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<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><FONT size=3><FONT
face="Times New Roman">Dear Wien users<?xml:namespace prefix = o ns =
"urn:schemas-microsoft-com:office:office" /><o:p></o:p></FONT></FONT></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT face="Times New Roman">I
have some problems in using parallelization over kpoints in the latest release
of WIEN2k. It is important to mention that I had no troubles in the past with my
settings.<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT face="Times New Roman">In
particular I am working with dual-core pc desktops, and one Quad-core machines,
individually. For instance, in a simple parallel setup, the typical test_case, I
found this:<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT
face="Times New Roman">---------<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT
face="Times New Roman">root@rfaccio:/home/rfaccio/calculo/wien2k/test_case# x
lapw1 -c -up -p<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT
face="Times New Roman">starting parallel lapw1 at Thu Oct<SPAN
style="mso-spacerun: yes"> </SPAN>1 23:32:56 UYT
2009<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT
face="Times New Roman">-><SPAN style="mso-spacerun: yes">
</SPAN>starting parallel LAPW1 jobs at Thu Oct<SPAN
style="mso-spacerun: yes"> </SPAN>1 23:32:56 UYT
2009<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT
face="Times New Roman">running LAPW1 in parallel mode (using
.machines)<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT face="Times New Roman">2
number_of_parallel_jobs<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT face="Times New Roman">[1]
30629<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT
face="Times New Roman">root@localhost's
password:<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT
face="Times New Roman">---------<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT face="Times New Roman">As
you can see the code keeps waiting for my password. It never happened before,
and it seems to have no relationship with the shared memory setup because I used
the same flags than in previous release
versions.<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT face="Times New Roman">I use
this .machine file:<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT
face="Times New Roman">1:localhost<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT
face="Times New Roman">1:localhost<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT
face="Times New Roman">granularity:1<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT
face="Times New Roman">extrafine:1<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT face="Times New Roman">I
would like to know if there exist an easy way to fix it, because I would like to
avoid any important modification in my security pc's
stuff.<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT face="Times New Roman">Is it
a new modification? or a strictly problem of the user
(me!)<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT
face="Times New Roman">Thanks in advance<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT
face="Times New Roman">Ricardo<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT face="Times New Roman">p.s.:
this is my OPTION file<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT
face="Times New Roman">current:FOPT:-FR -O3 -mp1 -w -prec_div -pc80 -pad -align
-DINTEL_VML<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT
face="Times New Roman">current:FPOPT:$(FOPT)<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT
face="Times New Roman">current:LDFLAGS:$(FOPT)
-L/opt/intel/Compiler/11.0/081/mkl/lib/em64t -pthread
-i-static<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT
face="Times New Roman">current:DPARALLEL:'-DParallel'<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT
face="Times New Roman">current:R_LIBS:-lmkl_lapack -lmkl -lguide -lmkl_scalapack
-lmkl_blacs_lp64<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT
face="Times New Roman">current:RP_LIBS:-lmkl_intel_lp64 -lmkl_scalapack_lp64
-lmkl_blacs_lp64 -lmkl_sequential -L /opt/local/fftw/lib/ -lfftw_mpi
-lfftw<o:p></o:p></FONT></FONT></SPAN></P>
<P class=MsoNormal style="MARGIN: 0cm 0cm 0pt"><SPAN lang=EN-GB
style="mso-ansi-language: EN-GB"><FONT size=3><FONT
face="Times New Roman">current:MPIRUN:<o:p></o:p></FONT></FONT></SPAN></P></FONT><FONT
face=Arial
size=2>-------------------------------------------------------------------------<BR>
Dr. Ricardo Faccio<BR> Prof. Adjunto de Física <BR> Mail:
Cryssmat-Lab., Cátedra de Física, DETEMA<BR> Facultad de Química,
Universidad de la República<BR> Av. Gral.
Flores 2124, C.C. 1157<BR> C.P. 11800,
Montevideo, Uruguay.<BR> E-mail: <A
href="mailto:rfaccio@fq.edu.uy">rfaccio@fq.edu.uy</A><BR> Phone: 598 2 924
98
59<BR>
598 2 929 06 48<BR> Fax: 598 2 9241906<BR>
Web: <A
href="http://cryssmat.fq.edu.uy/ricardo/ricardo.htm">http://cryssmat.fq.edu.uy/ricardo/ricardo.htm</A><BR>---------------------------------------------------------------------------------</FONT></DIV></BODY></HTML>