Match Hartree energy
Commits >
Commit 6dda27ed08cd9fd2b2f861e6109ead2bd6d3cd56 >
Run foss_mpi_opt_autotools: [foss2023a-mpi] >
Input 02-cu2_hgh.02_gs_current.inp
Value | Reference | Precision | Status |
1.109311722100000e+02 | 1.109311722100000e+02 | 5.550000000000000e-08 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)