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caleb-johnson committed Jul 10, 2023
1 parent 1f78313 commit 35110be
Showing 1 changed file with 6 additions and 2 deletions.
8 changes: 6 additions & 2 deletions test/forging/test_entanglement_forging_ground_state_solver.py
Original file line number Diff line number Diff line change
Expand Up @@ -88,10 +88,14 @@ def test_fixed_hf_h2o(self):
orb_act = list(range(0, 5))
num_alpha = num_beta = 3
hcore = np.load(
os.path.join(os.path.dirname(__file__), "test_data", "H2O_0.90_one_body.npy"),
os.path.join(
os.path.dirname(__file__), "test_data", "H2O_0.90_one_body.npy"
),
)
eri = np.load(
os.path.join(os.path.dirname(__file__), "test_data", "H2O_0.90_two_body.npy"),
os.path.join(
os.path.dirname(__file__), "test_data", "H2O_0.90_two_body.npy"
),
)
hamiltonian = ElectronicEnergy.from_raw_integrals(hcore, eri)
hamiltonian.nuclear_repulsion_energy = -61.57756706745154
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