Match Eigenvalue 1
Commits >
Commit 1f10c93c74388b17aea6526c581521be8cd6aa14 >
Run spack_intel-2023a_serial >
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)