Performance of the H2O-DFT-LS Benchmark on Cirrus
| Nodes | Cores | Best time (s) | Config |
|---|---|---|---|
| 14 | 504 | 1940.8 | 1 OMP thread per MPI task |
| 28 | 1008 | 1016.0 | 1 OMP thread per MPI task |
| 56 | 2016 | 543.0 | 2 OMP thread per MPI task |
| Nodes | Cores | Best time (s) | Config |
|---|---|---|---|
| 14 | 504 | 1940.8 | 1 OMP thread per MPI task |
| 28 | 1008 | 1016.0 | 1 OMP thread per MPI task |
| 56 | 2016 | 543.0 | 2 OMP thread per MPI task |