Match Hartree energy
Commits >
Commit 98d0ca144537205e7b2aa0b44074de55ddb8c97d >
Run foss_cuda_autotools: [foss2022a-cuda-mpi] >
Input 01-nio.01-U5-gs.inp
Value | Reference | Precision | Status |
6.828467830000000e+01 | 6.828467787000000e+01 | 4.730000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)