Match Hartree energy (numerical)
Commits >
Commit 94d58911903c32860449c62a795f2d74d19217f9 >
Run intel_mpi_omp_autotools: [intel2022a-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)