Installing Deepmd-Kit + Lammps with Cuda Version 11.1

[AvMach]

Hello,

As I upgraded to a RTX 3080 recently and want to use it for calculations in Lammps with Deepmd and it only supports Cuda 11.1, I want to ask how one should proceed when trying to install it. Is the latest v1.3.2 installer enough as the improvement mentioned: "Compiling with Cuda 11.0 and 11.1 #390" or do I have to do a manual installation?

I tried installing it with the run file but it seems that there is a problem with the installation as an error with Cuda 10.x is specified.

Thank you,

Alex

[njzjz]

For CUDA>=11, publishing a binary version is in our plan. However, currently you have to compile by yourself. I suggest to compile TensorFlow 2.4.1 following the document (this document is for v2.3, but v2.4 should be OK).