Match Eigenvalues sum
Commits >
Commit 42d5c2c12b8376ac01df1778205b77ce6ca96480 >
Run spack_intel-2023a_serial >
Input 03-sodium_chain.01-ground_state.inp
Value | Reference | Precision | Status |
-3.455995480000000e+00 | -3.455995490000000e+00 | 1.730000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Eigenvalues =', 3)