KILLED BY SIGNAL: 9 (Killed) error

[pxlxingliang]

Describe the bug

For below system, ABACUS throw below error, after calculation of force:

===================================================================================
=   BAD TERMINATION OF ONE OF YOUR APPLICATION PROCESSES
=   RANK 0 PID 38 RUNNING AT dp-lbg-471-11467972
=   KILLED BY SIGNAL: 9 (Killed)
===================================================================================

057.zip

The INPUT is:

INPUT_PARAMETERS
calculation     scf
basis_type      pw
symmetry        0
ecutwfc 100
scf_thr 1e-08
scf_nmax 200
cal_force       1
cal_stress      1
kspacing        0.08
pseudo_rcut     10
pseudo_mesh     1
ks_solver       dav
smearing_method gauss
smearing_sigma 0.015

The system is an alloy of 36 Sr and 24 Al.

Expected behavior

No response

To Reproduce

No response

Environment

No response

Additional Context

No response

Task list for Issue attackers (only for developers)

• Verify the issue is not a duplicate.
• Describe the bug.
• Steps to reproduce.
• Expected behavior.
• Error message.
• Environment details.
• Additional context.
• Assign a priority level (low, medium, high, urgent).
• Assign the issue to a team member.
• Label the issue with relevant tags.
• Identify possible related issues.
• Create a unit test or automated test to reproduce the bug (if applicable).
• Fix the bug.
• Test the fix.
• Update documentation (if necessary).
• Close the issue and inform the reporter (if applicable).

[pxlxingliang]

I try to use c32_m128_cpu machine (the previous machine is c32_m64_cpu, which memory is only 64G), and the memory is 128G. This time, the job can be calculated successfully.
057 (2).zip

[WHUweiqingzhou]

@dyzheng,
do you think it is reasonable cost or not?