Match Hartree energy (numerical)
Commits >
Commit 65c9d1acfcf72851dda73eaed77edd797333194c >
Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] >
Input 10-hartree_pfft.04-3d_3d_periodic.inp
| Value | Reference | Precision | Status |
| 3.497836148181825e-01 | 3.497836148185000e-01 | 1.750000000000000e-12 | PASS |
Command: GREPFIELD(hartree_results, 'Hartree Energy (numerical) =', 5)