Molcas Forum

abid

Member

Registered: 2015-11-12

Posts: 41

Request-----urgent please

I am getting this error (or similar with only difference in  number of bins) in most of my calculations, can anyone suggest why is it?
=========================================================

  SEWARD will use a sorting area of       32768 Words(Real*8) in the first phase (=   4 bins).
  SEWARD will use a sorting area of   381420900 Words(Real*8) in the second phase.

--- Stop Module: seward at Sat Oct 12 19:56:58 2019 /rc=_RC_INTERNAL_ERROR_ ---
*** files: xmldump

================================================

wingsofephemera

Member

Registered: 2019-10-11

Posts: 10

Re: Request-----urgent please

The specific error type is defined as
_RC_INTERNAL_ERROR_       Some internal inconsistency of the code was detected
this can be thrown in many modules, could you pls provide the input?

abid

Member

Registered: 2015-11-12

Posts: 41

Re: Request-----urgent please

Dear wingsofephemera
I have following input file and few other calculating core excitations. But all of them end up with Seward module saying the above error.

>>export MOLCAS_NEW_WORKDIR=YES
>export MOLCAS_KEEP_WORKDIR=NO
>export MOLCAS_MEM=6044
>export MOLCAS_PRINT=VERBOSE
&GATEWAY
  Coord
coord.xyz
Group = NoSym
&SEWARD
>>export CurDir=/path/abc/1
>>COPY $CurDir/$Project.JobIph_S0 JOB001
>>COPY $CurDir/$Project.JobIph_X0 JOB002
&RASSI
 MEES

Ignacio

Administrator

From: Uppsala

Registered: 2015-11-03

Posts: 1,079

Re: Request-----urgent please

Maybe the memory is not enough, or maybe there's a problem with the missing basis set.