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 >> >> >> ______________________________**_________________ >> 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 >> >> ______________________________**_________________ >> 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 > -- Thanks and Regards Bramha Prasad Pandey Indian School of Mines(ISM) Dhanbad, INDIA. -------------- next part -------------- An HTML attachment was scrubbed... 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