Re: [QE-users] [QE-GPU] Ylm out of bounds

[Filippo Spiga]

Dear Daniel,

can you open a bug report here https://gitlab.com/QEF/q-e/-/issues and
provide a input case (+ pseudo) to reproduce the problem?

Thank you

--
Filippo SPIGA ~ http://fspiga.github.io ~ skype: filippo.spiga


On Tue, 2 Nov 2021 at 15:09, Daniel B. Straus  wrote:

> Hello,
>
>
>
> Jobs that ran fine with 6.7 are failing in 6.8 with the following error:
>
>
>
>
> %%
>
>  Error in routine  ylmr (6):
>
>  l>4 => out of bounds in Ylm with CUDA Kernel
>
>
> %%
>
>
>
> I am using the containers published at
> https://ngc.nvidia.com/catalog/containers/hpc:quantum_espresso for both
> 6.7 and 6.8.
>
>
>
> Any ideas?
>
>
>
> Thanks,
>
> Daniel
>
>
>
> --
>
> Daniel Straus
>
> Postdoctoral Research Associate
>
> Department of Chemistry
>
> Princeton University
>
> Frick Laboratory A09
>
> Princeton, NJ 08544
>
> dstr...@princeton.edu
>
>
> ___
> Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
> users mailing list users@lists.quantum-espresso.org
> https://lists.quantum-espresso.org/mailman/listinfo/users
___
Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
users mailing list users@lists.quantum-espresso.org
https://lists.quantum-espresso.org/mailman/listinfo/users

Re: [QE-users] [QE-GPU] Ylm out of bounds

[Pietro Davide Delugas]

Hello
Could you provide more details ?
Regards Pietro

Sent from Mail for Windows

From: Daniel B. Straus
Sent: Tuesday, November 2, 2021 4:09 PM
To: users@lists.quantum-espresso.org
Subject: [QE-users] [QE-GPU] Ylm out of bounds

Hello,

Jobs that ran fine with 6.7 are failing in 6.8 with the following error:

%%
 Error in routine  ylmr (6):
 l>4 => out of bounds in Ylm with CUDA Kernel
%%

I am using the containers published at 
https://ngc.nvidia.com/catalog/containers/hpc:quantum_espresso for both 6.7 and 
6.8.

Any ideas?

Thanks,
Daniel

--
Daniel Straus
Postdoctoral Research Associate
Department of Chemistry
Princeton University
Frick Laboratory A09
Princeton, NJ 08544
dstr...@princeton.edu


___
Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
users mailing list users@lists.quantum-espresso.org
https://lists.quantum-espresso.org/mailman/listinfo/users