Match Hartree energy
Commits >
Commit 9bb80dbc43fc7b1ccbcadf899a686fb8cb0164a9 >
Run intel-2022b >
Input 10-helium_upf.01-gs_nofilter.inp
Value | Reference | Precision | Status |
2.003281340000000e+00 | 2.003281330000000e+00 | 1.000000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)