Match Hartree-Fock eigenvalues sum
Commits >
Commit 45adf9b0e5ec0c590d65885bc40efffc0d377767 >
Run intel_mpi_omp_autotools: [intel2022a-mpi] >
Input 02-xc_2d.02-hf.inp
Value | Reference | Precision | Status |
1.314019460000000e+00 | 1.314019340000000e+00 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(static/info, 'Eigenvalues =', 3)