[Pw_forum] Pseudo directory error
Bramha Pandey
pandey.bramha at gmail.com
Sun Dec 30 19:09:43 CET 2012
Dear Ari,
you can downloaded ifortron for non-commercial purposes without any
restriction with license agreement.
On Sun, Dec 30, 2012 at 11:35 PM, Ari P Seitsonen <Ari.P.Seitsonen at iki.fi>wrote:
>
> Dear Deepika,
>
> Newer versions of 'gfortran' should also work I believe. The license
> agreements of the Intel compiler are quite restrictive - well I guess most
> of the people either do not know or actively ignore them.
>
> #> gfortran -v
>
> shows you which version you have installed on your machine.
>
> Greetings and Good Luck,
>
>
> apsi
>
> -=*=-=*=-=*=-=*=-=*=-=*=-=*=-=***=-=*=-=*=-=*=-=*=-=*=-=*=-=*=**
> -=*=-=*=-=*=-=*=-
> Ari P Seitsonen / Ari.P.Seitsonen at iki.fi / http://www.iki.fi/~apsi/
> Physikalisch-Chemisches Institut der Universitaet Zuerich
> Tel: +41 44 63 54 497 / Mobile: +41 79 71 90 935
>
>
> On Sun, 30 Dec 2012, deepika goyal wrote:
>
> Thanks for the nice comments.. yes we are using gfortran compiler,now
>> this
>> seems the only option is to use ifort -03 compiler. I will try for this
>> and
>> let you know..
>> I will be in touch with this forum as I am very new to this field.. I'll
>> always need your help...
>>
>> Greetings
>> Deepika
>>
>> On Sun, Dec 30, 2012 at 11:12 PM, Bramha Pandey <pandey.bramha at gmail.com>
>> wrote:
>> As few days ago..i was getting the same like error and adviced
>> of some Prof. is that to upgrade the compiler.
>> basicaly i guess you are using gfortron but use upgraded one.
>> other is that download the ifort -03 noncomercial compiler from
>> intel site and then configure and make all by this ifort.
>> As this is a long process keep in touch with this forun and
>> firstly searched the mailinf list.."this is also the part of
>> Ph.D and research."
>>
>> On Sun, Dec 30, 2012 at 11:06 PM, deepika goyal
>> <deepika.goyal58 at gmail.com> wrote:
>> this is espresso-5.0.2.
>>
>> On Sun, Dec 30, 2012 at 11:03 PM, Bramha Pandey
>> <pandey.bramha at gmail.com> wrote:
>> Dear Deepika,
>> you can search at forun and got lots of
>> posts at this error.
>> this error is due to many reasons as you
>> are using old version of code or buggy
>> compiler all those things.
>> which version you are using.. svn or
>> espresso-5.0.1 or like.
>>
>> On Sun, Dec 30, 2012 at 10:54 PM, Ari P
>> Seitsonen <Ari.P.Seitsonen at iki.fi>
>> wrote:
>>
>> Dear Deepika,
>>
>> Like you see, the
>> directory is already wrong
>> at this stage:
>>
>> # pseudo directory:
>> /pseudo
>>
>> It should be what you
>> defined in the file
>> 'environment_variables',
>> PSEUDO_DIR=/home/bramha/**espresso/pseudo
>> Are you sure that you source
>> (= the ".
>> <path>environment_variable"
>> line in 'run_example') the
>> correct file?
>>
>> Greetings,
>>
>> apsi
>>
>> -=*=-=*=-=*=-=*=-=*=-=*=-=*=-=***=-=*=-=*=-=*=-=*=-=*=-=*=-=*=**
>> -=*=-=*=-=*=-=*
>> =-
>> Ari P Seitsonen /
>> Ari.P.Seitsonen at iki.fi /
>> http://www.iki.fi/~apsi/
>> Physikalisch-Chemisches
>> Institut der Universitaet
>> Zuerich
>> Tel: +41 44 63 54 497 /
>> Mobile: +41 79 71 90 935
>>
>>
>> On Sun, 30 Dec 2012, deepika
>> goyal wrote:
>>
>> Hello Sir,
>> I have checked the environmental
>> variable file and the path for the
>> PESUDO_DIR is also correctly defined. In
>> FAQ, I found no thread relating
>> this error. I tried with EXPORT
>> HTTP_PROXY=http://username:**password/ in
>> .bashrc file. but nothing is working.
>>
>> Error message:
>>
>> physics at intranet:~/espresso/**espresso/PW/examples/**example01$
>> ./run_example
>>
>> /home/physics/espresso/**espresso/PW/examples/example01
>> : starting
>>
>> This example shows how to use pw.x to
>> calculate the total energy and
>> the band structure of four simple
>> systems: Si, Al, Cu, Ni.
>>
>> executables directory: /bin
>> pseudo directory: /pseudo
>> temporary directory:
>> /home/physics/tmp
>> checking that needed directories and
>> files exist...
>> ERROR: /pseudo not existent or not a
>> directory
>> Aborting
>> physics at intranet:~/espresso/**espresso/PW/examples/**example01$
>>
>> If possible can we do it using Team
>> Viewer as I am very new to Linux
>> environment.
>>
>> Thanks and regards
>>
>> DeepikaResearch Scholar
>> Department of Physics
>> Indian Institute of Technology
>> Ropar, 140001
>> Punjab
>>
>>
>>
>> On Sun, Dec 30, 2012 at 10:19 PM, Ari P
>> Seitsonen <Ari.P.Seitsonen at iki.fi>
>> wrote:
>>
>> Dear Deepika,
>>
>> Clearly the variable 'pseudo_dir' in
>> your input is
>> errorneuous, probably there is a problem
>> with an environmental
>> variable that you use but it is not
>> defined?
>>
>> Otherwise it would be more useful to
>> provide more information
>> about what you did, your script/input
>> files; but this is
>> practically an FAQ, more a question
>> about the usage of
>> unix/linux scripts than Q-E itself.
>>
>> Good Luck!,
>>
>> apsi
>>
>> -=*=-=*=-=*=-=*=-=*=-=*=-=*=-=***=-=*=-=*=-=*=-=*=-=*=-=*=-=*=**
>> -=*=-=*=-=*=-=*
>>
>> =-
>> Ari P Seitsonen /
>> Ari.P.Seitsonen at iki.fi /
>> http://www.iki.fi/~apsi/
>> Physikalisch-Chemisches Institut der
>> Universitaet Zuerich
>> Tel: +41 44 63 54 497 / Mobile: +41
>> 79 71 90 935
>>
>>
>> On Sun, 30 Dec 2012, deepika goyal
>> wrote:
>>
>> Hello,
>> I have started working on Quantum
>> Espresso, while
>> installation process I
>> have successfully tested the PW and CPV
>> modules as given
>> in User's guide for
>> Quantum Espresso but the example files
>> while running shows
>> the error message
>>
>> ERROR: /pseudo not existent or not a
>> directory
>> Aborting
>>
>> Thanks and Regards
>>
>> --
>> DeepikaResearch Scholar
>> Department of Physics
>> Indian Institute of Technology
>> Ropar, 140001
>> Punjab
>>
>>
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>>
>>
>>
>>
>> --
>> DeepikaResearch Scholar
>> Department of Physics
>> Indian Institute of Technology
>> Ropar, 140001
>> Punjab
>>
>>
>> ______________________________**_________________
>> Pw_forum mailing list
>> Pw_forum at pwscf.org
>> http://pwscf.org/mailman/**listinfo/pw_forum<http://pwscf.org/mailman/listinfo/pw_forum>
>>
>>
>>
>>
>> --
>> Thanks and Regards
>> Bramha Prasad Pandey
>> Indian School of Mines(ISM)
>> Dhanbad, INDIA.
>>
>> ______________________________**_________________
>> Pw_forum mailing list
>> Pw_forum at pwscf.org
>> http://pwscf.org/mailman/**listinfo/pw_forum<http://pwscf.org/mailman/listinfo/pw_forum>
>>
>>
>>
>>
>> --
>> DeepikaResearch Scholar
>> Department of Physics
>> Indian Institute of Technology
>> Ropar, 140001
>> Punjab
>>
>> ______________________________**_________________
>> Pw_forum mailing list
>> Pw_forum at pwscf.org
>> http://pwscf.org/mailman/**listinfo/pw_forum<http://pwscf.org/mailman/listinfo/pw_forum>
>>
>>
>>
>>
>> --
>> Thanks and Regards
>> Bramha Prasad Pandey
>> Indian School of Mines(ISM)
>> Dhanbad, INDIA.
>>
>> ______________________________**_________________
>> Pw_forum mailing list
>> Pw_forum at pwscf.org
>> http://pwscf.org/mailman/**listinfo/pw_forum<http://pwscf.org/mailman/listinfo/pw_forum>
>>
>>
>>
>>
>> --
>> DeepikaResearch Scholar
>> Department of Physics
>> Indian Institute of Technology
>> Ropar, 140001
>> Punjab
>>
>>
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--
Thanks and Regards
Bramha Prasad Pandey
Indian School of Mines(ISM)
Dhanbad, INDIA.
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