Re: [Wien] Error during compilation

2022-12-01 Thread Gavin Abo
That's not enough information. You would need to look for additional information inside the SRC_hf/compile.msg file for troubleshooting the error. It might also help to upgrade to WIEN2k 21.1. On the updates page [1], it has written the following were it looks like WIEN2k 21.1 fixed

[Wien] Error during compilation

2022-12-01 Thread shamik chakrabarti
Dear Wien2k users, I have tried to install wien2k 19.1 in a workstation in which Ubantu is installed. Compilation progresses with an error at SRC_hf as follows; make[1]: *** [Makefile:273: read_uc.o] Error 1 make[1]: Leaving directory '/usr/local/Wien2k/SRC_hf' make: ***

Re: [Wien] Error in compilation of lapw0

2021-01-07 Thread Laurence Marks
My guess is that you have not appropriately setup $MKLROOT. Try the command "ls -l $MKLROOT" and check whether it is right and you have permissions. The default path has an "/opt" in front which you are missing. (But you might have installed to /intel rather than /opt/intel.) Did you source the

[Wien] Error in compilation of lapw0

2021-01-07 Thread Vidit Zala
Dear Sir, I am trying to compile Wien2k version 19.1 on a system with intel Core i7 processor (Haswell), having ubuntu-18.04.5 installed in it. I am using intel parallel_studio_xe_2019_update4_cluster_edition for libraries, with mpiifort and icc as compilers. I have kept Compiler option : -O3

Re: [Wien] Error after compilation

2018-01-22 Thread Gavin Abo
The ilp64 in your R_LIBS cannot be used for WIEN2k, you must use lp64 [ https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg08707.html ]. For composer 2017, you might also need "-assume nobuffered_io" in the O line [

[Wien] Error after compilation

2018-01-22 Thread mostefa djermouni
Dear Peter BLAHA and Wien2k users, I have Linux Debian 9 architecture with ifort: composer 2017 and i7 7700 possessor. I did my compilation  without error message, After calculation of GaAs example I get this error:  LAPW0 END forrtl: severe (174): SIGSEGV, segmentation fault occurred forrtl:

[Wien] error in compilation

2013-03-18 Thread Mathrubutham Rajagopalan
Dear Dr Gavin, Thanks for your response As per your suggestion I modified but still I am getting the same error can not open include file mkl_vml_fi Will you kindly suggest Regards and greetings Rajagopalan On Fri, Mar 15, 2013 at 6:25 AM, Gavin Abo gsabo at crimson.ua.edu wrote: Try

[Wien] error in compilation

2013-03-18 Thread Gavin Abo
Does the file exist and have read access? username at computername:~/Desktop$ cd /opt/intel/composer_xe_2013.2.146/mkl/include/ username at computername:/opt/intel/composer_xe_2013.2.146/mkl/include$ ls -l mkl_vml.fi -- 1 root root 1373 Jan 25 06:10 mkl_vml.fi = File exists, but can

[Wien] error in compilation

2013-03-15 Thread Mathrubutham Rajagopalan
Dear Developers and Users, Recently we purchased a DELL power edge T620 server . We have installed Ubuntu 12.04LS OS and for the ifort and mkl we used Composer_xe_2013.2.146 options used: Compiler options: -FR -mp1 -w -prec_div -pc80 -pad -ip -DINTEL_VML -

[Wien] error in compilation

2013-03-15 Thread Gavin Abo
Try the following shown below. On 3/15/2013 1:01 AM, Mathrubutham Rajagopalan wrote: Dear Developers and Users, Recently we purchased a DELL power edge T620 server . We have installed Ubuntu 12.04LS OS and for the ifort and mkl we used Composer_xe_2013.2.146 options used: Compiler

[Wien] error in compilation

2012-12-27 Thread Chemam faïçal
Dear Wien user in wien12 compilation with ifort 11.1 073 and impi 4 in fedora 16 system; i've found lot of error of libmkl not found. ld: cannot find -libmkl_blas95.a ld: cannot find -libmkl_lapack95.a ld: cannot find -libmkl_cdft_core.a ld: cannot find -libmkl_intel.a ld: cannot find

[Wien] error in compilation

2012-12-27 Thread Gavin Abo
In siteconfig, it looks like you might have used an unrecognized format -libmkl_blas95.a. Try replacing lib with l for -lmkl_blas95 or without the dash in front libmkl_blas95.a. On 12/27/2012 11:50 AM, Chemam fa??al wrote: Dear Wien user in wien12 compilation with ifort 11.1 073 and impi 4

[Wien] error during compilation (siteconfig_lapw)

2011-06-01 Thread Gerhard Fecher
at zeus.theochem.tuwien.ac.at [wien-bounces at zeus.theochem.tuwien.ac.at]quot; im Auftrag von quot;shamik chakrabarti [shamikphy at gmail.com] Gesendet: Dienstag, 31. Mai 2011 18:26 Bis: A Mailing list for WIEN2k users Betreff: Re: [Wien] error during compilation (siteconfig_lapw) Dear Dr. Gerhard

[Wien] error during compilation (siteconfig_lapw)

2011-05-31 Thread shamik chakrabarti
Dear Dr. Peter Blaha Sir and Wien2k users, We are trying to install wien2k in a COMPAQ Laptop having core2duo processor. During siteconfig_lapw we have received the following error : Compile time errors (if any) were: SRC_aim/compile.msg:make[1]: *** [aim] Error 1

[Wien] error during compilation (siteconfig_lapw)

2011-05-31 Thread Ramkumar Thapa
Dear Shamik, Your options : current:LDFLAGS:-L/home/avijitghosh/intel/fc/10.1.018/lib -static-intel -Bstatic -lguide -lguide_stats -lsvml -Bdynamic -lpthread current:DPARALLEL:'-DParallel' current:R_LIBS:-L/home/avijitghosh/intel/composerxe-2011.4.191/mkl/lib/ia32 -Bstatic -lmkl_lapack -lmkl_ia32

[Wien] error during compilation (siteconfig_lapw)

2011-05-31 Thread Gerhard Fecher
at gmail.com] Gesendet: Dienstag, 31. Mai 2011 08:57 Bis: A Mailing list for WIEN2k users Betreff: [Wien] error during compilation (siteconfig_lapw) Dear Dr. Peter Blaha Sir and Wien2k users, We are trying to install wien2k in a COMPAQ Laptop having core2duo processor. During

[Wien] error during compilation (siteconfig_lapw)

2011-05-31 Thread Gerhard Fecher
users Betreff: Re: [Wien] error during compilation (siteconfig_lapw) Dear Shamik, Your options : current:LDFLAGS:-L/home/avijitghosh/intel/fc/10.1.018/lib -static-intel -Bstatic -lguide -lguide_stats -lsvml -Bdynamic -lpthread current:DPARALLEL:'-DParallel' current:R_LIBS:-L/home/avijitghosh/intel

[Wien] error during compilation (siteconfig_lapw)

2011-05-31 Thread Ramkumar Thapa
: wien-bounces at zeus.theochem.tuwien.ac.at [ wien-bounces at zeus.theochem.tuwien.ac.at]quot; im Auftrag von quot;Ramkumar Thapa [r.k.thapa at gmail.com] Gesendet: Dienstag, 31. Mai 2011 09:24 Bis: A Mailing list for WIEN2k users Betreff: Re: [Wien] error during compilation (siteconfig_lapw

[Wien] error during compilation (siteconfig_lapw)

2011-05-31 Thread shamik chakrabarti
;Ramkumar Thapa [r.k.thapa at gmail.com] Gesendet: Dienstag, 31. Mai 2011 09:24 Bis: A Mailing list for WIEN2k users Betreff: Re: [Wien] error during compilation (siteconfig_lapw) Dear Shamik, Your options : current:LDFLAGS:-L/home/avijitghosh/intel/fc/10.1.018/lib -static-intel -Bstatic

[Wien] Error during compilation

2008-10-10 Thread Stefaan Cottenier
Do what it asks you to do: Check file compile.msg in the corresponding SRC_* directory for the compilation log and more info on any compilation problem. Look for instance in SRC_lapw1/compile.msg and read the detailed error messages there. Stefaan Disclaimer:

[Wien] Error during compilation

2008-10-07 Thread Subhra Kulshrestha
pblaha at theochem.tuwien.ac.at wrote: From: Peter Blaha pbl...@theochem.tuwien.ac.at Subject: Re: [Wien] Error during compilation To: A Mailing list for WIEN2k users wien at zeus.theochem.tuwien.ac.at Date: Monday, 6 October, 2008, 9:40 PM Apparently you are trying to compile the mpi-parallel version

[Wien] Error during compilation

2008-10-07 Thread Peter Blaha
Matter Theory Group School of Studies in Physics, Jiwaji University Gwalior 474011? (M.P.) INDIA --- On Mon, 6/10/08, Peter Blaha pblaha at theochem.tuwien.ac.at wrote: From: Peter Blaha pblaha at theochem.tuwien.ac.at Subject: Re: [Wien] Error during compilation To: A Mailing list

[Wien] Error during compilation

2008-10-06 Thread Subhra Kulshrestha
Sir, We are using Wien2k 2008 version with fortran compiler 10.1.018 and math kernel library 10.1.0.009 We are having a problem during compilation of Wien2k at the ./sitecofig_lapw as below: Compile time errors (if any) were: SRC_lapw0/compile.msg:make[1]: *** [lapw0_mpi] Error 1