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Re: Problem in epw.x run

Posted: Thu Jul 13, 2017 4:01 pm
by vinpandey
dear sir, in the very begining of the calculation. I am getting this error. may I have explanation of all parameter of epw input file to calculate electron linewidth.

thank you

Re: Problem in epw.x run

Posted: Sun Aug 27, 2017 12:20 pm
by SeanBell
vinpeandey wrote:dear sir, in the very begining of the calculation. I am getting some bingo views this error. may I have explanation of all parameter of epw input file to calculate electron linewidth.

thank you


Are you still getting the error?

Re: Problem in epw.x run

Posted: Wed Nov 01, 2017 10:24 am
by rajubiswas
Hi,
I started using EPW package in quantum espresso software. I am a new beginner. I have exactly followed the diamond problem in test file. I am following these command to run the codes.
The steps are...
mpirun -np 4 pw.x <scf.in> scf.out
mpirun -np 4 ph.x <ph.in> ph.out
python pp.py
mpirun -np 4 pw.x <scf.in> scf.out
mpirun -np 4 pw.x -npool <nscf.in> nscf.out
mpirun -np 4 epw.x <epw.in> epw.out

once i run epw.x, I get this error..
"APPLICATION TERMINATED WITH THE EXIT STRING: Broken pipe (signal 13)"
why can this error be happened?

Re: Problem in epw.x run

Posted: Wed Nov 01, 2017 1:43 pm
by sponce
Hello,

It should be

mpirun -np 4 epw.x -npool 4 <epw.in> epw.out

Re: Problem in epw.x run

Posted: Thu Nov 02, 2017 4:39 am
by rajubiswas
sponce wrote:Hello,

It should be

mpirun -np 4 epw.x -npool 4 <epw.in> epw.out



Thank you very much for your kind reply. After using this command(mpirun -np 4 epw.x -npool 4 <epw.in> epw.out), I am still getting the same error(APPLICATION TERMINATED WITH THE EXIT STRING: Broken pipe (signal 13)). What does that error mean?

Re: Problem in epw.x run

Posted: Thu Nov 02, 2017 11:24 am
by sponce
Hello,

The nscf also needs 4 cpu:

mpirun -np 4 pw.x -npool 4 <nscf.in> nscf.out
mpirun -np 4 epw.x -npool 4 <epw.in> epw.out

Best,
Samuel

Re: Problem in epw.x run

Posted: Thu Nov 02, 2017 12:22 pm
by rajubiswas
sponce wrote:Hello,

The nscf also needs 4 cpu:

mpirun -np 4 pw.x -npool 4 <nscf.in> nscf.out
mpirun -np 4 epw.x -npool 4 <epw.in> epw.out

Best,
Samuel


Still I am getting same error. Is it installation error or other error?

Re: Problem in epw.x run

Posted: Thu Nov 02, 2017 12:27 pm
by sponce
Hello,

Yes, its likely an installation error then.

Does it work in sequential ?

Do you see the EPW logo then it segfault ?
What is the full error message ?

If you do
mpirun --version

you get the intel version correctly ?

Best,
Samuel

Re: Problem in epw.x run

Posted: Thu Nov 02, 2017 1:07 pm
by rajubiswas
sponce wrote:Hello,

Yes, its likely an installation error then.

Does it work in sequential ?

Do you see the EPW logo then it segfault ?
What is the full error message ?

If you do
mpirun --version

you get the intel version correctly ?

Best,
Samuel


Hi,
Yes, EPW logo is there.
Yes, It is showing intel version correctly.
The full error is given below..


S. Ponce, E. R. Margine, C. Verdi, and F. Giustino,
Comput. Phys. Commun. 209, 116 (2016)



Program EPW v.4.1.0 (svn rev. 13369) starts on 2Nov2017 at 18:38:16

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

Parallel version (MPI), running on 4 processors
K-points division: npool = 4

Reading data from directory:
./temp_diam/diam.save

Info: using nr1, nr2, nr3 values from input

Info: using nr1, nr2, nr3 values from input

IMPORTANT: XC functional enforced from input :
Exchange-correlation = SLA PW PBE PBE ( 1 4 3 4 0 0)
Any further DFT definition will be discarded
Please, verify this is what you really want

file C.pbe-rrkjus.UPF: wavefunction(s) 2S 2P renormalized

G-vector sticks info
--------------------
sticks: dense smooth PW G-vecs: dense smooth PW
Sum 367 367 121 4645 4645 893


Possibly too few bands at point 1 0.00000 0.00000 0.00000

Possibly too few bands at point 2 -0.33333 0.33333 -0.33333

Possibly too few bands at point 3 -0.66667 0.66667 -0.66667

Possibly too few bands at point 4 0.33333 0.33333 0.33333

Possibly too few bands at point 5 0.00000 0.66667 0.00000

Possibly too few bands at point 6 -0.33333 1.00000 -0.33333

Possibly too few bands at point 7 0.66667 0.66667 0.66667
APPLICATION TERMINATED WITH THE EXIT STRING: Broken pipe (signal 13)

Re: Problem in epw.x run

Posted: Sat Nov 04, 2017 7:17 am
by rajubiswas
Hi,
Do you have any idea about that error(APPLICATION TERMINATED WITH THE EXIT STRING: Broken pipe (signal 13)) what I am getting?