Dear Dr. Maxim Rakitin, Thanks for your reply. But it seems that the download page was already removed.
Best regards, Gaku Eguchi (11/11/29 4:08), Maxim Rakitin wrote: > Please see my comment there about how to find it: > http://zeus.theochem.tuwien.ac.at/pipermail/wien/2011-November/015688.html. > > Maxim > > 28.11.2011 22:02, EGUCHI Gaku ?????: >> Dr. Laurence Marks, >> >> Thanks a lot for your quick reply. I checked the mail readily but it >> seems a >> different problem, because I could run w2web and went through to >> `Struct- >> Gen' and `initialize calc.' without any problem. I also ran >> `./siteconfig' but >> couldn't find `-O3' option. >> >> Yeah it's the problem of memory, but it looks difficult for me to >> deal imme- >> diately. >> I'd like to re-install the Composer XE 2011 Update 3, but I don't >> know how >> to find it in the current situation. If someone knows how to obtain >> it, could >> you tell me? >> >> Best, >> Gaku Eguchi >> >> (11/11/29 0:00), Laurence Marks wrote: >>> You will see from the mailing list (e.g. >>> http://zeus.theochem.tuwien.ac.at/pipermail/wien/2011-November/015651.html >>> >>> ) that there is an issue with some of the recent versions of ifort, >>> and by the looks of it the version you are using won't work. >>> >>> One comment. if you do a google search on "free(): invalid next size" >>> you will see that this is a memory problem. >>> >>> 2011/11/28 EGUCHI Gaku<geguchi at scphys.kyoto-u.ac.jp>: >>>> Hello All, >>>> >>>> Recently I reinstalled WIEN2k_v11 with the latest ifort and icc >>>> (composer_xe_2011_sp1.7.256), or the ifort and gcc to Ubuntu 11.04, >>>> and consequently I've fallen into suffering from the following error >>>> at the SRC run. Is this also the problem for the compiler, which is >>>> difficult to deal with for the beginner? >>>> >>>> The installation has done without any problem. I executed everything >>>> in bash and the setting by userconfig_lapw is done to .bashrc. >>>> >>>> I'm happy if I could keep using ifort because of the simplicity of the >>>> installation. >>>> >>>> Best, >>>> Gaku Eguchi >>>> >>>> ----------- >>>> LAPW0 END >>>> *** glibc detected *** /home/parallels/Downloads/wien2k_v11/lapw1c: >>>> free(): >>>> invalid next size (normal): 0x00000000024e8f40 *** >>>> ======= Backtrace: ========= >>>> /lib/x86_64-linux-gnu/libc.so.6(+0x78a8f)[0x2b5847c4aa8f] >>>> /lib/x86_64-linux-gnu/libc.so.6(cfree+0x73)[0x2b5847c4e8e3] >>>> /home/parallels/Downloads/wien2k_v11/lapw1c[0x4a8d0c] >>>> /home/parallels/Downloads/wien2k_v11/lapw1c[0x465a9a] >>>> /home/parallels/Downloads/wien2k_v11/lapw1c[0x40e828] >>>> /home/parallels/Downloads/wien2k_v11/lapw1c[0x442bf3] >>>> /home/parallels/Downloads/wien2k_v11/lapw1c[0x404ccc] >>>> /lib/x86_64-linux-gnu/libc.so.6(__libc_start_main+0xff)[0x2b5847bf0eff] >>>> >>>> /home/parallels/Downloads/wien2k_v11/lapw1c[0x404bc9] >>>> ======= Memory map: ======== >>>> 00400000-005a6000 r-xp 00000000 08:01 1580323 >>>> /home/parallels/Downloads/wien2k_v11/lapw1c >>>> 007a5000-007b4000 rw-p 001a5000 08:01 1580323 >>>> /home/parallels/Downloads/wien2k_v11/lapw1c >>>> 007b4000-00a3d000 rw-p 00000000 00:00 0 >>>> 0221c000-033ae000 rw-p 00000000 00:00 0 >>>> [heap] >>>> 2b58447dd000-2b58447fe000 r-xp 00000000 08:01 3673832 >>>> /lib/x86_64-linux-gnu/ld-2.13.so >>>> 2b58447fe000-2b5844800000 rw-p 00000000 00:00 0 >>>> 2b58449fd000-2b58449fe000 r--p 00020000 08:01 3673832 >>>> /lib/x86_64-linux-gnu/ld-2.13.so >>>> 2b58449fe000-2b5844a00000 rw-p 00021000 08:01 3673832 >>>> /lib/x86_64-linux-gnu/ld-2.13.so >>>> 2b5844a00000-2b5844f8e000 r-xp 00000000 08:01 797568 >>>> /opt/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_intel_lp64.so >>>> >>>> 2b5844f8e000-2b584518e000 ---p 0058e000 08:01 797568 >>>> /opt/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_intel_lp64.so >>>> >>>> 2b584518e000-2b584519c000 rw-p 0058e000 08:01 797568 >>>> /opt/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_intel_lp64.so >>>> >>>> 2b584519c000-2b58451a2000 rw-p 00000000 00:00 0 >>>> 2b58451a2000-2b5845e9a000 r-xp 00000000 08:01 797580 >>>> /opt/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_intel_thread.so >>>> >>>> >>>> 2b5845e9a000-2b5846099000 ---p 00cf8000 08:01 797580 >>>> /opt/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_intel_thread.so >>>> >>>> >>>> 2b5846099000-2b58461f1000 rw-p 00cf7000 08:01 797580 >>>> /opt/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_intel_thread.so >>>> >>>> >>>> 2b58461f1000-2b58461f4000 rw-p 00000000 00:00 0 >>>> 2b58461f4000-2b584700b000 r-xp 00000000 08:01 795641 >>>> /opt/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_core.so >>>> 2b584700b000-2b584720a000 ---p 00e17000 08:01 795641 >>>> /opt/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_core.so >>>> 2b584720a000-2b584721e000 rw-p 00e16000 08:01 795641 >>>> /opt/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_core.so >>>> 2b584721e000-2b584722e000 rw-p 00000000 00:00 0 >>>> 2b584723d000-2b5847255000 r-xp 00000000 08:01 3673910 >>>> /lib/x86_64-linux-gnu/libpthread-2.13.so >>>> 2b5847255000-2b5847455000 ---p 00018000 08:01 3673910 >>>> /lib/x86_64-linux-gnu/libpthread-2.13.so >>>> 2b5847455000-2b5847456000 r--p 00018000 08:01 3673910 >>>> /lib/x86_64-linux-gnu/libpthread-2.13.so >>>> 2b5847456000-2b5847457000 rw-p 00019000 08:01 3673910 >>>> /lib/x86_64-linux-gnu/libpthread-2.13.so >>>> 2b5847457000-2b584745c000 rw-p 00000000 00:00 0 >>>> 2b584745c000-2b58474e0000 r-xp 00000000 08:01 3673882 >>>> /lib/x86_64-linux-gnu/libm-2.13.so >>>> 2b58474e0000-2b58476df000 ---p 00084000 08:01 3673882 >>>> /lib/x86_64-linux-gnu/libm-2.13.so >>>> 2b58476df000-2b58476e0000 r--p 00083000 08:01 3673882 >>>> /lib/x86_64-linux-gnu/libm-2.13.so >>>> 2b58476e0000-2b58476e1000 rw-p 00084000 08:01 3673882 >>>> /lib/x86_64-linux-gnu/libm-2.13.so >>>> 2b58476e1000-2b58477ad000 r-xp 00000000 08:01 786493 >>>> /opt/intel/composer_xe_2011_sp1.7.256/compiler/lib/intel64/libiomp5.so >>>> 2b58477ad000-2b58479ac000 ---p 000cc000 08:01 786493 >>>> /opt/intel/composer_xe_2011_sp1.7.256/compiler/lib/intel64/libiomp5.so >>>> 2b58479ac000-2b58479b6000 rw-p 000cb000 08:01 786493 >>>> /opt/intel/composer_xe_2011_sp1.7.256/compiler/lib/intel64/libiomp5.so >>>> 2b58479b6000-2b58479cd000 rw-p 00000000 00:00 0 >>>> 2b58479cd000-2b58479cf000 r-xp 00000000 08:01 3673855 >>>> /lib/x86_64-linux-gnu/libdl-2.13.so >>>> 2b58479cf000-2b5847bcf000 ---p 00002000 08:01 3673855 >>>> /lib/x86_64-linux-gnu/libdl-2.13.so >>>> 2b5847bcf000-2b5847bd0000 r--p 00002000 08:01 3673855 >>>> /lib/x86_64-linux-gnu/libdl-2.13.so >>>> 2b5847bd0000-2b5847bd1000 rw-p 00003000 08:01 3673855 >>>> /lib/x86_64-linux-gnu/libdl-2.13.so >>>> 2b5847bd1000-2b5847bd2000 rw-p 00000000 00:00 0 >>>> 2b5847bd2000-2b5847d5c000 r-xp 00000000 08:01 3673845 >>>> /lib/x86_64-linux-gnu/libc-2.13.so >>>> 2b5847d5c000-2b5847f5b000 ---p 0018a000 08:01 3673845 >>>> /lib/x86_64-linux-gnu/libc-2.13.so >>>> 2b5847f5b000-2b5847f5f000 r--p 00189000 08:01 3673845 >>>> /lib/x86_64-linux-gnu/libc-2.13.so >>>> 2b5847f5f000-2b5847f60000 rw-p 0018d000 08:01 3673845 >>>> /lib/x86_64-linux-gnu/libc-2.13.so >>>> 2b5847f60000-2b5847f66000 rw-p 00000000 00:00 0 >>>> 2b5847f66000-2b5847f7b000 r-xp 00000000 08:01 3673873 >>>> /lib/x86_64-linux-gnu/libgcc_s.so.1 >>>> 2b5847f7b000-2b584817a000 ---p 00015000 08:01 3673873 >>>> /lib/x86_64-linux-gnu/libgcc_s.so.1 >>>> 2b584817a000-2b584817b000 r--p 00014000 08:01 3673873 >>>> /lib/x86_64-linux-gnu/libgcc_s.so.1 >>>> 2b584817b000-2b584817c000 rw-p 00015000 08:01 3673873 >>>> /lib/x86_64-linux-gnu/libgcc_s.so.1 >>>> 2b584817c000-2b584817f000 rw-p 00000000 00:00 0 >>>> 2b584817f000-2b5848788000 r-xp 00000000 08:01 797692 >>>> /opt/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_vml_avx.so >>>> >>>> 2b5848788000-2b5848988000 ---p 00609000 08:01 797692 >>>> /opt/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_vml_avx.so >>>> >>>> 2b5848988000-2b58489af000 rw-p 00609000 08:01 797692 >>>> /opt/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_vml_avx.so >>>> >>>> 2b58489af000-2b58489b0000 rw-p 00000000 00:00 0 >>>> 2b5848a7f000-2b5848be7000 rw-p 00000000 00:00 0 >>>> 2b58498ea000-2b584b206000 r-xp 00000000 08:01 795470 >>>> /opt/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_avx.so >>>> 2b584b206000-2b584b405000 ---p 0191c000 08:01 795470 >>>> /opt/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_avx.so >>>> 2b584b405000-2b584b41a000 rw-p 0191b000 08:01 795470 >>>> /opt/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_avx.so >>>> 2b584b41a000-2b584b63c000 rw-p 00000000 00:00 0 >>>> 2b584c000000-2b584c021000 rw-p 00000000 00:00 0 >>>> 2b584c021000-2b5850000000 ---p 00000000 00:00 0 >>>> 7fff9e4de000-7fff9e500000 rw-p 00000000 00:00 0 >>>> [stack] >>>> 7fff9e54d000-7fff9e54e000 r-xp 00000000 00:00 0 >>>> [vdso] >>>> ffffffffff600000-ffffffffff601000 r-xp 00000000 00:00 0 >>>> [vsyscall] >>>> >>>>> stop error >>>> -- >>>> ------------------------------------------------------------------------ >>>> >>>> Gaku Eguchi >>>> Department of Physics, Graduate School of Science, Kyoto University >>>> Oiwake-cho, Kitashirakawa, Sakyou-ku, Kyoto 606-8502, Japan >>>> Laboratory TEL : +81-75-753-3744 >>>> E-mail : geguchi at scphys.kyoto-u.ac.jp >>>> http://www.ss.scphys.kyoto-u.ac.jp/index.html.en >>>> ------------------------------------------------------------------------ >>>> >>>> >>>> _______________________________________________ >>>> Wien mailing list >>>> Wien at zeus.theochem.tuwien.ac.at >>>> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien >>>> >>>> >>> >>> >> >> > _______________________________________________ > Wien mailing list > Wien at zeus.theochem.tuwien.ac.at > http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien -- ------------------------------------------------------------------------ Gaku Eguchi Department of Physics, Graduate School of Science, Kyoto University Oiwake-cho, Kitashirakawa, Sakyou-ku, Kyoto 606-8502, Japan Laboratory TEL : +81-75-753-3744 E-mail : geguchi at scphys.kyoto-u.ac.jp http://www.ss.scphys.kyoto-u.ac.jp/index.html.en ------------------------------------------------------------------------