[Pw_forum] error in find_mode_sym.f90
Bramha Pandey
pandey.bramha at gmail.com
Tue Jan 29 11:48:03 CET 2013
Dear Sir,
I am sending my make.sys file to you. Due to executable file i have change
it name make only.
Please find the attachment.
I am very grateful for your kind help.
On Tue, Jan 29, 2013 at 2:43 PM, Andrea Dal Corso <dalcorso at sissa.it> wrote:
>
> On Tue, 2013-01-29 at 13:57 +0530, Bramha Pandey wrote:
> > Dear Prof. Paolo,
> > Thanks for your kind reply.
> > As per my search, i got the same error with svn espresso (version
> > PHONON v.5.0.2 (svn rev. 9881)) and by espresso-5.0.2 (PHONON v.5.0.2
> > (svn rev. 9392)) to run the examples01 and example02.
> > By seeing the out put of ph.x only prints
> > There are 3 irreducible representations
> >
> > Representation 1 2 modes - To be done
> >
> > Representation 2 2 modes - To be done
> >
> > Representation 3 2 modes - To be done
> >
> >
> >
> > Alpha used in Ewald sum = 0.7000
> > PHONON : 1.92s CPU 2.35s WALL
> >
> >
> >
> > Representation # 1 modes # 1 2
> >
> > Self-consistent Calculation
> >
> > after that at terminal the following error messages are appeared.
> >
> > running the scf calculation for Si... done
> > running the phonon calculation at Gamma for Si...forrtl: severe
> > (174): SIGSEGV, segmentation fault occurred
> > Image PC Routine Line
> > Source
> > ph.x 08076447 find_mode_sym_new 145
> > find_mode_sym.f90
> > ph.x 08151582 set_irr_new_ 158
> > set_irr.f90
> > ph.x 0813D510 find_irrep_ 32
> > find_irrep.f90
> > ph.x 0807AB66 init_representati 103
> > init_representations.f90
> > ph.x 0804E7FF check_initial_sta 161
> > check_initial_status.f90
> > ph.x 0804B531 MAIN__ 91 phonon.f90
> > ph.x 0804B484 Unknown Unknown Unknown
> > libc.so.6 B68374D3 Unknown Unknown Unknown
> > done
> > running the phonon calculation at X for Si...forrtl: severe (174):
> > SIGSEGV, segmentation fault occurred
> >
> > Stack trace terminated abnormally.
> > Error condition encountered during test: exit status = 174
> > Aborting
> >
> > As per my knowledge the error is coming at 145 lines in
> > 'find_mode_sym.f90 which is DO i=1,dim_rap(igroup).
> > Dear Sir now i am further helpless why this is occured as if i
> > compared with espresso-4.3.2(which runs without any problem) this line
> > is written as DO i=1,dim_rap.
> >
>
> Please provide your make.sys, or try to link with the internal blas and
> lapack libraries. I do not know if this apply to your case, but I have
> seen an error similar to the one that you report due to a problem with
> the blas library. find_mode_sym is just the first routine that uses
> zdotc.
>
> HTH,
>
> Andrea
>
>
>
>
>
> > As Prof. Dal has advised to add the patch given by you but it also
> > doen't help me may be i am not able to patach it correctly. As i
> > patched
> > bramha at bramha-Inspiron-1545:~/espresso-5.0.2$ patch -p1 <
> > "attachment.bin" . this attachment.bin is in my espresso-5.0.2
> > directory.
> >
> > P.S The pw.x calculation is done perfectly. for all the cases.
> >
> > Sorry for such long message.
> > I am looking forward for your kind comments and help.
> >
> > On Mon, Jan 28, 2013 at 2:13 AM, Paolo Giannozzi
> > <giannozz at democritos.it> wrote:
> > it works for me. If it doesn't work for you, please find out
> > why
> > and report
> >
> > P.
> >
> > On Jan 27, 2013, at 16:41 , Bramha Pandey wrote:
> >
> > > Dear all Developers and users,
> > > I was trying to run example01 in PHonon subdirectory in
> > > espresso-5.0.2 ( PHONON v.5.0.2 (svn rev. 9392))
> > > and got the following error,
> > > running the scf calculation for Si... done
> > > running the phonon calculation at Gamma for Si...forrtl:
> > severe
> > > (174): SIGSEGV, segmentation fault occurred
> > > Image PC Routine Line
> > Source
> > > ph.x 08076447 find_mode_sym_new 145
> > > find_mode_sym.f90
> > > ph.x 08151582 set_irr_new_ 158
> > > set_irr.f90
> > > ph.x 0813D510 find_irrep_ 32
> > > find_irrep.f90
> > > ph.x 0807AB66 init_representati 103
> > > init_representations.f90
> > > ph.x 0804E7FF check_initial_sta 161
> > > check_initial_status.f90
> > > ph.x 0804B531 MAIN__ 91
> > phonon.f90
> > > ph.x 0804B484 Unknown Unknown
> > Unknown
> > > libc.so.6 B68DE4D3 Unknown Unknown
> > Unknown
> > > done
> > > running the phonon calculation at X for Si...forrtl:
> > severe
> > > (174): SIGSEGV, segmentation fault occurred
> > > Error condition encountered during test: exit status = 174
> > > Aborting
> > > I have compiled espresso-5.0.2 with Intel compiler and
> > gfortran
> > > both and the same error was coming.
> > > Any type of help is appreciated.
> > >
> > > P.S. when i was tried to run with espresso-4.3.2 (with
> > gfortran),
> > > it was working without any error.
> > > --
> > > 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
> >
> >
> > ---
> > Paolo Giannozzi, Dept of Chemistry&Physics&Environment,
> > Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
> > Phone +39-0432-558216, fax +39-0432-558222
> >
> >
> >
> >
> > _______________________________________________
> > 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.
> > _______________________________________________
> > Pw_forum mailing list
> > Pw_forum at pwscf.org
> > http://pwscf.org/mailman/listinfo/pw_forum
> --
> Andrea Dal Corso Tel. 0039-040-3787428
> SISSA, Via Bonomea 265 Fax. 0039-040-3787249
> I-34136 Trieste (Italy) e-mail: dalcorso at sissa.it
>
>
> _______________________________________________
> 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.
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