Match Hartree energy (numerical)
Commits >
Commit 968a3ff7080ffa1f89f08d37efc7416527769dec >
Run intel_mpi_autotools: [intel2023a-mpi] >
Input 05-hartree_3d_fft.04-3d_3d_periodic.inp
| Value | Reference | Precision | Status |
| 3.497836148181827e-01 | 3.497836148185000e-01 | 1.750000000000000e-12 | PASS |
Command: GREPFIELD(hartree_results, 'Hartree Energy (numerical) =', 5)