Match Hartree energy
Commits >
Commit 4ba99df89cd19114311b0fcb367f44d4f4e26fb8 >
Run cuda-mpi-omp: [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)