Match Hartree energy
Commits >
Commit 15b914f6cf8a906b04634cf1151edac44a3f54fa >
Run spack_foss-2022a_cuda_mpi_omp >
Input 16-scfinlcao_std.01-gs.inp
Value | Reference | Precision | Status |
2.713253548410000e+03 | 2.713253548480000e+03 | 1.360000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)