Match Hartree energy
Commits >
Commit d89ed1adec8f63937926022ba961c15ddb98b66b >
Run foss-ppc: [foss2022a-serial] >
Input 01-nio.01-U5-gs.inp
| Value | Reference | Precision | Status |
| 6.828467744000000e+01 | 6.828467787000000e+01 | 4.730000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)