[Wien] INTEL XEON EM64T IFORT 9.0 MKL 9.0

[Michael Gurnett]

Also, and I'm just pointing this out since I missed this to begin with,
make sure you use the ifort in the fce folder and not the one in the fc
folder.

Michael

-----Original Message-----
From: EB Lombardi <lombaeb at science.unisa.ac.za>
To: A Mailing list for WIEN2k users <wien at zeus.theochem.tuwien.ac.at>
Date: Thu, 17 Nov 2005 11:09:35 +0200
Subject: Re: [Wien] INTEL XEON EM64T IFORT 9.0 MKL 9.0

> Hello
> 
> You should be able to compile using the OPTIONS given in the e-mail 
> yesterday:
> 
> current:FOPT:-FR -mp1 -w -prec_div -pc80 -pad -ip -DINTEL_VML -xP
> current:FPOPT:-FR -mp1 -w -prec_div -pc80 -pad -ip -DINTEL_VML
> current:LDFLAGS:-L/opt/intel/fce/9.0/lib -L/opt/intel/mkl/8.0/lib/em64t
> -lsvml
> current:DPARALLEL:'-DParallel'
> current:R_LIBS:-lmkl_lapack -lmkl_em64t -lguide -lguide_stats -lpthread
> current:RP_LIBS:-L /usr/local/SCALAPACK -L /usr/local/BLACS/LIB -lpblas
> -lredist -ltools -lscalapack -lfblacs -lblacs -lmpi
> 
> A few points in general, which may not apply to you:
> 1. The paths to the compiler and mkl libraries given above will depend 
> on the specific installation.
> 2. These paths must also be included in .bashrc (or .cshrc) :
> setenv LD_LIBRARY_PATH 
> /opt/intel/fce/9.0/lib:/opt/intel/mkl/8.0/lib/em64t (for .cshrc). For 
> bash, use   export LD_LIBRARY_PATH=.....
> 3. On RHEL 3 it is necessary to use export LD_ASSUME_KERNEL=2.4.1.
> 4. The limit on the stack size needs to be increased for ifort on RHL9 
> and higher:   limit stacksize unlimited (in .cshrc)   or    ulimit -s 
> unlimited (in .bashrc)
> 5. I have found that disabling HT in the BIOS improves the calculation 
> speed if using mkl 8.0.
> 
> Regards
> 
> Enrico Lombardi
> 
> --
> Dr E B Lombardi
> Physics Department
> University of South Africa
> P.O. Box 392
> 0003 UNISA
> South Africa
> Tel: +27 (0)12 429-8027
> Fax: +27 (0)12 429-3643
> e-mail: lombaeb at science.unisa.ac.za
> 
> 
> César de la Fuente wrote:
> 
> > Hi,
> >
> > - I am trying to install wien2k_05.6 on an Intel Xeon Dual EM64t with
> > Red Hat Enterprise 4, ifort 9.0 and Intel mkl 9.0.
> >
> > - The purpose of my calculations is to get xray emision espectra in
> Ce 
> > compounds.
> >
> > - All the WIEN2k programs can be compiled but not linked anyway. LD 
> > shows the following error message '--short-section' is not
> recognized. 
> > I am loosing the hope to work under this hard+soft configuration
> after 
> > 2 weeks.
> >
> > At the begining, I have used the configuration option "J" in the 
> > "siteconfig_lapw" script. Clearly, It does not work because it is 
> > configured for ifort 8.1 and mkl 7.0.
> >
> > Any hope for this kind of system and software?
> >
> > Dr. César de la Fuente del Rey
> > add1: Facultad de Ciencias - Dep. Física de la Materia Condensada
> > Ciudad Universitaria, 50009 Zaragoza, SPAIN
> > add2: Centro Politécnico Superior - Dep. Física de la Materia
> Condensada
> > C/María de Luna, 3, 50018 Zaragoza, SPAIN
> > Tfno. 34 976762395
> > Fax: 34 976762395
> >  
> >  
> >
> >
> >----------------------------------------------------------------------
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> >
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>