*Hi All, I am new to Quantum Espresso. I have install espresso-5.0.2. Since we are working behind the campus Proxy (it requires proxy user name and password).
While installing we got the following errors * /*********************************************************************************************************/ ( cd ../../bin ; ln -fs ../PW/tools/bands_FS.x . ) gfortran -O3 -g -c kvecs_FS.f gfortran -g -o kvecs_FS.x kvecs_FS.o /home/manoj/espresso-5.0.2/lapack-3.2/lapack.a -lfftw3 /home/manoj/espresso-5.0.2/BLAS/blas.a ( cd ../../bin ; ln -fs ../PW/tools/kvecs_FS.x . ) make[2]: Leaving directory `/home/manoj/espresso-5.0.2/PW/tools' make[1]: Leaving directory `/home/manoj/espresso-5.0.2/PW' cd install ; make -f plugins_makefile neb make[1]: Entering directory `/home/manoj/espresso-5.0.2/install' *** Unable to download neb. Test whether curl or wget is installed and working, *** if you have direct access to internet. If not, copy into archive/ the file *** neb-5.0.2.tar.gz from http://files.qe-forge.org/index.php?file=neb-5.0.2.tar.gz. make[1]: *** [uncompress-neb] Error 1 make[1]: Leaving directory `/home/manoj/espresso-5.0.2/install' make: *** [neb] Error 2 /*************************************************************************************************************/ *Solution: We Manual download the following files and coped them into the archive/ directory neb-5.0.2.tar.gz. PHonon-5.0.2.tar.gz pwcond-5.0.2.tar.gz atomic-5.0.2.tar.gz tddfpt-5.0.2.tar.gz after this make all run without any error.* *Then while running cd PW/tests/ ./check_pw.x.j we got the following error.* /*****************************************************************************************************************/ Program PWSCF v.5.0.2 (svn rev. 9392) starts on 3Dec2012 at 18:57:31 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org";, in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote.php Serial version Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Reading input from /home/manoj/espresso-5.0.2/PW/tests/atom.in %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% Error in routine read_ncpp (1): pseudo file is empty or wrong %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% stopping ... /*******************************************************************************************************************/ *and then also try running* *cd CPV/tests/ ./check_cp.x.j got the following error * /*******************************************************************************************************************/ Program CP v.5.0.2 (svn rev. 9392) starts on 3Dec2012 at 18:59:17 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org";, in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote.php Serial version Reading input from /home/manoj/espresso-5.0.2/CPV/tests/h2o-mt-blyp.in1 Job Title: Water Molecule Atomic Pseudopotentials Parameters ---------------------------------- Reading pseudopotential for specie # 1 from file : /home/manoj/espresso-5.0.2/pseudo/O.blyp-mt.UPF file type is old PWscf NC format %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% Error in routine read_ncpp (1): pseudo file is empty or wrong %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% stopping ... /*******************************************************************************************************************/ *Please suggest us, how can we debug this runtime error.* -- Regards, Manoj Kumar Panwar, Pradeep Research Group IIT Madras, India Mobile: +91-9940268725 Email: manojkumarapnwar at gmail.com <manojkumarapnwar at gmail.com> -------------- next part -------------- An HTML attachment was scrubbed... URL: http://pwscf.org/pipermail/pw_forum/attachments/20121203/a0007204/attachment-0001.html
