kpar calculation error

[pxlxingliang]

Describe the bug

When I set kpar=4 in LCAO calculations, during the SCF, abacus is stopped abnormal:

 * * * * * *
 << Start SCF iteration.
 ITER      TMAG       AMAG        ETOT/eV          EDIFF/eV         DRHO     TIME/s
 GE1      3.15e+01   3.29e+01  -1.01320040e+05   0.00000000e+00   6.8200e-02  25.27
 GE2      3.36e+01   3.44e+01  -1.01333408e+05  -1.33677580e+01   3.2150e-02  23.02
 GE3      3.37e+01   3.50e+01  -1.01335339e+05  -1.93134518e+00   1.7747e-02  23.00
 GE4      3.47e+01   3.60e+01  -1.01335678e+05  -3.38426245e-01   1.0694e-02  22.99
 GE5      3.47e+01   3.66e+01  -1.01335964e+05  -2.86198516e-01   5.7317e-03  22.91
 GE6      3.49e+01   3.67e+01  -1.01335999e+05  -3.54613168e-02   3.6981e-03  23.06
 GE7      3.49e+01   3.68e+01  -1.01335992e+05   7.67498555e-03   2.6695e-03  23.00
 GE8      3.48e+01   3.68e+01  -1.01335997e+05  -4.89171828e-03   1.6578e-03  23.00
 GE9      3.47e+01   3.68e+01  -1.01336001e+05  -4.65089043e-03   3.4829e-04  23.00
 GE10     3.47e+01   3.68e+01  -1.01336001e+05  -1.05952656e-04   2.6453e-04  22.94
 GE11     3.48e+01   3.68e+01  -1.01336001e+05  -8.33600483e-05   1.2761e-04  22.96
 GE12     3.48e+01   3.68e+01  -1.01336001e+05  -1.66829337e-05   5.5800e-05  22.93
 GE13     3.48e+01   3.68e+01  -1.01336001e+05  -2.45205620e-06   3.6140e-05  22.95
 GE14     3.48e+01   3.68e+01  -1.01336001e+05  -1.84446519e-06   2.0335e-05  22.99
 GE15     3.48e+01   3.68e+01  -1.01336001e+05  -4.00123322e-07   1.1107e-05  22.99
 GE16     3.48e+01   3.68e+01  -1.01336001e+05  -2.39393406e-07   6.4698e-06  22.98
 GE17     3.48e+01   3.68e+01  -1.01336001e+05  -9.89573590e-08   4.1572e-06  23.00
 GE18     3.48e+01   3.68e+01  -1.01336001e+05  -2.81515558e-08   2.7041e-06  22.95
 GE19     3.48e+01   3.68e+01  -1.01336001e+05  -1.12234994e-08   1.6258e-06  23.01
 GE20     3.48e+01   3.68e+01  -1.01336001e+05  -2.37586757e-09   8.2842e-07  22.94
 GE21     3.48e+01   3.68e+01  -1.01336001e+05   1.96751533e-09   5.5777e-07  22.97

===================================================================================
=   BAD TERMINATION OF ONE OF YOUR APPLICATION PROCESSES
=   RANK 0 PID 38 RUNNING AT dp-lbg-14037-13933528
=   KILLED BY SIGNAL: 9 (Killed)
===================================================================================

kpar.zip

Expected behavior

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To Reproduce

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Environment

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Additional Context

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