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14 changes: 13 additions & 1 deletion src/mqt/yaqs/core/methods/tdvp.py
Original file line number Diff line number Diff line change
Expand Up @@ -519,8 +519,9 @@ def two_site_tdvp(
left_identity[i, a, i] = 1
left_blocks[0] = left_identity

# Adjust simulation time step if simulation parameters require a unit time step.
if isinstance(sim_params, (WeakSimParams, StrongSimParams)):
sim_params.dt = 1
sim_params.dt = 2

# Left-to-right sweep for sites 0 to L-2.
for i in range(num_sites - 2):
Expand All @@ -544,12 +545,23 @@ def two_site_tdvp(
numiter_lanczos,
)

# Guarantees unit time at final site for circuits
if isinstance(sim_params, (WeakSimParams, StrongSimParams)):
sim_params.dt = 1

i = num_sites - 2
merged_tensor = merge_mps_tensors(state.tensors[i], state.tensors[i + 1])
merged_mpo = merge_mpo_tensors(hamiltonian.tensors[i], hamiltonian.tensors[i + 1])
merged_tensor = update_site(
left_blocks[i], right_blocks[i + 1], merged_mpo, merged_tensor, sim_params.dt, numiter_lanczos
)
# Only a single sweep is needed for circuits
if isinstance(sim_params, (WeakSimParams, StrongSimParams)):
state.tensors[i], state.tensors[i + 1] = split_mps_tensor(
merged_tensor, "right", threshold=sim_params.threshold
)
return

state.tensors[i], state.tensors[i + 1] = split_mps_tensor(merged_tensor, "left", threshold=sim_params.threshold)
right_blocks[i] = update_right_environment(
state.tensors[i + 1], state.tensors[i + 1], hamiltonian.tensors[i + 1], right_blocks[i + 1]
Expand Down
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