CCL: [EXTERNAL] CCL: DLPNO-CCSDT job finished by error termination in
MDCI
- From: Tobias Kraemer <Tobias.Kraemer:-:mu.ie>
- Subject: CCL: [EXTERNAL] CCL: DLPNO-CCSDT job finished by error
termination in MDCI
- Date: Wed, 1 Mar 2023 19:08:04 +0000
Dear Nikunj,
This is potentially due to a memory issue. But it might be better to pose that
question in the ORCA Forum. Without more specific detail it’s hard to
tell what’s going on.
Tobias
Dr Tobias Krämer
Assistant Professor of Inorganic Chemistry
Maynooth University, Maynooth, Co. Kildare, Ireland.
E: tobias.kraemer[]mu.ie<mailto:tobias.kraemer[]mu.ie> T: +353 (0)1 474 7517
> From: owner-chemistry+tobias.kraemer==mu.ie[]ccl.net
<owner-chemistry+tobias.kraemer==mu.ie[]ccl.net> on behalf of Nikunj Kumar
nkk749**gmail.com <owner-chemistry[]ccl.net>
Date: Wednesday, 1 March 2023 at 18:26
To: Tobias Kraemer <Tobias.Kraemer[]mu.ie>
Subject: [EXTERNAL] CCL: DLPNO-CCSDT job finished by error termination in MDCI
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Sent to CCL by: "Nikunj Kumar" [nkk749++gmail.com]
Hello everyone,
I am trying to do single point calculation using DLPNO-CCSDT in ORCA 5.0.3. My
job runs for a while and it get terminated by itself showing the following
error:
ORCA finished by error termination in MDCI
Calling Command: mpirun -np 12 --mca opal_common_ucx_opal_mem_hooks
My system consist of 37 atoms/
Can someone please help me on how to deal with this error.
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