| 查看: 1424 | 回复: 2 | ||
| 当前只显示满足指定条件的回帖，点击这里查看本话题的所有回帖 | ||
xjz_zjx木虫 (正式写手)
|
[求助]
请教vasp中CI-NEB编译问题
|
|
|
最近想用vasp中CI-NEB计算一些催化反应，按照VTST.Tools网页上给的code和tools以及guide进行了编辑，nebmake.pl能够正常插入images，但是进行频率计算时，出现下面问题，麻烦各位指点指点，多谢。 mpirun has exited due to process rank 19 with PID 31087 on node zjx10 exiting improperly. There are two reasons this could occur: 1. this process did not call "init" before exiting, but others in the job did. This can cause a job to hang indefinitely while it waits for all processes to call "init". By rule, if one process calls "init", then ALL processes must call "init" prior to termination. 2. this process called "init", but exited without calling "finalize". By rule, all processes that call "init" MUST call "finalize" prior to exiting or it will be considered an "abnormal termination" This may have caused other processes in the application to be terminated by signals sent by mpirun (as reported here). -------------------------------------------------------------------------- |
回复此楼» 猜你喜欢
为什么网上很多人说本周 12号出结果
已经有4人回复
-
基金中了
已经有15人回复
-
帮忙看看fileCode
已经有8人回复
-
小木虫上这么多卖论文的，真有人买论文么？感觉没必要啊
已经有3人回复
-
FileCode能看出啥？
已经有15人回复
-
filecode
已经有8人回复
-
确定了，国自然21号放榜
已经有7人回复
-
综述论文作为代表作会不会影响评审专家的印象分？
已经有11人回复
-
关于代码变化问题，想知道的进来
已经有24人回复
-
静等基金结果
已经有16人回复
3楼2017-02-13 12:46:46
2楼2016-11-18 00:39:54
100