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qiskit.chemistry.components.variational_forms.CHC

class CHC(num_qubits=None, reps=1, ladder=False, excitations=None, entanglement='full', initial_state=None)

GitHub

This trial wavefunction is the Compact Heuristic for Chemistry.

The trial wavefunction is as defined in Ollitrault Pauline J., Chemical science 11 (2020): 6842-6855. It aims at approximating the UCC Ansatz for a lower CNOT count.

Note

It is not particle number conserving and the accuracy of the approximation decreases with the number of excitations.

Parameters

  • num_qubits (Optional[int]) – number of qubits
  • reps (int) – number of replica of basic module
  • ladder (bool) – use ladder of CNOTs between to indices in the entangling block
  • excitations (Optional[List[List[int]]]) – indices corresponding to the excitations to include in the circuit
  • entanglement (Union[str, List[int]]) – physical connections between the qubits
  • initial_state (Union[QuantumCircuit, InitialState, None]) – an initial state to prepend to the variational form

__init__

__init__(num_qubits=None, reps=1, ladder=False, excitations=None, entanglement='full', initial_state=None)

Parameters

  • num_qubits (Optional[int]) – number of qubits
  • reps (int) – number of replica of basic module
  • ladder (bool) – use ladder of CNOTs between to indices in the entangling block
  • excitations (Optional[List[List[int]]]) – indices corresponding to the excitations to include in the circuit
  • entanglement (Union[str, List[int]]) – physical connections between the qubits
  • initial_state (Union[QuantumCircuit, InitialState, None]) – an initial state to prepend to the variational form

Methods

__init__([num_qubits, reps, ladder, …])type num_qubitsOptional[int]
construct_circuit(parameters[, q])Construct the variational form, given its parameters.
get_entangler_map(map_type, num_qubits[, offset])returns entangler map
validate_entangler_map(entangler_map, num_qubits)validate entangler map

Attributes

num_parametersNumber of parameters of the variational form.
num_qubitsNumber of qubits of the variational form.
parameter_boundsParameter bounds.
preferred_init_pointsReturn preferred init points.
setting
support_parameterized_circuitWhether or not the sub-class support parameterized circuit.

construct_circuit

construct_circuit(parameters, q=None)

Construct the variational form, given its parameters.

Parameters

  • parameters (Union[ndarray, List[Parameter], ParameterVector]) – circuit parameters
  • q (Optional[QuantumRegister]) – Quantum Register for the circuit.

Returns

a quantum circuit with given parameters

Return type

QuantumCircuit

Raises

  • ValueError – the number of parameters is incorrect.
  • ValueError – if num_qubits has not been set and is still None
  • ValueError – only supports single and double excitations at the moment.

get_entangler_map

static get_entangler_map(map_type, num_qubits, offset=0)

returns entangler map

num_parameters

Number of parameters of the variational form.

Returns

An integer indicating the number of parameters.

Return type

int

num_qubits

Number of qubits of the variational form.

Returns

An integer indicating the number of qubits.

Return type

int

parameter_bounds

Parameter bounds.

Returns

A list of pairs indicating the bounds, as (lower, upper). None indicates an unbounded parameter in the corresponding direction. If None is returned, problem is fully unbounded.

Return type

list

preferred_init_points

Return preferred init points.

If an initial state is provided then the variational form may provide back this set of parameters which when used on the variational form should result in the overall state being that defined by the initial state

setting

support_parameterized_circuit

Whether or not the sub-class support parameterized circuit.

Returns

indicate the sub-class support parameterized circuit

Return type

boolean

validate_entangler_map

static validate_entangler_map(entangler_map, num_qubits)

validate entangler map

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