[Pw_forum] Installation problem

Ben Palmer benpalmer1983 at gmail.com
Tue May 21 20:07:31 CEST 2013


Hi Yantao,

Also you may qualify for the intel compiler:

http://software.intel.com/en-us/non-commercial-software-development

Ben
> Hi Axel,
>
> Thank you for your reply. But can you be more specific about how to 
> override the compilers? In the User's Guide, the most relevant thing I 
> could find was to modify some environment variables. But in 
> the environment_variables.txt, I only found something about path 
> setting, wget, parallelism, and image parallelization, none of which 
> seems to be relevant to overriding the compilers.
>
> Thanks you,
> Yantao
>
>
> On Tue, May 21, 2013 at 9:53 AM, Axel Kohlmeyer <akohlmey at gmail.com 
> <mailto:akohlmey at gmail.com>> wrote:
>
>     On Tue, May 21, 2013 at 6:45 PM, Yantao Wu <ywu at g.hmc.edu
>     <mailto:ywu at g.hmc.edu>> wrote:
>     > Dear all,
>     >
>     > My administrator just installed gfortran44 (version 4.4), which
>     is somewhat
>     > newer than 4.1.2. However, I don't he removed the 4.1.2
>     compiler. When I ran
>
>     it is outdated just as well. gcc-4.7 is current and will soon be
>     succeeded by gcc-4.8
>
>     > ./configure, it seemed that QE still recognized the 4.1.2 one
>     instead of the
>     > 4.4 one. So in the case of two or more fortran compilers, what
>     should one do
>     > to make QE realize that the newest version should be used?
>
>     follow the installation instructions. they explain how to override the
>     compiler.
>     axel.
>
>
>     > Thanks for your time,
>     > Yantao Wu,
>     > Undergraduate Student
>     > Physics and Chemistry, HMC'15
>     >
>     >
>     > On Mon, May 20, 2013 at 9:47 PM, Yantao Wu <ywu at g.hmc.edu
>     <mailto:ywu at g.hmc.edu>> wrote:
>     >>
>     >> Thank you very much, Surender. (I want to bake you cookies! ) I ran
>     >> ./configure again and it seems that I'm using gfortran-4.1.2 as
>     well.
>     >>
>     >> Yantao
>     >>
>     >>
>     >> On Mon, May 20, 2013 at 2:41 PM, Surender
>     <surender_kumar at iitb.ac.in <mailto:surender_kumar at iitb.ac.in>>
>     >> wrote:
>     >>>
>     >>> Hi,
>     >>> I had a similar problem with GNU Fortran 4.1.2 compiler, and
>     if you are
>     >>> using gfortran version < 4.5 then most probably its the compiler
>     >>> issue.Now
>     >>> either you can use a newer version gfortran or compile your
>     code with
>     >>> Intel non-commercial compilers.
>     >>>
>     >>> Moreover, you can search pw-forum and may be you can find a better
>     >>> answer.
>     >>>
>     >>> http://www.democritos.it/cgi-bin/htsearch?words=
>     >>>
>     >>> Surender
>     >>> IIT Bombay
>     >>>
>     >>> > Hi all,
>     >>> >
>     >>> > When I ran example01 in PW, the following error resulted:
>     >>> >
>     >>> >
>     >>> >
>     ########################################################################################################################
>     >>> > # FROM IOTK LIBRARY, VERSION 1.2.0
>     >>> > # UNRECOVERABLE ERROR (ierr=1)
>     >>> > # ERROR IN: iotk_scan_end (iotk_scan.f90:241)
>     >>> > # CVS Revision: 1.23
>     >>> > # foundl
>     >>> > # ERROR IN: iotk_close_read (iotk_files.f90:746)
>     >>> > # CVS Revision: 1.20
>     >>> >
>     >>> >
>     ########################################################################################################################
>     >>> >
>     >>> > Does anyone know what this is referring to?
>     >>> > Thanks.
>     >>> >
>     >>> >
>     >>> > On Mon, May 20, 2013 at 1:04 PM, Paolo Giannozzi
>     >>> > <paolo.giannozzi at uniud.it
>     <mailto:paolo.giannozzi at uniud.it>>wrote:
>     >>> >
>     >>> >> On Mon, 2013-05-20 at 11:34 -0700, Yantao Wu wrote:
>     >>> >>
>     >>> >> > wouldn't this imply an error in the source files, which
>     I'm sure
>     >>> >> > most people didn't encounter. Does anyone know why?
>     >>> >>
>     >>> >> some compilers are more picky than others. In this case, I
>     do not see
>     >>> >> anything wrong in the syntax, so maybe your compiler has
>     been too
>     >>> >> picky
>     >>> >>
>     >>> >> P.
>     >>> >>
>     >>> >> >
>     >>> >> >
>     >>> >> > Thanks
>     >>> >> >
>     >>> >> >
>     >>> >> > On Mon, May 20, 2013 at 10:38 AM, Surender
>     >>> >> > <surender_kumar at iitb.ac.in
>     <mailto:surender_kumar at iitb.ac.in>>
>     >>> >> > wrote:
>     >>> >> >         Hi Yantao Wu
>     >>> >> >
>     >>> >> >         May be you need to put a space between ENDIF and &
>     >>> >> >         then do make clean and recompile the code
>     >>> >> >
>     >>> >> >         Surender
>     >>> >> >         IIT Bombay, India
>     >>> >> >
>     >>> >> > > Dear QE users,
>     >>> >> > >
>     >>> >> > > Recently I reinstalled QE-5.0.2 on my computer, but the
>     >>> >> >         following error
>     >>> >> > > message resulted:
>     >>> >> > >
>     >>> >> > > "
>     >>> >> > > gfortran -O3 -g -x f95-cpp-input -D__GFORTRAN -D__STD_F95
>     >>> >> >         -D__FFTW
>     >>> >> > >  -I../include -I../../iotk/src -I../../Modules -I. -c
>     >>> >> >         exx.f90
>     >>> >> > >  In file exx.f90:1547
>     >>> >> > >
>     >>> >> > >                   ENDIF&
>     >>> >> > >                       1
>     >>> >> > > Error: Expected terminating name at (1)
>     >>> >> > > "
>     >>> >> > >
>     >>> >> > > Do anyone recognize this message and suggest anyway to
>     >>> >> > help?
>     >>> >> > >
>     >>> >> > > Thank you very much.
>     >>> >> > > Yantao Wu,
>     >>> >> > > Undergraduate student
>     >>> >> > > Physics and Chemistry, HMC'15
>     >>> >> >
>     >>> >> > > _______________________________________________
>     >>> >> > > Pw_forum mailing list
>     >>> >> > > Pw_forum at pwscf.org <mailto:Pw_forum at pwscf.org>
>     >>> >> > > http://pwscf.org/mailman/listinfo/pw_forum
>     >>> >> >
>     >>> >> >         _______________________________________________
>     >>> >> >         Pw_forum mailing list
>     >>> >> > Pw_forum at pwscf.org <mailto:Pw_forum at pwscf.org>
>     >>> >> > http://pwscf.org/mailman/listinfo/pw_forum
>     >>> >> >
>     >>> >> >
>     >>> >> > _______________________________________________
>     >>> >> > Pw_forum mailing list
>     >>> >> > Pw_forum at pwscf.org <mailto:Pw_forum at pwscf.org>
>     >>> >> > http://pwscf.org/mailman/listinfo/pw_forum
>     >>> >>
>     >>> >> --
>     >>> >> Paolo Giannozzi, Dept. Chemistry&Physics&Environment,
>     >>> >> Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
>     >>> >> Phone +39-0432-558216 <tel:%2B39-0432-558216>, fax
>     +39-0432-558222 <tel:%2B39-0432-558222>
>     >>> >>
>     >>> >> _______________________________________________
>     >>> >> Pw_forum mailing list
>     >>> >> Pw_forum at pwscf.org <mailto:Pw_forum at pwscf.org>
>     >>> >> http://pwscf.org/mailman/listinfo/pw_forum
>     >>> >>
>     >>> > _______________________________________________
>     >>> > Pw_forum mailing list
>     >>> > Pw_forum at pwscf.org <mailto:Pw_forum at pwscf.org>
>     >>> > http://pwscf.org/mailman/listinfo/pw_forum
>     >>>
>     >>> _______________________________________________
>     >>> Pw_forum mailing list
>     >>> Pw_forum at pwscf.org <mailto:Pw_forum at pwscf.org>
>     >>> http://pwscf.org/mailman/listinfo/pw_forum
>     >>
>     >>
>     >
>     >
>     > _______________________________________________
>     > Pw_forum mailing list
>     > Pw_forum at pwscf.org <mailto:Pw_forum at pwscf.org>
>     > http://pwscf.org/mailman/listinfo/pw_forum
>
>
>
>     --
>     Dr. Axel Kohlmeyer akohlmey at gmail.com <mailto:akohlmey at gmail.com>
>     http://goo.gl/1wk0
>     International Centre for Theoretical Physics, Trieste. Italy.
>     _______________________________________________
>     Pw_forum mailing list
>     Pw_forum at pwscf.org <mailto:Pw_forum at pwscf.org>
>     http://pwscf.org/mailman/listinfo/pw_forum
>
>
>
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> http://pwscf.org/mailman/listinfo/pw_forum

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