Extensions.CreateHartreeFockState(FermionHamiltonian, Int32) Method

Reference

Definition

Namespace:: Microsoft.Quantum.Chemistry.Fermion

Assembly:: Microsoft.Quantum.Chemistry.DataModel.dll

Package:: Microsoft.Quantum.Chemistry.DataModel v0.25.218240

Important

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This approximates the Hamiltonian ground state by a greedy algorithm
that minimizes only the PP term energies. If there are no PP terms, states will be occupied in lexicographic order.

public static Microsoft.Quantum.Chemistry.Fermion.FermionWavefunction<int> CreateHartreeFockState (this Microsoft.Quantum.Chemistry.Fermion.FermionHamiltonian hamiltonian, int nElectrons);

static member CreateHartreeFockState : Microsoft.Quantum.Chemistry.Fermion.FermionHamiltonian * int -> Microsoft.Quantum.Chemistry.Fermion.FermionWavefunction<int>

<Extension()>
Public Function CreateHartreeFockState (hamiltonian As FermionHamiltonian, nElectrons As Integer) As FermionWavefunction(Of Integer)

Parameters

hamiltonian: FermionHamiltonian

nElectrons: Int32

Returns

FermionWavefunction<Int32>

Greedy trial state for minimizing Hamiltonian diagonal one-electron energy.

Applies to