Match Hartree energy (numerical)
Commits >
Commit 22a7b3628f7ddff53691f80b422d9224cf7a2498 >
Run spack_foss-2022a_cuda_mpi_omp >
Input 05-hartree_3d_fft.05-3d_2d_periodic.inp
Value | Reference | Precision | Status |
3.871004614452603e-01 | 3.871004614453000e-01 | 1.940000000000000e-12 | PASS |
Command: GREPFIELD(hartree_results, 'Hartree Energy (numerical) =', 5)