qe-gpu-6.4.1a1 New minor release mostly containing bug fixes.
This release aligns the GPU accelerated version with Quantum ESPRESSO v6.4.1.
- Updated GPU Eigensolver version
- Fixed allocation of duplicated variables in
- Temporary workaround for a memory access problem in
addusdens_gpuleading to invalid memory access when running the parallel version with 1 MPI.
qe-gpu-6.4a1 This is the first public alpha release of the GPU accelerated version of the Quantum ESPRESSO suite of codes.
This is the first alpha release of Quantum ESPRESSO GPU, the GPU accelerated version of the Quantum ESPRESSO suite of codes.
This release provides an accelerated version of the
pw.xcode. The other applications have not been ported yet, but will likely be added in future. The GPU accelerated
pw.xis fully compatible with the CPU only executable. It accepts the same inputs and options and can be used to restart simulations performed with the CPU only version. Please refer to the project wiki for more information.