Match Hartree energy
Commits >
Commit 1f10c93c74388b17aea6526c581521be8cd6aa14 >
Run spack_foss-2023a_serial_debug >
Input 10-fullerene.01-gs.inp
| Value | Reference | Precision | Status |
| 3.954895211040000e+03 | 3.954895210660000e+03 | 4.180000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)