Match Hartree energy
Commits >
Commit 4104ea28a473696fae3c7fad4406bf86d5f6976c >
Run foss_cuda_autotools: [foss2022a-cuda-mpi] >
Input 13-primitive.02-graphene.inp
Value | Reference | Precision | Status |
-1.128225426000000e+01 | -1.128225359000000e+01 | 7.150000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)