search

pyscf / gpu4pyscf

A plugin to use Nvidia GPU in PySCF package
GNU General Public License v3.0
117 stars 21 forks source link

compilation: GPU architecture #77

Closed chburger closed 7 months ago

chburger commented 8 months ago

Where would I specify for which GPU architecture the program is compiled?

wxj6000 commented 8 months ago

Here is the solution of compiling for certain architecture. https://github.com/pyscf/gpu4pyscf/issues/65