Match Eigenvalue 5
Commits >
Commit 6e9e1a4536d8fe2a292bd24d601ed608cb4be1e6 >
Run intel_mpi_omp_autotools: [intel2022a-mpi] >
Input 31-acetylene_b3lyp.01-gs.inp
Value | Reference | Precision | Status |
-2.990350000000000e-01 | -2.990300000000000e-01 | 1.500000000000000e-04 | PASS |
Command: GREPFIELD(static/info, ' 5 --', 3)