Match Hartree energy
Commits >
Commit adf3952efd5c2bdc0cc9389163d26498c92cbe64 >
Run foss-mpi-full: [foss2023a-mpi] >
Input 02-cu2_hgh.01_gs.inp
Value | Reference | Precision | Status |
1.254766983800000e+02 | 1.254766984400000e+02 | 6.270000000000000e-08 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)