Match Hartree energy
Commits >
Commit e2663e21d2b19b776c1ae6497ca3d74f14dbf310 >
Run intel-2022b_impi >
Input 10-vdw_d3_dna.02-gs_d3.inp
Value | Reference | Precision | Status |
3.356159261400000e+02 | 3.356159261400000e+02 | 1.680000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)