Match Eigenvalue 1
Commits >
Commit daa93de2f371acc02c8ba320d7b5759725cfd1f4 >
Run eb_fosscuda-2022a >
Input 31-acetylene_b3lyp.01-gs.inp
| Value | Reference | Precision | Status |
| -7.571610000000000e-01 | -7.571610000000000e-01 | 3.790000000000000e-05 | PASS |
Command: GREPFIELD(static/info, ' 1 --', 3)