Match Hartree energy
Commits >
Commit e2663e21d2b19b776c1ae6497ca3d74f14dbf310 >
Run intel-2022b >
Input 20-masked_periodic_boundaries.01-graphene.inp
Value | Reference | Precision | Status |
-9.655118330000001e+00 | -9.655118330000001e+00 | 4.830000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)