Match Total energy
Commits >
Commit babc485c55a2119a415aa56305cb49f398154cb7 >
Run spack_foss-2022a_mpi_opt >
Input 31-acetylene_b3lyp.01-gs.inp
| Value | Reference | Precision | Status |
| -1.333925467000000e+01 | -1.333925462000000e+01 | 6.670000000000000e-08 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)