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Dear WIEN2kian,<br><br>
We are trying to install WIEN2k in our IBM merlin (p575AIX)
machine. So far we haven't succeeded in installation yet. Attached is
errors that we met. Could someone help us to solve this problem? We
deeply thank for your help.<br><br>
Regards,<br>
Khuong<br><br>
<br>
<blockquote type=cite class=cite cite="">Date: Wed, 28 Feb 2007 14:46:03
+0800<br>
From: Dave Lin Yi <liny@acrc.a-star.edu.sg><br>
Subject: Wien2k Version 7 Compilation Problem On IBM merlin (p575
AIX)<br>
To: ongpk@ihpc.a-star.edu.sg<br>
Cc: liny@acrc.a-star.edu.sg<br>
X-Accept-Language: en-us, en<br>
User-Agent: Mozilla Thunderbird 1.0 (Windows/20041206)<br><br>
Hi Dr. Ong,<br><br>
After successfully installed MPIBLACS, SCALAPCK, and a lot of trials to
compile Wien2K version 7, we finally eliminate most of the compilation
errors. However, there is one error that I could not figure out a
solution. Could you kindly liase with Wien2K developers to see whether
they have any solutions?<br><br>
The following are the details:<br><br>
1. The OPTIONS file content<br><br>
current:FOPT:-q64 -O3 -qstrict -qarch=pwr5x -qtune=pwr5 -qcache=auto<br>
current:FPOPT:-q64 -O3 -qstrict -qarch=pwr5x -qtune=pwr5
-qcache=auto<br>
current:LDFLAGS:-q64 -O3 -qstrict -qipa=missing=isolated
-L../SRC_lib<br>
current:DPARALLEL:'-WF,-DParallel'<br>
current:R_LIBS:-lessl -llapack_lapw<br>
current:RP_LIBS:-L /usr/local/lib -lscalapack -L /usr/local/lib/blacs
-lblacs_MPI-P575-0 -lblacsF77init_MPI-P575-0<br>
current:MPIRUN:poe _EXEC_ -shared_memory yes -procs _NP_ -hfile
_HOSTS_<br><br>
<br>
2. Compilers<br><br>
Compiler used for serial executable is IBM xlf90 and for parallel
executable is mpxlf90_r.<br><br>
<br>
3. The error summary at the end of the compilation of all programs is as
follows:<br><br>
Compile time errors (if any) were:<br>
SRC_aim/compile.msg:** xerror === End of Compilation 17
===<br>
SRC_aim/compile.msg:** xerror === End of Compilation 17
===<br>
SRC_eosfit6/compile.msg:make: The error code from the last command is
2.<br>
SRC_eosfit6/compile.msg:make: Ignored error code 2 from last
command.<br>
SRC_eosfit6/compile.msg:1586-346 (U) An error occurred during code
generation. The code generation return code was<br>
40.<br>
SRC_eosfit6/compile.msg:make: The error code from the last command is
1.<br><br>
<br>
4. Compilation error message at directory SRC_eosfit6 is as follows:<br>
<br>
rm eosfit6 *.o<br>
rm: eosfit6: No such file or directory<br>
make: The error code from the last command is 2.<br>
make: Ignored error code 2 from last command.<br>
clean<br>
xlf90 -q64 -O3 -qstrict -qarch=pwr5x
-qtune=pwr5 -qcache=auto -c eosfit6.f <br>
** eosfit === End of Compilation 1 ===<br>
** eos === End of Compilation 2 ===<br>
** eosparabol === End of Compilation 3 ===<br>
** eosother === End of Compilation 4 ===<br>
1501-510 Compilation successful for file eosfit6.f.<br>
xlf90 -q64 -O3 -qstrict -qarch=pwr5x
-qtune=pwr5 -qcache=auto -c gtfnam.f <br>
** gtfnam === End of Compilation 1 ===<br>
1501-510 Compilation successful for file gtfnam.f.<br>
xlf90 -q64 -O3 -qstrict -qarch=pwr5x
-qtune=pwr5 -qcache=auto -c all.f ** dn2fb === End of
Compilation 1 ===<br>
** d1mach === End of Compilation 2 ===<br>
** i1mcry === End of Compilation 3 ===<br>
** da7sst === End of Compilation 4 ===<br>
** dd7mlp === End of Compilation 5 ===<br>
** dd7tpr === End of Compilation 6 ===<br>
** dd7upd === End of Compilation 7 ===<br>
** df7dhb === End of Compilation 8 ===<br>
** dg7itb === End of Compilation 9 ===<br>
** dg7qsb === End of Compilation 10 ===<br>
** dg7qts === End of Compilation 11 ===<br>
** dh2rfa === End of Compilation 12 ===<br>
** dh2rfg === End of Compilation 13 ===<br>
** ditsum === End of Compilation 14 ===<br>
** divset === End of Compilation 15 ===<br>
** dl7itv === End of Compilation 16 ===<br>
** dl7ivm === End of Compilation 17 ===<br>
** dl7msb === End of Compilation 18 ===<br>
** dl7mst === End of Compilation 19 ===<br>
** dl7sqr === End of Compilation 20 ===<br>
** dl7srt === End of Compilation 21 ===<br>
** dl7svn === End of Compilation 22 ===<br>
** dl7tvm === End of Compilation 23 ===<br>
** dl7vml === End of Compilation 24 ===<br>
** dparck === End of Compilation 25 ===<br>
** dq7apl === End of Compilation 26 ===<br>
** dq7rad === End of Compilation 27 ===<br>
** dq7rsh === End of Compilation 28 ===<br>
** dr7mdc === End of Compilation 29 ===<br>
** dr7tvm === End of Compilation 30 ===<br>
** drldst === End of Compilation 31 ===<br>
** drn2gb === End of Compilation 32 ===<br>
** ds7bqn === End of Compilation 33 ===<br>
** ds7dmp === End of Compilation 34 ===<br>
** ds7ipr === End of Compilation 35 ===<br>
** ds7lup === End of Compilation 36 ===<br>
** ds7lvm === End of Compilation 37 ===<br>
** dv2axy === End of Compilation 38 ===<br>
** dv2nrm === End of Compilation 39 ===<br>
** dv7cpy === End of Compilation 40 ===<br>
** dv7dfl === End of Compilation 41 ===<br>
** dv7ipr === End of Compilation 42 ===<br>
** dv7scl === End of Compilation 43 ===<br>
** dv7scp === End of Compilation 44 ===<br>
** dv7shf === End of Compilation 45 ===<br>
** dv7vmp === End of Compilation 46 ===<br>
** i1mach === End of Compilation 47 ===<br>
** i1mcr1 === End of Compilation 48 ===<br>
** i7copy === End of Compilation 49 ===<br>
** i7mdcn === End of Compilation 50 ===<br>
** i7pnvr === End of Compilation 51 ===<br>
** i7shft === End of Compilation 52 ===<br>
** stopx === End of Compilation 53 ===<br>
1586-346 (U) An error occurred during code generation. The code
generation return code was 40.<br>
1501-511 Compilation failed for file all.f.<br>
make: The error code from the last command is 1.<br><br>
<br>
Stop.<br><br>
<br>
Thank you and best regards<br>
dave lin<br><br>
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</blockquote>
<x-sigsep><p></x-sigsep>
<font color="#000080">
*******************************************************<br>
</font><font face="Times New Roman, Times" size=4 color="#000080">
Dr. Ong Phuong Khuong<br>
Computational Materials Science and Engineering<br>
Institute of High Performance Computing<br>
1 Science Park Road, #01-01 The Capricorn<br>
Singapore Science Park II, Singapore 117528<br>
Tel: (off) +65.6-4191 566<br>
(home) +65.6-8971
801<br>
(mobile) +65. 9 1149 927<br>
Fax: +65.64191290<br><br>
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and notify us immediately. <br>
Please do not copy or use it for any purpose, or<br>
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