2">David</font></span></div>
<div> </div>
<p align="left">
<hr>
<font face="Tahoma" size="2"><b>From:</b> <a onclick="return top.js.OpenExtLink(window,event,this)" href="mailto:wien-bounces@zeus.theochem.tuwien.ac.at" target="_blank">wien-bounces@zeus.theochem.tuwien.ac.at</a> [mailto:
<a onclick="return top.js.OpenExtLink(window,event,this)" href="mailto:wien-bounces@zeus.theochem.tuwien.ac.at" target="_blank">wien-bounces@zeus.theochem.tuwien.ac.at</a>] <b>On Behalf Of </b>Jaccob Smith<br><b>Sent:</b>
Tuesday, October 30, 2007 5:14 PM<br><b>To:</b> A Mailing list for WIEN2k users<br><b>Subject:</b> Re: [Wien] Question on internal parameter optimization<br></font><br>
<p></p>
<div><span class="e" id="q_115f1fe954c1e5e4_1">
<div></div>Thanks a lot for your reply and I got your attached file. But there is a question, do I need to remove the compiled wien2k version completely then replace that init.f in the uncompiled package with this one then redo the compilation? Thanks!
<br><br>Yours,<br>Jaccob<br><br>
<div><span class="gmail_quote">On 10/30/07, <b class="gmail_sendername">Peter Blaha</b> <<a onclick="return top.js.OpenExtLink(window,event,this)" href="mailto:pblaha@theochem.tuwien.ac.at" target="_blank">pblaha@theochem.tuwien.ac.at
</a>> wrote:</span>
<blockquote class="gmail_quote" style="PADDING-LEFT: 1ex; MARGIN: 0pt 0pt 0pt 0.8ex; BORDER-LEFT: rgb(204,204,204) 1px solid">Sorry, forget to attach the file.<br><br> P.Blaha<br>--------------------------------------------------------------------------
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</div><br><br clear="all"><br>-- <br>Thanks and Best Wishes.<br><br>Sincerely yours,<br>Bo Qiu<br><a href="http://web.ics.purdue.edu/~qiub/">http://web.ics.purdue.edu/~qiub/</a>