Match LUMO+5
Commits >
Commit 4104ea28a473696fae3c7fad4406bf86d5f6976c >
Run foss-mpi-debug: [foss2023a-mpi] >
Input 01-casida.03-unocc.inp
Value | Reference | Precision | Status |
4.542300000000000e-02 | 4.542300000000000e-02 | 2.270000000000000e-05 | PASS |
Command: GREPFIELD(static/eigenvalues, '11 --', 3)