Match Hartree energy
Commits >
Commit f8aeac8acec97cad57d0dc81a915c34dc5591a3a >
Run intel_mpi_autotools: [intel2023a-mpi] >
Input 10-intersite.02-silicon.inp
Value | Reference | Precision | Status |
1.729323224000000e+01 | 1.729323236000000e+01 | 1.900000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)