Match Hartree energy
Commits >
Commit 08b73ec86c1ce3969ff61040f8f54a592910f9b6 >
Run cmake_foss_2022a_full_mpi >
Input 04-ACBN0_isolated.01-H_unpacked.inp
Value | Reference | Precision | Status |
3.080899600000000e-01 | 3.080899600000000e-01 | 1.540000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)