[Pw_forum] QE-GPU installation help

Dr. NG Siu Pang rollyng at cityu.edu.hk
Sat Oct 24 16:30:39 CEST 2015


Dear all,

I would like to test the GPU acceleration on QE and we have a server with 8x C2050 GPU cards running OpenSuSE 12.3.

I have searched https://github.com/fspiga/QE-GPU, but I found that the latest QE-GPU 14.10.0 is designed for QE 5.1. Since QE-GPU 14.10.0 was dated back to 2014, I am not sure if it works with the latest QE 5.2.1?

So, I would like to have your advice on QE-GPU installation, and these are already installed on OpenSUSE 12.3

1)      CUDA Version: 6.5-14

2)      CUDA Version: 6.0-37

3)      Nvidia graphic driver, Name: nvidia-gfxG03-kmp-desktop, version: 340.65_k3.7.10_1.1-32.1

4)      Nvidia computing driver, Name: nvidia-computeG03, version: 340.65-32.1

Do I need to installed the following Intel tools instead of gcc?

5)      Intel composer_xe_2013 sp1.0.080 (what about the latest version? does it work?)

6)      Intel ifort

7)      Intel MKL

8)      Intel MPI (so MPI is needed to run all 8 GPUs on the server?)

Do I also need scalapack? Where can I get this?

Do I need phigemm? Where can I get this as well?

Thank you very much,
Rolly



Disclaimer: This email (including any attachments) is for the use of the intended recipient only and may contain confidential information and/or copyright material. If you are not the intended recipient, please notify the sender immediately and delete this email and all copies from your system. Any unauthorized use, disclosure, reproduction, copying, distribution, or other form of unauthorized dissemination of the contents is expressly prohibited.
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20151024/2a5f9a63/attachment.html>


More information about the users mailing list