Match Hartree energy
Commits >
Commit 61d12a07bb2f18211cbe349e5d87c7e10e0bf297 >
Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] >
Input 11-isotopes.01-deuterium.inp
Value | Reference | Precision | Status |
2.955567600000000e-01 | 2.955485500000000e-01 | 3.000000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)