[Pw_forum] error when run example02 in 3.2.package
njuxuyuehua at gmail.com
Mon Mar 24 10:56:50 CET 2008
in fact ,a few days ago ,i submit the problem in the pwscf forum,
you can seach it .
"Presently, configure looks first for a fortran compiler,
then for a mpif90 script. Configure assumes that the latter
uses the former. If not, the fortran flags chosen for the mpif90
scripts will not be the correct ones. In your case you have
ifort as (serial) compiler but your mpif90 script uses pgi"
i am now puzzled that my mpi is complied with pgi, so ,i choose f90=pgi
how to deal with problem.anyone could help me
2008/3/24, lan haiping <lanhaiping at gmail.com>:
> Hi, actually, this is due to your compilor .
> this glibc error probably comes from memory leakage ,
> you can try with another compilor , such as Intel ifort,
> as i guess yours now should be a pgi pack..
> On Mon, Mar 24, 2008 at 11:02 AM, xu yuehua <njuxuyuehua at gmail.com>
> > hi all here
> > i am trying to test example,but face the crash ,i did not know what is
> > wrong .
> > please help me
> > thank you a lot
> > /home/xyh/home2/espresso-3.2.3/examples/example02 : starting
> > This example shows how to use pw.x and ph.x to calculate phonon
> > frequencies at Gamma and X for Si and C in the diamond structure and
> > for fcc-Ni.
> > executables directory: /home/xyh/home2/espresso-3.2.3/bin
> > pseudo directory: /home/xyh/home2/espresso-3.2.3/pseudo
> > temporary directory: /home/xyh/home2/temp
> > checking that needed directories and files exist... done
> > running pw.x as: /home/xyh/home2/espresso-3.2.3/bin/pw.x
> > running ph.x as: /home/xyh/home2/espresso-3.2.3/bin/ph.x
> > cleaning /home/xyh/home2/temp... done
> > running the scf calculation...FORTRAN STOP
> > done
> > running the phonon calculation at Gamma...*** glibc detected ***
> > double free or corruption (!prev): 0x0000000002df48e0 ***
> > i fact ,that is the same problem when i run example1 .
> > --
> > Xu Yuehua
> > physics Department of Nanjing university
> > China
> > _______________________________________________
> > Pw_forum mailing list
> > Pw_forum at pwscf.org
> > http://www.democritos.it/mailman/listinfo/pw_forum
> Hai-Ping Lan
> Department of Electronics ,
> Peking University , Bejing, 100871
> lanhaiping at gmail.com, hplan at pku.edu.cn
> Pw_forum mailing list
> Pw_forum at pwscf.org
physics Department of Nanjing university
-------------- next part --------------
An HTML attachment was scrubbed...
More information about the users