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飞利白

新虫 (初入文坛)

[求助] lammps报错

lammps老报错Atom count is inconsistent, cannot write restart file,我看了手册说是可能原子有丢失,可是我看了我的初始构型没什么问题,而且时间步长也调小了,还是不行。我的盒子xy方向都是周期性,z方向非周期性,比如加压板从做往右压
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飞利白

新虫 (初入文坛)

引用回帖:
2楼: Originally posted by wegreen at 2015-04-10 04:26:51
使用dump命令把原子结构输出,用VMD打开看看有没有原子飞出去

谢谢热心回复哇,我已经找到错误了,反射墙放的位置不对
3楼2015-04-11 21:51:04
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wegreen

银虫 (小有名气)

使用dump命令把原子结构输出,用VMD打开看看有没有原子飞出去
2楼2015-04-10 04:26:51
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