[Pw_forum] Installation problem
Ben Palmer
benpalmer1983 at gmail.com
Tue May 21 20:19:08 CEST 2013
Ah, I have to admit I didn't read their information closely :) getting
the right version of gfortran to run seems to be the way then.
> On Tue, May 21, 2013 at 8:07 PM, Ben Palmer<benpalmer1983 at gmail.com> wrote:
>> Hi Yantao,
>>
>> Also you may qualify for the intel compiler:
>>
>> http://software.intel.com/en-us/non-commercial-software-development
>
> *very* unlikely. the intel web site explains in great detail that
> using the non-commercial version for research work is not allowed. you
> need an academic license. the fact that Q-E is open source doesn't
> change a thing about this.
>
> you qualify, if you use the non-commercial license for *developing*
> non-commercial software *in your free time*. that is it.
>
> axel.
>
>
>> 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> wrote:
>>> On Tue, May 21, 2013 at 6:45 PM, Yantao Wu<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 it is outdated just as well.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> 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>
>>>>> 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>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>
>>>>>>>>> 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
>>>>>>>>> > http://pwscf.org/mailman/listinfo/pw_forum
>>>>>>>>>
>>>>>>>>> _______________________________________________
>>>>>>>>> Pw_forum mailing list
>>>>>>>>> Pw_forum at pwscf.org
>>>>>>>>> http://pwscf.org/mailman/listinfo/pw_forum
>>>>>>>>>
>>>>>>>>>
>>>>>>>>> _______________________________________________
>>>>>>>>> Pw_forum mailing list
>>>>>>>>> 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, fax +39-0432-558222
>>>>>>>>
>>>>>>>> _______________________________________________
>>>>>>>> Pw_forum mailing list
>>>>>>>> Pw_forum at pwscf.org
>>>>>>>> http://pwscf.org/mailman/listinfo/pw_forum
>>>>>>>>
>>>>>>> _______________________________________________
>>>>>>> Pw_forum mailing list
>>>>>>> Pw_forum at pwscf.org
>>>>>>> http://pwscf.org/mailman/listinfo/pw_forum
>>>>>> _______________________________________________
>>>>>> Pw_forum mailing list
>>>>>> Pw_forum at pwscf.org
>>>>>> http://pwscf.org/mailman/listinfo/pw_forum
>>>>>
>>>>
>>>> _______________________________________________
>>>> Pw_forum mailing list
>>>> Pw_forum at pwscf.org
>>>> http://pwscf.org/mailman/listinfo/pw_forum
>>>
>>>
>>> --
>>> Dr. Axel Kohlmeyer akohlmey at gmail.com http://goo.gl/1wk0
>>> International Centre for Theoretical Physics, Trieste. Italy.
>>> _______________________________________________
>>> Pw_forum mailing list
>>> Pw_forum at pwscf.org
>>> http://pwscf.org/mailman/listinfo/pw_forum
>>
>>
>> _______________________________________________
>> Pw_forum mailing list
>> Pw_forum at pwscf.org
>> http://pwscf.org/mailman/listinfo/pw_forum
>>
>>
>>
>> _______________________________________________
>> Pw_forum mailing list
>> Pw_forum at pwscf.org
>> http://pwscf.org/mailman/listinfo/pw_forum
>
>
> --
> Dr. Axel Kohlmeyer akohlmey at gmail.com http://goo.gl/1wk0
> International Centre for Theoretical Physics, Trieste. Italy.
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://pwscf.org/mailman/listinfo/pw_forum
More information about the users
mailing list