On Tue, Apr 04, 2023, Freddy Bernal via AMBER wrote:
>
>
> Thanks for the answer. I'm running Amber22 under Ubuntu 20.04.5 LTS with
> two GPU cards Nvidia Quadro P5000. As for compilers, the system is using
> cuda 11.2.2, gcc 4:9.3.0, gfortran 4:9.3.0, GNU Make 4.2.1.
>
We have seen occasional problems using gnu 9.x compilers; you might try
installing gcc10 or gcc11 to see if that helps.
It's also possible that there is some problem with the Quadro P5000 cards.
Do you have the ability to test on different hardware?
...regards...dac
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Received on Wed Apr 05 2023 - 14:30:02 PDT
