Match External energy
Commits >
Commit c7ac96946c926bee5c46ca4221093c1f60753f5a >
Run spack_foss-2023a_mpi_omp >
Input 31-acetylene_b3lyp.01-gs.inp
Value | Reference | Precision | Status |
-5.378242106000000e+01 | -5.378242078000000e+01 | 3.030000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'External =', 3)