Match Hartree energy
Commits >
Commit 45adf9b0e5ec0c590d65885bc40efffc0d377767 >
Run foss-mpi-min: [foss2023a-mpi] >
Input 10-helium_upf.03-gs_filter_bsb.inp
Value | Reference | Precision | Status |
1.984577640000000e+00 | 1.984576070000000e+00 | 5.000000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)