Match Hartree energy
Commits >
Commit fa579c158b779976d5f0fa5d04f6d011c21f022f >
Run spack_foss-2022a_cuda_mpi_omp >
Input 18-TiO2.02-gs_kerker.inp
Value | Reference | Precision | Status |
4.172936840000000e+01 | 4.172936816000000e+01 | 1.910000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)