Match Hartree energy
Commits >
Commit 155f01ef7d18124a1050c3611747e8f8b44bbe31 >
Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] >
Input 03-sodium_chain.01-ground_state.inp
| Value | Reference | Precision | Status |
| -4.551475340000000e+00 | -4.551475340000001e+00 | 2.280000000000000e-08 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)