# Molecular orbital for Hamiltonian generation#

You can set the molecular orbital directly here for Hamiltonian generation.

• `mo_coeff`: coefficients of the basis function for each molecular orbital (inner list: coefficients of the basis function for each molecular orbital, outer list: molecular orbitals).

```"molecular_orbital_for_hamiltonian_generation":
"mo_coeff": [
[
0.5445586947820809,
1.2620659398031695
],
[
0.5445586947820809,
-1.2620659398031695
]
],
```