Match Hartree energy
Commits >
Commit 0fe8dcc2cda723db7bfa614b73e6eb662c8bbe1e >
Run foss_cmake: [foss2022a-mpi, foss-min-mpi] >
Input 13-primitive.03-bcc_iron.inp
| Value | Reference | Precision | Status |
| 3.271988088000000e+01 | 3.271988088000001e+01 | 3.270000000000000e-13 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)