Match Hartree energy
Commits >
Commit e2663e21d2b19b776c1ae6497ca3d74f14dbf310 >
Run intel-2022a_impi >
Input 01-nio.01-U5-gs.inp
Value | Reference | Precision | Status |
4.641776804000000e+01 | 4.641776690000000e+01 | 7.890000000000001e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)