Match Hartree energy
Commits >
Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc >
Run autotools_intel_mpi_omp: [intel2023a-mpi] >
Input 03-ACBN0_restricted.02-lif_unpacked.inp
Value | Reference | Precision | Status |
8.278887590000000e+00 | 8.278887590000000e+00 | 4.140000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)