MWChem long

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Tullio

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Message 1161 - Posted: 1 Nov 2020, 5:20:41 UTC

Got 6 MWChem long tasks. Three completed and validated giving me 5000 credits each, one ended in Computing errror, one Validated error and I cut short one because it was going for a too long time.My PC is a Windows 10 PC with Intel i5 9400F CPU and 12 GMB RAM.
Tullio
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Tullio

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Message 1162 - Posted: 1 Nov 2020, 7:25:55 UTC - in response to Message 1161.  

Sorry, NWChem long.
Tullio
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damotbe
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Message 1167 - Posted: 2 Nov 2020, 14:49:01 UTC - in response to Message 1162.  

NWChem long are very hard and very umpredictable tasks. Thank you for your help!
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Tullio

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Message 1168 - Posted: 2 Nov 2020, 16:40:43 UTC - in response to Message 1167.  

I have been using Virtual Box since 2010 on CERN programs, even when using Linux, since CERN uses a Scientfic Linux with CERN Libraries that are not in most Linux distributions. Now I am older and use Windows also.
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SolidAir79

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Message 1430 - Posted: 10 Jun 2021, 12:05:50 UTC

Sorry hijacking the thread a little. When will there be more long wu's available ?
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damotbe
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Message 1435 - Posted: 19 Jun 2021, 15:26:14 UTC - in response to Message 1430.  

This special experiment is over. The next step imply real chemists to look at the results to select few candidates for synthesis and evaluation. there are no more calculations planned at this time. If we have other projects like this one, we will not hesitate to share with you.

Thank you for your help !
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Message boards : Number crunching : MWChem long

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