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小木虫: 金币+0.5, 给个红包，谢谢回帖
本人利用杂化泛函计算失败原因如何如下，如何处理？谢谢！
LDA part: xc-table for Pade appr. of Perdew
POSCAR, INCAR and KPOINTS ok, starting setup
WARNING: small aliasing (wrap around) errors must be expected
FFT: planning ...( 1 )
WAVECAR not read
entering main loop
N E dE d eps ncg rms rms(c)
rank 14 in job 1 node1_56151 caused collective abort of all ranks
exit status of rank 14: killed by signal 9
rank 12 in job 1 node1_56151 caused collective abort of all ranks
exit status of rank 12: killed by signal 9
rank 35 in job 1 node1_56151 caused collective abort of all ranks
exit status of rank 35: killed by signal 9
rank 29 in job 1 node1_56151 caused collective abort of all ranks
exit status of rank 29: killed by signal 9
rank 28 in job 1 node1_56151 caused collective abort of all ranks
exit status of rank 28: killed by signal 9
rank 27 in job 1 node1_56151 caused collective abort of all ranks
exit status of rank 27: killed by signal 9
rank 26 in job 1 node1_56151 caused collective abort of all ranks
exit status of rank 26: killed by signal 9
rank 25 in job 1 node1_56151 caused collective abort of all ranks
exit status of rank 25: killed by signal 11
rank 24 in job 1 node1_56151 caused collective abort of all ranks
exit status of rank 24: killed by signal 11
rank 47 in job 1 node1_56151 caused collective abort of all ranks
exit status of rank 47: killed by signal 11
rank 46 in job 1 node1_56151 caused collective abort of all ranks
exit status of rank 46: killed by signal 9
rank 45 in job 1 node1_56151 caused collective abort of all ranks
exit status of rank 45: killed by signal 9
rank 38 in job 1 node1_56151 caused collective abort of all ranks
exit status of rank 38: killed by signal 9
rank 37 in job 1 node1_56151 caused collective abort of all ranks
exit status of rank 37: killed by signal 9
rank 36 in job 1 node1_56151 caused collective abort of all ranks
exit status of rank 36: killed by signal 11
rank 11 in job 1 node1_56151 caused collective abort of all ranks
exit status of rank 11: killed by signal 9 |
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