[QE-users] phonon problem

[Stefano Baroni]

👏
—
Stefano Baroni - Trieste —  http://stefano.baroni.me




On 11 Dec 2024, at 15:52, Kazume NISHIDATE <nisidate at iwate-u.ac.jp> wrote:

Dear 2400169 at stu.neu.edu.cn <mailto:2400169 at stu.neu.edu.cn>,

We are not a FAQ page or an AI machine.

You should provide your input data as much as possible if you want advice from experts worldwide.


Sincerely yours,


2024/12/11 22:47、2400169 at stu.neu.edu.cnのメール:

I encountered an issue while performing phonon calculations. When running the calculation, I received the following error message:

  Error in routine potinit (1):
    starting and expected charges differ




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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/

________________________________________
The Quantum ESPRESSO Foundation stands in solidarity with all civilians worldwide who are victims of terrorism, military aggression, and indiscriminate warfare.
----------------------------------------
Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
users mailing list users at lists.quantum-espresso.org
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