Match Eigenvalue 1
Commits >
Commit 42d5c2c12b8376ac01df1778205b77ce6ca96480 >
Run spack_foss-2023a_serial_min >
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)