Match Hartree-Fock exchange energy
Commits >
Commit 6fea4ae0129736a1dfe4fc8183ca68b9f7403b45 >
Run intel_mpi_autotools: [intel2023a-mpi] >
Input 02-xc_2d.02-hf.inp
Value | Reference | Precision | Status |
-6.700426200000000e-01 | -6.700426400000000e-01 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(static/info, 'Exchange =', 3)