Match Hartree energy
Commits >
Commit 6dda27ed08cd9fd2b2f861e6109ead2bd6d3cd56 >
Run foss_mpi_autotools: [foss2023a-mpi] >
Input 25-Fe_polarized.01-gs.inp
Value | Reference | Precision | Status |
6.510589229999999e+01 | 6.510589381000000e+01 | 3.000000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)