Match Hartree energy
Commits >
Commit f2d849ada5a655d1f6759e4d19e0c812b266e6fc >
Run spack_foss-2023a_mpi >
Input 18-TiO2.02-gs_kerker.inp
Value | Reference | Precision | Status |
4.172936841000000e+01 | 4.172936816000000e+01 | 1.910000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)