Match Eigenvalues sum
Commits >
Commit 1a80ca3478da7edc19284ff737aa0abfc175abac >
Run eb_fosscuda-2022a_mpi_omp >
Input 03-sodium_chain.01-ground_state.inp
Value | Reference | Precision | Status |
-3.455996330000000e+00 | -3.455996330000000e+00 | 1.730000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Eigenvalues =', 3)