Match Eigenvalue 6
Commits >
Commit 7a2379c5947d58fb2522a5e1a0c4903dfa35a523 >
Run spack_foss-2023a_mpi_omp >
Input 31-acetylene_b3lyp.01-gs.inp
Value | Reference | Precision | Status |
2.811100000000000e-02 | 2.811100000000000e-02 | 1.410000000000000e-05 | PASS |
Command: GREPFIELD(static/info, ' 6 --', 3)