Match Total energy
Commits >
Commit 4eed2c655b9f478fca43a397c5feb863f7436add >
Run spack_foss-2022a_cuda_mpi_omp >
Input 04-lithium.01-ground_state.inp
Value | Reference | Precision | Status |
-4.178845430000000e+00 | -4.178845955000000e+00 | 8.500000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)