thank you for your kind response. i can not understand the problem according to your directions. it is mine fault as i am not much experienced in Linux. i simply installed wien2k in root directory and now it is working fine. <br>
<br><div class="gmail_quote">On Wed, Sep 19, 2012 at 1:32 PM, Peter Blaha <span dir="ltr"><<a href="mailto:pblaha@theochem.tuwien.ac.at" target="_blank">pblaha@theochem.tuwien.ac.at</a>></span> wrote:<br><blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex">
Check the compilation. sgroup is a C program, not fortran.<br>
<br>
cd SRC_sgroup<br>
more compile.msg<br>
<br>
<br>
Am 18.09.2012 10:39, schrieb Muhammad Sajjad:<br>
<blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex"><div><div class="h5">
Respected Group Members<br>
<br>
hello.<br>
<br>
I re-installed wien2k version 8 on a machine of type Dell Core I5 Desktop with operating system FEDORA17 (64 BIT) , fortran compiler<br>
<br>
"l_fcompxe_2013.0.079".<br>
when i start OPT then i found error on clicking 'x sgroup' in initialization, and the error is<br>
<br>
/home/WIEN2K/w2k8/sgroup: Command not found.<br>
/home/WIEN2K/w2k8/sgroup: Command not found.<br>
diff: OPT.outputsgroup: No such file or directory<br>
diff: OPT.outputsgroup1: No such file or directory<br>
/home/WIEN2K/w2k8/sgroup: Command not found.<br>
0.000u 0.000s 0:00.00 0.0% 0+0k 0+0io 0pf+0w<br>
error: command /home/WIEN2K/w2k8/sgroup -wi OPT.struct -wo OPT.struct_sgroup -set-TOL=0.00001 failed<br>
<br>
<br>
I am unable to find the reason and solution to this problem. Please guide me in this regard.<br>
<br>
Thank you..<br>
<br>
<br></div></div><div class="im">
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-- <br>
------------------------------<u></u>-----------<br>
Peter Blaha<br>
Inst. Materials Chemistry, TU Vienna<br>
Getreidemarkt 9, A-1060 Vienna, Austria<br>
Tel: +43-1-5880115671<br>
Fax: +43-1-5880115698<br>
email: <a href="mailto:pblaha@theochem.tuwien.ac.at" target="_blank">pblaha@theochem.tuwien.ac.at</a><br>
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