[Pw_forum] Pseudo directory error
Ari P Seitsonen
Ari.P.Seitsonen at iki.fi
Sun Dec 30 19:05:32 CET 2012
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
>
>
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>
>
> --
> Thanks and Regards
> Bramha Prasad Pandey
> Indian School of Mines(ISM)
> Dhanbad, INDIA.
>
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>
>
> --
> 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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>
>
> --
> DeepikaResearch Scholar
> Department of Physics
> Indian Institute of Technology
> Ropar, 140001
> Punjab
>
>
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