[QE-users] File not found when finding pseudopotential in supercomputer

[Guo, Mr Yiming (Bill) Guo]

Dear QE Expert,

I am a new user of Quantum Espresso and I am currently running my calculations on a supercomputer. However, I have encountered an issue where I keep receiving the following error message:

  file /home/ucecuof/Scratch/pseudo/Forpractice/C.pbe-n-kjpaw_psl.1.0.0.UPF not found

I am certain that the UPF file is located in the specified directory.
[cid:769c8a2b-c370-40a0-b50a-4780f8e3e298]

I am not sure if there is an issue with the file itself or if there is an error in my script.

Below, I have included the relevant file and script. Could you kindly assist me in identifying the problem?

Input File: N-graphene.in

Submission Script: Job_QE

Crash file: Crash

Error File: For-JOB-QE.e148225

I would greatly appreciate your guidance on resolving this issue.

Thank you for your assistance.

Best regards,
Bill(Yiming) Guo



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