Match LUMO+5
Commits >
Commit f72050fe95608e153e1887ef05d1ad42dc082fde >
Run foss-serial-min: [foss2022a-serial] >
Input 01-casida.04-unocc_restart.inp
Value | Reference | Precision | Status |
4.542300000000000e-02 | 4.542300000000000e-02 | 2.270000000000000e-05 | PASS |
Command: GREPFIELD(static/eigenvalues, '11 --', 3)