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Physical Review B

Linear combination of harmonic orbitals and configuration interaction method for the voltage control of exchange interaction in gated lateral quantum dot networks

Irene Puerto Gimenez, Marek Korkusiński, Paweł Hawrylak

Published Aug 21, 2007• 30 citations
Publisher

Abstract

We present a computational LCHO-CI approach allowing for the simulation of exchange interactions in gated lateral quantum dot networks. The approach is based on single-particle states calculated using a linear combination of harmonic orbitals (LCHOs) of each of the dots and a configuration interaction (CI) approach to the interacting electron problem. The LCHO-CI method is applied to a network of three quantum dots with one-electron spin per dot, and a Heisenberg spin Hamiltonian is derived. The manipulation of spin states of a three-spin molecule by applying bias to one of the dots is demonstrated and related to the bias dependence of effective exchange interaction parameters.

DOI
10.1103/physrevb.76.075336

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We present a computational LCHO-CI approach allowing for the simulation of exchange interactions in gated lateral quantum dot networks. The approach is based on single-particle states calculated using a linear combination of harmonic orbitals (LCHOs) of each of the dots and a configuration interaction (CI) approach to the interacting electron problem. The LCHO-CI method is applied to a network of three quantum dots with one-electron spin per dot, and a Heisenberg spin Hamiltonian is derived. The manipulation of spin states of a three-spin molecule by applying bias to one of the dots is demonstrated and related to the bias dependence of effective exchange interaction parameters.
We present a computational LCHO-CI approach allowing for the simulation of exchange interactions in gated lateral quantum dot networks. The approach is based on single-particle states calculated using a linear combination of harmonic orbitals (LCHO) of each of the dots, and a configuration interaction (CI) approach to the interacting electron problem. The LCHO-CI method is applied to a network of three quantum dots with one electron spin per dot, and a Heisenberg spin Hamiltonian is derived. The manipulation of spin states of a three-spin molecule by applying bias to one of the dots is demonstrated and related to the bias dependence of effective exchange interaction parameters.
We present a method of changing the effective spin-spin interactions of electrons localized in quantum dot molecules from antiferromagnetic to ferromagnetic using electrical means. We show that starting with antiferromagnetic interaction of two electrons localized in two quantum dots, the effective spin-spin interaction can change to ferromagnetic by allowing interaction with a third dot containing two spin singlet electrons. The total spin of this four-electron complex can be tuned by changing the third dot potential from singlet to triplet. This is demonstrated using the linear combination of harmonic orbitals combined with the configuration-interaction method mapped onto the Hubbard and an effective $t\text{\ensuremath{-}}J$ model for the triple dot system. All three approaches predict singlet-triplet spin transition, i.e., a mechanism for changing the magnitude and sign of the effective Heisenberg interaction between two localized spins.
We perform time-dependent simulations of spin exchange for an electron pair in laterally coupled quantum dots. The calculation is based on configuration interaction scheme accounting for spin-orbit (SO) coupling and electron-electron interaction in a numerically exact way. Noninteracting electrons exchange orientations of their spins in a manner that can be understood by interdot tunneling associated with spin precession in an effective SO magnetic field that results in anisotropy of the spin swap. The Coulomb interaction blocks the electron transfer between the dots but the spin transfer and spin precession due to SO coupling is still observed. The electron-electron interaction additionally induces an appearance of spin components in the direction of the effective SO magnetic field which are opposite in both dots. Simulations indicate that the isotropy of the spin swap is restored for equal Dresselhaus and Rashba constants and properly oriented dots.
In this thesis, I present a microscopic theory of quantum circuits based on interacting electron spins in quantum dot molecules. We use the Linear Combination of Harmonic Orbitals-Configuration Interaction (LCHO-CI) formalism for microscopic calculations. We then derive effective Hubbard, t-J, and Heisenberg models. These models are used to predict the electronic, spin and transport properties of a triple quantum dot molecule (TQDM) as a function of topology, gate configuration, bias and magnetic field. With these theoretical tools and fully characterized TQDMs, we propose the following applications: 1. Voltage tunable qubit encoded in the chiral states of a half-filled TQDM. We show how to perform single qubit operations by pulsing voltages. We propose the "chirality-to-charge" conversion as the measurement scheme and demonstrate the robustness of the chirality-encoded qubit due to charge fluctuations. We derive an effective qubit-qubit Hamiltonian and demonstrate the two-qubit gate. This provides all the necessary operations for a quantum computer built with chirality-encoded qubits. 2. Berry's phase. We explore the prospect of geometric quantum computing with chirality-encoded qubit. We construct a Herzberg circuit in the voltage space and show the accumulation of Berry's phase. 3. Macroscopic quantum states on a semiconductor chip. We consider a linear chain of TQDMs, each with 4 electrons, obtained by nanostructuring a metallic gate in a field effect transistor. We theoretically show that the low energy spectrum of the chain maps onto that of a spin-1 chain. Hence, we show that macroscopic quantum states, protected by a Haldane gap from the continuum, emerge. In order to minimize decoherence of electron spin qubits, we consider using electron spins in the p orbitals of the valence band (valence holes) as qubits. We develop a theory of valence hole qubit within the 4-band k.p model. We show that static magnetic fields can be used to perform single qubit operations. We also show that the qubit-qubit interactions are sensitive to the geometry of a quantum dot network. For vertical qubit arrays, we predict that there exists an optimal qubit separation suitable for the voltage control of qubit-qubit interactions.
We propose a method for quantum computation which uses control of spin-orbit coupling in a linear array of single electron quantum dots. Quantum gates are carried out by pulsing the exchange interaction between neighboring electron spins, including the anisotropic corrections due to spin-orbit coupling. Control over these corrections, even if limited, is sufficient for universal quantum computation over qubits encoded into pairs of electron spins. The number of voltage pulses required to carry out either single-qubit rotations or controlled-Not gates scales as the inverse of a dimensionless measure of the degree of control of spin-orbit coupling.
We present a general model to study the spin-state transition in a network of singly occupied lateral quantum dots. The perturbative expansion of the extended Hubbard model is used to describe the dynamics of confined electrons as an effective spin Hamiltonian in the strong correlation regime. To optimize the transition, we apply the gradient ascent pulse engineering algorithm to control the exchange couplings constrained to the manifolds evaluated by Heitler-London approximation. The method is applicable to an arbitrary number of quantum dots in any arrangement. Results of the method applied to the case of triple quantum dot are presented for linear and triangular topologies.