Match Eigenvalues sum
Commits >
Commit f72050fe95608e153e1887ef05d1ad42dc082fde >
Run foss-mpi-debug: [foss2023a-mpi] >
Input 10-fullerene.01-gs.inp
| Value | Reference | Precision | Status |
| -1.076353196300000e+02 | -1.076353197600000e+02 | 4.570000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Eigenvalues =', 3)