Match Hartree energy
Commits >
Commit e0b7240ece6c1278a2610f2d337090ca4d2c526d >
Run cmake_foss_2022a_full_mpi >
Input 13-primitive.03-bcc_iron.inp
| Value | Reference | Precision | Status |
| 3.271841312000000e+01 | 3.271841312000000e+01 | 1.640000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)