Match Eigenvalues sum
Commits >
Commit b45a8fef6ff6ab58f3c67555688c7395ac2833ed >
Run intel-serial-debug: [intel2023a-serial] >
Input 24-hartree_fock_1D.01-gs.inp
Value | Reference | Precision | Status |
-4.873826427300000e+02 | -4.873826427300000e+02 | 2.440000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Eigenvalues =', 3)