<div dir="ltr">Dear forum members<div><br></div><div style>Sorry to post the same message again. But even gfortran version 4.7.2 is also giving same error with iotk. Can anybody suggest me the appropriate combination of compilers (with version numbers) for PWSCF v5.0?</div>
</div><div class="gmail_extra"><br><br><div class="gmail_quote">On Wed, Mar 13, 2013 at 6:41 PM, Ali KACHMAR <span dir="ltr"><<a href="mailto:kachmar_ali@hotmail.fr" target="_blank">kachmar_ali@hotmail.fr</a>></span> wrote:<br>
<blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex">
<div><div dir="ltr"><br>> From: <a href="mailto:giannozz@democritos.it" target="_blank">giannozz@democritos.it</a><br>> To: <a href="mailto:pw_forum@pwscf.org" target="_blank">pw_forum@pwscf.org</a><br>> Date: Fri, 30 Nov 2012 12:48:55 +0100<br>
> Subject: Re: [Pw_forum] ERROR IN: iotk_scan_end (iotk_scan.f90:241)<div class="im"><br>> <br>> On Fri, 2012-11-30 at 16:27 +0530, Bramha Pandey wrote:<br>> <br>> > # FROM IOTK LIBRARY, VERSION 1.2.0<br>
> > # UNRECOVERABLE ERROR (ierr=1)<br>> > # ERROR IN: iotk_scan_end (iotk_scan.f90:241)<br>> <br></div>> as mentioned no less than 1001 times: this is almost invariably a<br>> gfortran bug. The only solution is to upgrade the compiler. <br>
> <br>> P.<br>> -- <br>> Paolo Giannozzi, IOM-Democritos and University of Udine, Italy<br>> <br><br><div><div></div><hr>Date: Wed, 13 Mar 2013 17:35:12 +0530<br>From: <a href="mailto:krishnachaitanya.gunturu@gmail.com" target="_blank">krishnachaitanya.gunturu@gmail.com</a><br>
To: <a href="mailto:pw_forum@pwscf.org" target="_blank">pw_forum@pwscf.org</a><br>Subject: [Pw_forum] problem with bands.x and iotk<div><div class="h5"><br><br><div dir="ltr">Dear Users<div><br></div><div>When I am trying to get band structure of example file for si (<a href="http://www.vlab.msi.umn.edu/events/download/tutorial_pwscf_ex.pdf" target="_blank">http://www.vlab.msi.umn.edu/events/download/tutorial_pwscf_ex.pdf</a>), in nscf step I am getiing this problem.</div>
<div><br></div><div><div>[scs1@srtmun examples_pwscf_ex]$ pw.x <<a href="http://si.nscf.in" target="_blank">si.nscf.in</a> >si.nscf.out &</div><div>[1] 8096</div><div>[scs1@srtmun examples_pwscf_ex]$ ########################################################################################################################</div>
<div># FROM IOTK LIBRARY, VERSION 1.2.0</div><div># UNRECOVERABLE ERROR (ierr=1)</div><div># ERROR IN: iotk_scan_end (iotk_scan.f90:241)</div><div># CVS Revision: 1.23 </div><div># foundl</div><div># ERROR IN: iotk_close_read (iotk_files.f90:746)</div>
<div># CVS Revision: 1.20 </div><div>########################################################################################################################</div><div>application called MPI_Abort(MPI_COMM_WORLD, 1) - process 0</div>
<div><br></div><div>[1]+ Exit 1 pw.x < <a href="http://si.nscf.in" target="_blank">si.nscf.in</a> > si.nscf.out</div><div>[scs1@srtmun examples_pwscf_ex]$ </div><div><br></div><div><br></div><div>
>From forum searching, I found that it is due to mismatch of compiler version and latest version of compilers will solve this issue. I have compiled espresso-5.0-GPU on CentOS release 5.5 by using intel-composer_xe_2013.1.117 vesion with gfortan-4.1.2 as secondary compiler. But still I am getting this problem.</div>
<div><br></div><div>Can anybody suggest something to overcome this problem?</div><div><br></div><div><br></div>-- <br>With Best Regards<br><br>Dr. G. Krishna Chaitanya<br>Assistant Professor<br>School of Chemical Sciences<br>
SRTM University<br>Nanded-431 606<br>India.<br>
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<a href="http://pwscf.org/mailman/listinfo/pw_forum" target="_blank">http://pwscf.org/mailman/listinfo/pw_forum</a><br></blockquote></div><br><br clear="all"><div><br></div>-- <br>With Best Regards<br><br>Dr. G. Krishna Chaitanya<br>
Assistant Professor<br>School of Chemical Sciences<br>SRTM University<br>Nanded-431 606<br>India.<br>
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