recently, I use mpi-atk(v2008.10.0) to calculation for nano systems, however, I face to a problem, when two-probe calculation reached 2 steps, however, it displays in outfile .log:
# ----------------------------------------------------------------
# TwoProbe Calculation
# ----------------------------------------------------------------
# sc 0 : q = 791.88962 e
# sc 1 : q = 834.52211 e dRho = 5.2383E-01
mpiexec_node08: mpd_uncaught_except_tb handling:
exceptions.IOError: [Errno 5] Input/output error
/opt/mpich2/bin/mpiexec 1051 handle_cli_stderr_input
sys.stderr.write(msg)
/opt/mpich2/bin/mpdlib.py 762 handle_active_streams
handler(stream,*args)
/opt/mpich2/bin/mpiexec 515 mpiexec
rv = streamHandler.handle_active_streams(timeout=1.0)
/opt/mpich2/bin/mpiexec 1423 ?
mpiexec()
how to solve this involved problem?Thank you very much!!!