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arXiv:quant-ph/9911080 · Physical Review A

Hilbert-space structure of a solid-state quantum computer: Two-electron states of a double-quantum-dot artificial molecule

Xuedong Hu, S. Das Sarma

Published May 3, 2000• 368 citations
arXivHTMLPDF

Abstract

We theoretically study a double-quantum-dot hydrogen molecule in the GaAs conduction band as the basic elementary gate for a quantum computer, with the electron spins in the dots serving as qubits. Such a two-dot system provides the necessary two-qubit entanglement required for quantum computation. We determine the excitation spectrum of two horizontally coupled quantum dots with two confined electrons, and study its dependence on an external magnetic field. In particular, we focus on the splitting of the lowest singlet and triplet states, the double occupation probability of the lowest states, and the relative energy scales of these states. We point out that at zero magnetic field it is difficult to have both a vanishing double occupation probability for a small error rate and a sizable exchange coupling for fast gating. On the other hand, finite magnetic fields may provide finite exchange coupling for quantum computer operations with small errors. We critically discuss the applicability of the envelope-function approach in the current scheme, and also the merits of various quantum-chemical approaches in dealing with few-electron problems in quantum dots, such as the Hartree-Fock self-consistent-field method, the molecular-orbital method, the Heisenberg model, and the Hubbard model. We also discuss a number of relevant issues in quantum dot quantum computing in the context of our calculations, such as the required design tolerance, spin decoherence, adiabatic transitions, magnetic-field control, and error correction.

DOI
10.1103/physreva.61.062301

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We theoretically study a double-quantum-dot hydrogen molecule in the GaAs conduction band as the basic elementary gate for a quantum computer, with the electron spins in the dots serving as qubits. Such a two-dot system provides the necessary two-qubit entanglement required for quantum computation. We determine the excitation spectrum of two horizontally coupled quantum dots with two confined electrons, and study its dependence on an external magnetic field. In particular, we focus on the splitting of the lowest singlet and triplet states, the double occupation probability of the lowest states, and the relative energy scales of these states. We point out that at zero magnetic field it is difficult to have both a vanishing double occupation probability for a small error rate and a sizable exchange coupling for fast gating. On the other hand, finite magnetic fields may provide finite exchange coupling for quantum computer operations with small errors. We critically discuss the applicability of the envelope-function approach in the current scheme, and also the merits of various quantum-chemical approaches in dealing with few-electron problems in quantum dots, such as the Hartree-Fock self-consistent-field method, the molecular-orbital method, the Heisenberg model, and the Hubbard model. We also discuss a number of relevant issues in quantum dot quantum computing in the context of our calculations, such as the required design tolerance, spin decoherence, adiabatic transitions, magnetic-field control, and error correction.
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We calculate the effect of an inhomogeneous magnetic field, which is invariably present in an experimental environment, on the exchange energy of a double-quantum-dot artificial molecule, projected to be used as a two-qubit quantum gate in the proposed quantum-dot quantum computer. We use two different theoretical methods to calculate the Hilbert space structure in the presence of the inhomogeneous field: the Heitler-London method, which is carried out analytically, and the molecular orbital method, which is done computationally. Within these approximations we show that the exchange energy J changes slowly when the coupled dots are subject to a magnetic field with a wide range of inhomogeneity, suggesting that swap operations can be performed in such an environment as long as quantum error correction is applied to account for the Zeeman term. We also point out the quantum interference nature of this slow variation in exchange.
This thesis addresses the concept of quantum computing with semiconductor quantum dots. The basic unit of a quantum computer is a quantum mechanical two-level system, the so-called quantum bit (qubit). The qubit can be defined as the spin of an electron confined in a quantum dot or as a two-dimensional subspace of the Hilbert space for several spins. Some semiconductors have several minima in their conduction band, socalled valleys. A two-dimensional valley degree of freedom can also be considered as a qubit. In this thesis, quantum registers storing spin as well as valley qubits are described theoretically. Virtual hopping yields an exchange interaction between neighboring quantum dots, which reduces the energy of antisymmetric spin-valley states according to the Pauli principle. Considering the spin and the valley degrees of freedom of two electrons in neighboring quantum dots as qubits, the exchange interaction is a four-qubit interaction. In this thesis, it will be shown that it is, nevertheless, possible to generate a universal two-qubit gate for spin qubits or for valley qubits by combining the exchange interaction and individual single-qubit gates. The exchange interaction in this two-electron double quantum dot directly provides a universal two-qubit gate for one spin and one valley qubit as well. For this, the qubits are defined as suitable subspaces, spanned by the singlet and one triplet state of the spin and the valley states, respectively, Using those gates, arbitrary quantum operations can be performed for single-spin and single-valley qubits in the same quantum register, where in one double quantum dot the quantum states are restricted to the singlet-triplet subspace. While in this register single-spin and single-valley rotations are required, these gates are dispensable in a quantum register storing spin and valley singlet-triplet qubits. The single-qubit operations, in this case, can be provided by the exchange interaction and a gradient in the energy splitting of spin and valley states when the spin qubit is stored in a double quantum dot with spin degrees of freedom only and when the spin states in the double quantum dot which stores the valley qubit are polarized. For providing the two-qubit gate, the spin and the valley qubits need to be stored in the same double quantum dot. The crucial task for this register is to interchange the spin of a spin-only and a spin-valley quantum dot in order to switch between the single-qubit and the two-qubit operation mode. This interchanging of the spin can be achieved by a valley-depending virtual hopping between the quantum dots. Furthermore, echo sequences for a so-called exchange-only qubit are considered. An exchange-only qubit is defined as a subspace in a system of three electron spins in a triple quantum dot. An inhomogeneous magnetic field, which may be caused by nuclear spins in the semiconductor, can lead to decoherence and leakage, i.e., the state might leave the qubit subspace. Suppressing this effect by an echo sequence which consists of pulses interchanging neighboring spin states, so-called SWAP gates, was proposed. Controllability over these quantum operations is provided via the exchange interaction. In this thesis, the performance of different such sequences is investigated. The analysis shows that optimization strategies developed for single spin echoes can be adapted for the three spin system. The echo sequences can be different in their order of applied SWAP gates interchanging the spins in the first and second dots or in the second and third dots. The noise suppression performance depends slightly on this order of SWAP gates. For two spins in a double quantum dot a scheme for quantum state tomography is presented. The corresponding measurement operators are constructed from a set of mutually unbiased bases of the four-dimensional two-qubit Hilbert space. These measurements are represented by short sequences of no more than three elementary quantum gates and projective measurements by the well-established spin-to-charge conversion.
We consider a quantum-gate mechanism based on electron spins in coupled semiconductor quantum dots. Such gates provide a general source of spin entanglement and can be used for quantum computers. We determine the exchange coupling JJJ in the effective Heisenberg model as a function of magnetic (B)(B)(B) and electric fields, and of the interdot distance aaa within the Heitler-London approximation of molecular physics. This result is refined by using sp\mathrm{sp}sp hybridization, and by the Hund-Mulliken molecular-orbit approach, which leads to an extended Hubbard description for the two-dot system that shows a remarkable dependence on BBB and aaa due to the long-range Coulomb interaction. We find that the exchange JJJ changes sign at a finite field (leading to a pronounced jump in the magnetization) and then decays exponentially. The magnetization and the spin susceptibilities of the coupled dots are calculated. We show that the dephasing due to nuclear spins in GaAs can be strongly suppressed by dynamical nuclear-spin polarization and/or by magnetic fields.
We report on our recent progress in applying semiconductor quantum dots for spin-based quantum computation, as proposed by Loss and DiVincenzo (1998 Phys. Rev. A 57 120). For the purpose of single-electron spin resonance, we study different types of single quantum dot devices that are designed for the generation of a local ac magnetic field in the vicinity of the dot. We observe photon-assisted tunnelling as well as pumping due to the ac voltage induced by the ac current driven through a wire in the vicinity of the dot, but no evidence for ESR so far. Analogue concepts for a double quantum dot and the hydrogen molecule are discussed in detail. Our experimental results in laterally coupled vertical double quantum dot device show that the Heitler–London model forms a good approximation of the two-electron wavefunction. The exchange coupling constant J is estimated. The relevance of this system for two-qubit gates, in particular the SWAP operation, is discussed. Density functional calculations reveal the importance of the gate electrode geometry in lateral quantum dots for the tunability of J in realistic two-qubit gates.
We present a theoretical study of a four-electron four-quantum-dot system based on molecular-orbital methods, which hosts a pair of singlet-triplet spin qubits. We took into account the admixture of electron wave functions in all dots, and we found that this mixing of wave functions has consequences to the energy spectrum, exchange interaction, and gate crosstalk of the system. Specifically, we found that when the two singlet-triplet qubits are close enough, some of the states are no longer dominated by the computational basis states, and the exchange interaction cannot simply be understood as the energy difference between the singlet and triplet states. Using the Hund-Mulliken calculation of the Hubbard parameters, we characterized the effective exchange interaction of the system, and we found good agreement with results calculated by taking energy differences where applicable. We studied the two commonly conceived schemes coupling two qubits, namely the exchange and capacitive coupling, and we found that when the interqubit distance is at certain intermediate values, the two kinds of coupling are comparable in strength, complicating the analyses of the evolution of the two qubits. We also investigated the gate crosstalk in the system due to the quantum-mechanical mixing of electron states, and we found that while this effect is typically very weak, it should not be ignored if the spacing between the qubits is similar to or less than the distance between the double dots that constitute the qubit.