Match Hartree energy (numerical)
Commits >
Commit 995bec41f97239ed4859b75e5397558b96cd16ab >
Run spack_foss-2022a_mpi_min >
Input 05-hartree_3d_fft.04-3d_3d_periodic.inp
Value | Reference | Precision | Status |
3.497836148181824e-01 | 3.497836148185000e-01 | 1.750000000000000e-12 | PASS |
Command: GREPFIELD(hartree_results, 'Hartree Energy (numerical) =', 5)