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标题: 请问vasp计算中开始任务还能正常进行,突然出现这样的报错,而后任务终止。 [打印本页]

作者
Author:
vickiCX    时间: 2025-7-14 09:12
标题: 请问vasp计算中开始任务还能正常进行,突然出现这样的报错,而后任务终止。
ERROR: MINIMIZE_L: failed to converge in 200 iterations
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...
VASP aborting ...



作者
Author:
1138711019    时间: 2025-7-14 10:47
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