Match Hartree energy
Commits >
Commit 7340c9717a63bb8691685536ab6dd281015dc066 >
Run intel_mpi_omp_autotools: [intel2022a-mpi] >
Input 02-ACBN0.02-lif.inp
Value | Reference | Precision | Status |
8.279869789999999e+00 | 8.279869789999999e+00 | 4.140000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)