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
