Re: [QE-users] Bug in GPU acceleration of QE7.0

2021-12-29 Thread Filippo Spiga
Dear Xiongyi, could you share a bit more about how you compile and run the calculation? It will be even better if you can you also share the problem (including input case, how you built and how you run) on the QE GitLab to track the bug properly. https://gitlab.com/QEF/q-e/-/issues Thank you

[QE-users] Bug in GPU acceleration of QE7.0

2021-12-28 Thread LEUNG Clarence
Dear QE developers Recently, I run the pw.x with GPU acceleration of QE7.0. And I run the pw.x with Serial version, my gpu is NVIDIA A100. I found that Total Wall time is much larger than Total CPU time as follows: PWSCF: 4d 2h16m CPU 5d 9h56m WALL In addition, I found that