Match Hartree energy
Commits >
Commit 45adf9b0e5ec0c590d65885bc40efffc0d377767 >
Run foss-ppc: [foss2022a-serial] >
Input 14-fullerene_unpacked.01-gs.inp
Value | Reference | Precision | Status |
3.988937003600000e+03 | 3.988936987400000e+03 | 4.670000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)