Match Hartree energy
Commits >
Commit 2cbd57b62c972cb2ebea8f328fb20b62d521e0ac >
Run spack_foss-2022a_mpi >
Input 13-primitive.01-diamond.inp
Value | Reference | Precision | Status |
1.000014420000000e+00 | 1.000000000000000e+00 | 5.000000000000000e+00 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)