Match Hartree energy
Commits >
Commit a52301560213e3c8fdab44f55dc98126fab73840 >
Run GCI_foss_mpi_autotools: [foss2023a-mpi] >
Input 01-nio.01-U5-gs.inp
Value | Reference | Precision | Status |
4.643667759000000e+01 | 4.643667351000000e+01 | 9.860000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)