Match Hubbard energy
Commits >
Commit 3874475d54e6d4931162c1a62f5667add8f8f561 >
Run intel_autotools: [intel2023a-serial] >
Input 10-intersite.02-silicon.inp
Value | Reference | Precision | Status |
5.415812080000000e+00 | 5.415811560000000e+00 | 5.390000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hubbard =', 3)