Match Eigenvalue 1
Commits >
Commit f72050fe95608e153e1887ef05d1ad42dc082fde >
Run foss-mpi-min: [foss2023a-mpi] >
Input 31-acetylene_b3lyp.01-gs.inp
Value | Reference | Precision | Status |
-7.571590000000000e-01 | -7.571610000000000e-01 | 3.790000000000000e-05 | PASS |
Command: GREPFIELD(static/info, ' 1 --', 3)