Match Hartree energy
Commits >
Commit 701869cc1eb5c6c77a64efba9e1ed1058e4204f9 >
Run foss-parallel: [foss2023a-mpi] >
Input 14-fullerene_unpacked.01-gs.inp
Value | Reference | Precision | Status |
3.988937003310000e+03 | 3.988936987400000e+03 | 4.670000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)