Match Hartree-Fock energy Total
Commits >
Commit db5a37a45dcf968be97880dd1f5766f32ce63f3a >
Run intel_mpi_omp_autotools: [intel2022a-mpi] >
Input 03-xc.01-gs.inp
Value | Reference | Precision | Status |
-7.075616800000000e-01 | -7.075695600000000e-01 | 8.729999999999999e-06 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)