[QE-developers] [QE-GPU] Quantum ESPRESSO in Google Colab

Yuvam Bhateja yuvamb16 at gmail.com
Mon May 25 11:42:45 CEST 2020


Hey,
We all know that Google colab provides free GPU. Can we use QE in Google
colab with GPU acceleration?
I installed pgi compiler and cuda and was successfully in configuring and
making the original qe-gpu at github in Google colab through bash commands.
But on putting input like....
/qe-gpu/bin/pw.x < si.scf.in > si.scf.out
And
With -inp si.scf.in > si.scf.out

It says.... Something like unknown symbol for system.

Can anyone please help?
I really want to accelerate my QE calculation through GPU.

Regards
Yuvam Bhateja
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