unknown error while RELCCSD

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Himadri Pathak

Apr 19, 2022, 11:14:48 AM4/19/22
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Hello experts,
                        I am trying to run RELCCSD using DIRAC for water dimer with dyall.ae4z basis. I have not frozen any spinors. I have sufficient storage space as well as allocated memory. After SCF,  I am getting below error. Could any of you help me to fix this?

pam: Caught signal #1(1) but dirac.x process group is going to be terminated with stronger ammunution - signal #2 (SIGINT).


Himadri Pathak
Advanced Computing, Mathematics, and Data Division,
Pacific Northwest National Laboratory (PNNL)

Ilias Miroslav, doc. RNDr., PhD.

Apr 19, 2022, 3:02:29 PM4/19/22
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Please provide also input and output files, together with the full log file to see the launching command.


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Subject: [dirac-users] unknown error while RELCCSD
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Himadri Pathak

Apr 20, 2022, 8:35:36 PM4/20/22
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Dear Prof. Saue, 
Dear Dr. Ilias,
                            Thank you for replying. I could fix the error. It has nothing to do with DIRAC. One of our supercomputers is giving trouble. 

Thanking You,
With Best Regards,

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