Match Eigenvalues sum
Commits >
Commit 968a3ff7080ffa1f89f08d37efc7416527769dec >
Run foss_autotools: [foss2023a-serial] >
Input 03-sodium_chain.01-ground_state.inp
Value | Reference | Precision | Status |
-3.455995550000000e+00 | -3.455995490000000e+00 | 1.730000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Eigenvalues =', 3)