[CP2K-user] Large amount of warnings in linear response calculation
Siebe Vanlommel
siebe.v... at ugent.be
Fri Nov 8 14:33:12 UTC 2019
Hi all,
I'm doing a linear response NMR calculation on an aluminosilicate
structure. Everything converges, but at the end of the linear response
calculation, the following error is printed >2000 times:
*** WARNING in dbcsr/dbcsr_api.F:1833 :: You should not add existing
blocks according to old API. ***
The NMR properties are printed out normally in the data files. Full output
is attached. I'm running intel compiled CP2K version 5.1.
Is this a warning which I need to worry about, or can I safely ignore it?
Any help in understanding this is greatly appreciated!
Best regards,
Siebe
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