Match Hartree energy
Commits >
Commit 917d830e9234ff154f8a96d6b6c157a89a03a450 >
Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] >
Input 18-TiO2.02-gs_kerker.inp
Value | Reference | Precision | Status |
4.172762507000000e+01 | 4.172762507000000e+01 | 2.090000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)