[QE-users] Fail to run an example given in QE tutorial 2022

wangzongyi at mail.ustc.edu.cn wangzongyi at mail.ustc.edu.cn
Fri Feb 23 11:31:05 CET 2024


Thank you for your help. However, your suggestion haven't solve the problem, the calculation environment I use is a supercomputing cloud environment. In this environment, the core is default to be 128, if the number is less then 128, system will regard it as 128. So I can't reduce the cores.

> -----原始邮件-----
> 发件人: "Kazume NISHIDATE" <nisidate at iwate-u.ac.jp>
> 发送时间: 2024-02-23 15:59:00 (星期五)
> 收件人: "Quantum ESPRESSO users Forum" <users at lists.quantum-espresso.org>
> 抄送: 
> 主题: Re: [QE-users] Fail to run an example given in QE tutorial 2022
> 
> Hi, 
> 
> You should reduce the number of cores in the srun.
> Try the following.
> 
> srun -n 2 bands.x <bands.in >bands.out
> 
> 
> > 2024/02/23 16:51、wangzongyi via users <users at lists.quantum-espresso.org>のメール:
> > 
> > srun -n 128 bands.x <bands.in >bands.out
> 
> 
> 
> 
> 
> 西館数芽
> Kazume NISHIDATE Ph.D
> 
> Department of Systems Innovation Engineering,
> Graduate School of Science and Engineering, Iwate University
> 4-3-5 Ueda, Morioka, Iwate, 020-8551 JAPAN
> Phone:+81-19-621-6391
> kazume.nishidate at gmail.com, nisidate at iwate-u.ac.jp
> https://sites.google.com/site/nisidatelab/
> 
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