Match Total energy
Commits >
Commit c18e6529b073b7f96582e125ea28d09e3ac5067c >
Run spack_foss-2023a_mpi_opt >
Input 24-hartree_fock_1D.01-gs.inp
Value | Reference | Precision | Status |
-4.884828460900000e+02 | -4.884828460900000e+02 | 2.440000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)