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Author Topic: Calculation stopped after sometime  (Read 3344 times)

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Offline Inaoton

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Calculation stopped after sometime
« on: November 27, 2017, 08:37 »
hello sir,
                I tried to run a script for geometry optimization using plane wave calculator but it stopped after running for a while. There is no error displayed on the log file . Could you please tell me what is the problem? I have attached the files.
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Offline Petr Khomyakov

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Re: Calculation stopped after sometime
« Reply #1 on: December 19, 2017, 12:44 »
Did you try to run it again? Do you have this problem if you use the LCAO calculator?
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Offline Inaoton

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Re: Calculation stopped after sometime
« Reply #2 on: December 19, 2017, 13:29 »
Yes Sir I tried running again but the same situation.
I have not tried in LCAO
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Offline Ulrik G. Vej-Hansen

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Re: Calculation stopped after sometime
« Reply #3 on: December 19, 2017, 16:55 »
As I answered you in the support channel, I believe it is a memory problem. Please see that e-mail for more information.
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