[Wannier] Error when using pw2wannier90.x
Pang Rui
pang.r at sustc.edu.cn
Sun Nov 16 17:37:11 CET 2014
Dear all
I am working on a slab system that contains 73 Ni and 60 C. When I use
pw2wannier90.x the code always ends at the first
Program PW2WANNIER v.5.1.1 starts on 17Nov2014 at 0:19:21
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 48 processors
R & G space division: proc/nbgrp/npool/nimage = 48
and show message like
mpirun noticed that process rank 0 with PID 41687 on node fn002 exited on
signal 11 (Segmentation fault)
I do not think it is because insufficient memory because the pwscf.save is
only 4M. Did anyone meet this problem before?
The following is the input file
&inputpp
outdir = './'
seedname = 'ni_down'
spin_component = 'down'
write_mmn = .true.
write_amn = .true.
--
PostDoc
Department of Physics, South University of Science and Technology of China
Shenzhen, Guangdong, PRC, 518500
More information about the Wannier
mailing list