[Wien] Print plane wave coefficients flom LAPW1 with -p option

Elias Assmann elias.assmann at gmail.com
Wed Jan 8 10:33:11 CET 2014


On 01/08/2014 01:20 AM, Oleg Rubel wrote:
> I wonder if anybody can reproduce this error?

I can.  I used only MPI-parallelism:

$ cat .machines
1: localhost localhost

$ x lapw1 -up -p
w2k_dispatch_signal(): received: Segmentation fault

$ cat uplapw1.error
**  Error in Parallel LAPW1
**  LAPW1 STOPPED at Wed Jan 8 10:26:39 CET 2014
**  check ERROR FILES!
Error in LAPW1
  'Unknow' - Process termination signal received

> Wien2k v13.1; Intel Fortran v11.0.074; MKL v10.1.0.015; MVAPICH2

$ cat $WIENROOT/VERSION
WIEN2k_13.1 (Release 17/6/2013)

`cat $WIENROOT/COMPILER` -V
Intel(R) Fortran Intel(R) 64 Compiler Professional for applications 
running on Intel(R) 64, Version 11.1    Build 20090630 Package ID: 
l_cprof_p_11.1.046

with Open MPI 1.4.4


HTH,

	Elias



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