Match Hartree energy
Commits >
Commit 23cadfdc08b3b148a9c434cb52e4be78ff32991e >
Run foss_mpi_autotools: [foss2023a-mpi] >
Input 08-benzene_supercell.01-gs.inp
Value | Reference | Precision | Status |
3.146027821000000e+01 | 3.146027821000000e+01 | 1.570000000000000e-09 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)