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#1 2020-01-20 15:49:52
- chucksty
- Member
- From: Cambridge, UK
- Registered: 2019-07-13
- Posts: 26
- Website
[SOLVED] Multiple warnings while runing the Cholesky decomposition
Hi Moolcas Team,
I am running a job with a pretty large basis set for all atoms (ANO-RCC) and have deployed the Cholesky decomposition scheme to deal with previous memory issue I was facing. The job is done now but looking at the log file, I can see a series of warning at different points of the decomposition scheme. I wanted to know if this can be fixed or if it has potentially affected my results.
**************************************************
MEMORY WARNING: use of FLUSH operation deprecated!
please contact the developer of this module and
ask him/her to fix this!
**************************************************Regards
David
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#2 2020-01-20 16:14:26
- Ignacio
- Administrator
- From: Uppsala
- Registered: 2015-11-03
- Posts: 1,202
Re: [SOLVED] Multiple warnings while runing the Cholesky decomposition
No effect on the results.
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#3 2020-01-21 12:37:07
- chucksty
- Member
- From: Cambridge, UK
- Registered: 2019-07-13
- Posts: 26
- Website
Re: [SOLVED] Multiple warnings while runing the Cholesky decomposition
Thanks
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