<div dir="ltr"><div>Dear Andy,</div><div> </div><div>I have run command molpro -v -n 2 <a href="http://h2-hf.com">h2-hf.com</a> >& OUTPUT &</div><div> </div><div>Only output file was created in the directory. So I attached this OUTPUT file together with input file (I just changed extension from com to txt-com). I also have compiled molpro-2010.1-23 using source code and it works fine under CentOS6.0 I attached output file OUTPUT-work from this calculation as well (may be it will help you to understand the problem).</div>
<div> </div><div> </div><div>Thank you David<br></div><div> </div><div class="gmail_quote">On Thu, Sep 8, 2011 at 1:35 PM, Andy May <span dir="ltr"><<a href="mailto:MayAJ1@cardiff.ac.uk">MayAJ1@cardiff.ac.uk</a>></span> wrote:<br>
<blockquote style="margin: 0px 0px 0px 0.8ex; padding-left: 1ex; border-left-color: rgb(204, 204, 204); border-left-width: 1px; border-left-style: solid;" class="gmail_quote">David,<br>
<br>
Please could you create a new directory, copy in the input file and then run again with -v option, i.e.:<br>
<br>
molpro -v -n 4 <a href="http://h2-hf.com" target="_blank">h2-hf.com</a><br>
<br>
and then send the full output along with any files in the directory, including the input file.<br>
<br>
Best wishes,<br>
<br>
Andy<div class="im"><br>
<br>
On 07/09/11 14:44, David Danovich wrote:<br>
</div><blockquote style="margin: 0px 0px 0px 0.8ex; padding-left: 1ex; border-left-color: rgb(204, 204, 204); border-left-width: 1px; border-left-style: solid;" class="gmail_quote"><div class="im">
Hello,<br>
I have installed molpro-mpp-2010.1-23.Linux_<u></u>x86_64 on CentOS6.0 (from<br>
binary file) and got following error message (command: molpro -n 4<br>
</div><a href="http://h2-hf.com" target="_blank">h2-hf.com</a> <<a href="http://h2-hf.com" target="_blank">http://h2-hf.com</a>> )<div class="im"><br>
<br>
tmp =<br>
/home/dodik/pdir//home/dodik/<u></u>PROGRAMS/molpro-2010-1-23/<u></u>molprop_2010_1_Linux_x86_64_<u></u>i8.exe.p<br></div>
Creating: host=<a href="http://lewis.ch.huji.ac.il" target="_blank">lewis.ch.huji.ac.il</a> <<a href="http://lewis.ch.huji.ac.il" target="_blank">http://lewis.ch.huji.ac.il</a>>,<div class="im"><br>
user=dodik,<br>
<br>
file=/home/dodik/PROGRAMS/<u></u>molpro-2010-1-23/molprop_2010_<u></u>1_Linux_x86_64_i8.exe,<br>
port=45855<br>
forrtl: severe (71): integer divide by zero<br>
Image PC Routine Line Source<br>
Unknown 00002AB8957BDD63 Unknown Unknown Unknown<br>
Unknown 00002AB8957ABE3D Unknown Unknown Unknown<br>
Unknown 00002AB89553BBA3 Unknown Unknown Unknown<br>
molprop_2010_1_Li 00000000035EE0DD Unknown Unknown Unknown<br>
molprop_2010_1_Li 00000000035EDF16 Unknown Unknown Unknown<br>
molprop_2010_1_Li 0000000003230629 Unknown Unknown Unknown<br>
molprop_2010_1_Li 0000000003231044 Unknown Unknown Unknown<br>
molprop_2010_1_Li 000000000322CE76 Unknown Unknown Unknown<br>
molprop_2010_1_Li 000000000322DB1B Unknown Unknown Unknown<br>
molprop_2010_1_Li 000000000184887B Unknown Unknown Unknown<br>
molprop_2010_1_Li 0000000001845B62 Unknown Unknown Unknown<br>
molprop_2010_1_Li 0000000000402C0F Unknown Unknown Unknown<br>
molprop_2010_1_Li 0000000000400535 Unknown Unknown Unknown<br>
molprop_2010_1_Li 00000000004004DC Unknown Unknown Unknown<br>
molprop_2010_1_Li 000000000359EB99 Unknown Unknown Unknown<br>
molprop_2010_1_Li 00000000004003A9 Unknown Unknown Unknown<br>
4: interrupt(1)<br>
<br>
[1] Done molpro -n 4 <a href="http://h2-hf.com" target="_blank">h2-hf.com</a><br></div>
<<a href="http://h2-hf.com" target="_blank">http://h2-hf.com</a>><div class="im"><br>
<br>
when I try to run a simple input which works fine on CentOS5.6. The<br>
program actually does not start because the same error I got when I<br>
used just command<br>
molpro &<br>
May be somebody already found the solution for this problem.<br>
Thank you David<br>
<br>
<br>
<br></div>
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</blockquote>
</blockquote></div></div>