Match Hartree energy
Commits >
Commit 23cadfdc08b3b148a9c434cb52e4be78ff32991e >
Run foss_mpi_min_autotools: [foss2022a-mpi] >
Input 22-vdw_d3_stress.01-Be_hpc.inp
Value | Reference | Precision | Status |
2.826117280000000e+00 | 2.826117240000000e+00 | 1.410000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)