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标题: VASP+lobster计算报错,个人修改无法解决,求助 [打印本页]

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Author:
Mr.seven    时间: 2025-12-28 08:51
标题: VASP+lobster计算报错,个人修改无法解决,求助
loster计算无论如何修改,于超算中本地运行还是提交成slurm运行,都会报下面的错误,无法解决,POSCAR、OUTCAR、WAVECAR均正常生成,VASP计算log文件无报错,求助各位老师:
terminate called after throwing an instance of 'std::out_of_range'
  what():  basic_string::substr: __pos (which is 2) > this->size() (which is 0)
/var/spool/slurmd/job37361060/slurm_script: line 23: 3719934 Aborted                 (core dumped) lobster > log






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