Match Eigenvalues sum
Commits >
Commit 32ddd3547162625b90bad3fe3e58ca7314bc5873 >
Run eb_foss-2022a_mpi >
Input 03-sodium_chain.03-ground_state_disp.inp
Value | Reference | Precision | Status |
-3.455995440000000e+00 | -3.455995440000000e+00 | 1.730000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Eigenvalues =', 3)