Match Total energy
Commits >
Commit 7a2cd2a0801cf0c9aaf759ff5aac90b0fe91b5f6 >
Run spack_foss-2023a_mpi_omp >
Input 04-lithium.01-ground_state.inp
Value | Reference | Precision | Status |
-4.178845380000000e+00 | -4.178845955000000e+00 | 8.500000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)