Valley Splitting Research Articles

Magnetotransport studies of mobility limiting mechanisms in undoped Si/SiGe heterostructures

We perform detailed magnetotransport studies on two-dimensional electron gases (2DEGs) formed in undoped Si/SiGe heterostructures in order to identify the electron mobility limiting mechanisms in this increasingly important materials system. By analyzing data from 26 wafers with different heterostructure growth profiles we observe a strong correlation between the background oxygen concentration in the Si quantum well and the maximum mobility. The highest quality wafer supports a 2DEG with a mobility of 160,000 cm^2/Vs at a density 2.17 x 10^11/cm^2 and exhibits a metal-to-insulator transition at a critical density 0.46 x 10^11/cm^2. We extract a valley splitting of approximately 150 microeV at a magnetic field of 1.8 T. These results provide evidence that undoped Si/SiGe heterostructures are suitable for the fabrication of few-electron quantum dots.

Optical Investigation of Monolayer and Bulk Tungsten Diselenide (WSe₂) in High Magnetic Fields.

Optical spectroscopy in high magnetic fields B ≤ 65 T is used to reveal the very different nature of carriers in monolayer and bulk transition metal dichalcogenides. In monolayer WSe2, the exciton emission shifts linearly with the magnetic field and exhibits a splitting that originates from the magnetic field induced valley splitting. The monolayer data can be described using a single particle picture with a Dirac-like Hamiltonian for massive Dirac Fermions, with an additional term to phenomenologically include the valley splitting. In contrast, in bulk WSe2 where the inversion symmetry is restored, transmission measurements show a distinctly excitonic behavior with absorption to the 1s and 2s states. Magnetic field induces a spin splitting together with a small diamagnetic shift and cyclotron like behavior at high fields, which is best described within the hydrogen model.

A reconfigurable gate architecture for Si/SiGe quantum dots

We demonstrate a reconfigurable quantum dot gate architecture that incorporates two interchangeable transport channels. One channel is used to form quantum dots, and the other is used for charge sensing. The quantum dot transport channel can support either a single or a double quantum dot. We demonstrate few-electron occupation in a single quantum dot and extract charging energies as large as 6.6 meV. Magnetospectroscopy is used to measure valley splittings in the range of 35–70 μeV. By energizing two additional gates, we form a few-electron double quantum dot and demonstrate tunable tunnel coupling at the (1,0) to (0,1) interdot charge transition.

Intersubband spin relaxation reduction and spin lifetime enhancement by strain in SOI structures

Electron spin attracts much attention as an alternative to the electron charge degree of freedom for low-power reprogrammable logic and non-volatile memory applications. Silicon appears to be the perfect material for spin-driven applications. An order of magnitude enhancement of the electron spin lifetime in (001) silicon thin films by shear strain is shown. It is demonstrated that spin-flip scattering processes between the two [001] valleys are responsible for spin relaxation in thin (001) silicon films. The enhancement of the spin lifetime is the result of the suppression of inter-valley scattering caused by the shear strain induced equivalent [001] valley splitting.

Low-strain Si/O superlattices with tunable electronic properties:Ab initiocalculations

We propose that low-strain Si/O superlattices can be constructed by connecting reconstructed Si{001} surfaces by Si-O-Si bridges. Ab initio calculations show that our models are energetically more favorable than all the models proposed so far. The part of our Si/O superlattice model is experimentally accessible just by oxidizing a Si(001) substrate. To complete our Si/O superlattice model, we propose a three-step method. We also explore the potential of our Si/O superlattice models for new materials used in future Si electronics. We find that the location of the channel where the carriers travel can be controlled between the interfaces and the Si layers by the insertion of O atoms into the Si-Si dimers. By revealing the origins of the interface electron and hole states, we find that similar interface states should be easily achieved for Si slabs and Si substrates. Interestingly, the interface electrons and holes have small effective masses in the direction parallel to the channel and large effective masses in the direction normal to the channel, which makes the Si/O superlattices attractive to be used for channel materials. We also find that the valley splitting of Si is enhanced by the formation of the Si/O/Si interfaces, which is ideal for developing Si-based qubits. Our findings open new perspectives to design and control the electronic properties of Si.

Valley splitting and polarization by the Zeeman effect in monolayer MoSe2.

We have measured circularly polarized photoluminescence in monolayer MoSe2 under perpendicular magnetic fields up to 10 T. At low doping densities, the neutral and charged excitons shift linearly with field strength at a rate of ∓0.12 meV/T for emission arising, respectively, from the K and K' valleys. The opposite sign for emission from different valleys demonstrates lifting of the valley degeneracy. The magnitude of the Zeeman shift agrees with predicted magnetic moments for carriers in the conduction and valence bands. The relative intensity of neutral and charged exciton emission is modified by the magnetic field, reflecting the creation of field-induced valley polarization. At high doping levels, the Zeeman shift of the charged exciton increases to ∓0.18 meV/T. This enhancement is attributed to many-body effects on the binding energy of the charged excitons.

Spin relaxation in a Si quantum dot due to spin-valley mixing

We study the relaxation of an electron spin qubit in a Si quantum dot due to electrical noise. In particular, we clarify how the presence of conduction-band valleys influences spin relaxation. In single-valley semiconductor quantum dots, spin relaxation is through the mixing of spin and envelope orbital states via spin-orbit interaction. In Si, the relaxation could also be through the mixing of spin and valley states. We find that the additional spin relaxation channel, via spin-valley mixing and electrical noise, is indeed important for an electron spin in a Si quantum dot. By considering both spin-valley and intravalley spin-orbit mixings and Johnson noise in a Si device, we find that the spin relaxation rate peaks at the hot spot, where the Zeeman splitting matches the valley splitting. Furthermore, because of a weaker field dependence, the spin relaxation rate due to Johnson noise could dominate over phonon noise at low magnetic fields, which fits well with recent experiments.

Magneto-optical spectra of transition metal dichalcogenides: A comparative study

Following our previous work [Ho et al., Phys. Rev. B 89, 155316 (2014)], we systematically calculate the magneto-optical properties of various transition metal dichalcogenide monolayers. The intrinsic spin-orbit coupling gives rise to the spin-split electronic states, while a perpendicular magnetic field further induces a valley splitting. In magneto-optical spectra with linearly polarized light, spectral features are spin and valley-polarized. Compounds are different from one another in terms of transition energies and appearance of twin peaks. Our numerical results can serve as a guide for future experimental identification.

Electronic properties of graphene/hexagonal-boron-nitride moiré superlattice

We theoretically investigate the electronic structures of moir\'e superlattices arising in monolayer/bilayer graphene stacked on hexagonal boron nitride (hBN) in the presence and absence of magnetic field. We develop an effective continuum model from a microscopic tight-binding lattice Hamiltonian and calculate the electronic structures of graphene-hBN systems with different rotation angles. Using the effective model, we explain the characteristic band properties such as the gap opening at the corners of the superlattice Brillouin zone (mini-Dirac point). We also investigate the energy spectrum and quantum Hall effect of graphene-hBN systems in uniform magnetic field and demonstrate the evolution of the fractal spectrum as a function of the magnetic field. The spectrum generally splits in the valley degrees of freedom ($K$ and ${K}^{\ensuremath{'}}$) due to the lack of the inversion symmetry, and the valley splitting is more significant in bilayer graphene on hBN than in monolayer graphene on hBN because of the stronger inversion-symmetry breaking in bilayer.

Determining the electronic confinement of a subsurface metallic state.

Dopant profiles in semiconductors are important for understanding nanoscale electronics. Highly conductive and extremely confined phosphorus doping profiles in silicon, known as Si:P δ-layers, are of particular interest for quantum computer applications, yet a quantitative measure of their electronic profile has been lacking. Using resonantly enhanced photoemission spectroscopy, we reveal the real-space breadth of the Si:P δ-layer occupied states and gain a rare view into the nature of the confined orbitals. We find that the occupied valley-split states of the δ-layer, the so-called 1Γ and 2Γ, are exceptionally confined with an electronic profile of a mere 0.40 to 0.52 nm at full width at half-maximum, a result that is in excellent agreement with density functional theory calculations. Furthermore, the bulk-like Si 3pz orbital from which the occupied states are derived is sufficiently confined to lose most of its pz-like character, explaining the strikingly large valley splitting observed for the 1Γ and 2Γ states.

Possible realization of a chiralp-wave paired state in a two-component system

There is much interest in the realization of systems with p-wave pairing in one dimension or chiral p-wave pairing in two dimensions, because these are believed to support Majorana modes at the ends or inside vortices. We consider a two component system of composite fermions and provide theoretical evidence that, under appropriate conditions, the screened interaction between the minority composite fermions is such as to produce an almost exact realization of p-wave paired state described by the so-called anti-Pfaffian wave function. This state is predicted to occur at filling $\nu=3/8$ or 13/8 in GaAs when the Zeeman energy is sufficiently small, and at $\nu=\pm 3/8$ or $\pm 13/8$ in single layer graphene when either the Zeeman or the valley splitting is sufficiently small.

Spontaneous parity breaking in spin-orbital coupled systems

Effects of spontaneous parity breaking by charge, spin, and orbital orders are investigated in a two-band Hubbard model on a honeycomb lattice. This is a minimal model in which the inter-orbital hopping, atomic spin-orbit coupling, and strong electron correlation give rise to fascinating properties, such as the magnetoelectric effects, quantum spin Hall effect, and spin or valley splitting in the band structure. We perform the symmetry analysis of possible broken-parity states and the mean-field analysis of their competition. We find that the model at 1/4 filling exhibits a spin-orbital composite ordered state and a charge ordered state, in addition to a paramagnetic quantum spin-Hall insulator. We show that the composite ordered phase exhibits two types of magnetoelectric responses. The charge ordered state shows spin splitting in the band structure, while the topological nature varies depending on electron correlations.

Valley-splitting and valley-dependent inter-Landau-level optical transitions in monolayerMoS2quantum Hall systems

The valley dependent optical selection rules in recently discovered monolayer group-VI transition metal dichalcogenides (TMDs) make possible optical control of valley polarization, a crucial step towards valleytronic applications. However, in presence of Landaul level(LL) quantization such selection rules are taken over by selection rules between the LLs, which are not necessarily valley contrasting. Using MoS$_{2}$ as an example we show that the spatial inversion-symmetry breaking results in unusual valley dependent inter-LL selection rules, which directly locks polarization to valley. We find a systematic valley splitting for all Landau levels (LLs) in the quantum Hall regime, whose magnitude is linearly proportional to the magnetic field and in comparable with the LL spacing. Consequently, unique plateau structures are found in the optical Hall conductivity, which can be measured by the magneto-optical Faraday rotations.

Signatures of the valley Kondo effect in Si/SiGe quantum dots

We report measurements consistent with the valley Kondo effect in Si/SiGe quantum dots, evidenced by peaks in the conductance versus source-drain voltage that show strong temperature dependence. The Kondo peaks show unusual behavior in a magnetic field that we interpret as arising from the valley degree of freedom. The interplay of valley and Zeeman splittings is suggested by the presence of side peaks, revealing a zero-field valley splitting between 0.28 to 0.34 meV. A zero-bias conductance peak for non-zero magnetic field, a phenomenon consistent with valley non- conservation in tunneling, is observed in two samples.

Electron spin resonance and spin-valley physics in a silicon double quantum dot.

Silicon quantum dots are a leading approach for solid-state quantum bits. However, developing this technology is complicated by the multi-valley nature of silicon. Here we observe transport of individual electrons in a silicon CMOS-based double quantum dot under electron spin resonance. An anticrossing of the driven dot energy levels is observed when the Zeeman and valley splittings coincide. A detected anticrossing splitting of 60 MHz is interpreted as a direct measure of spin and valley mixing, facilitated by spin-orbit interaction in the presence of non-ideal interfaces. A lower bound of spin dephasing time of 63 ns is extracted. We also describe a possible experimental evidence of an unconventional spin-valley blockade, despite the assumption of non-ideal interfaces. This understanding of silicon spin-valley physics should enable better control and read-out techniques for the spin qubits in an all CMOS silicon approach.

Splitting valleys in Si/SiO2: Identification and control of interface states

Interface states in a silicon/barrier junction break the silicon valley degeneracy near the interface, a desirable feature for some Si quantum electronics applications. Within a minimal multivalley tight-binding model in one dimension, we inspect here the spatial extent of these states into the Si and the barrier materials, as well as favorable conditions for its spontaneous formation. Our approach---based on Green's-function renormalization-decimation techniques---is asymptotically exact for the infinite chain and shows the formation of these states regardless of whether or not a confining electric field is applied. The renormalization language naturally leads to the central role played by the chemical bond of the atoms immediately across the interface. In the adopted decimation procedure, the convergence rate to a fixed point directly relates the valley splitting and the spread of the wave function, consequently connecting the splitting to geometrical experimental parameters such as the capacitance of a two-dimensional electron gas---explicitly calculated here. This should serve as a probe to identify such states as a mechanism for enhanced valley splitting.

A direct measurement of the electronic structure of Si nanocrystals and its effect on optoelectronic properties

Since reports that silicon nanocrystals (Si-NCs) can exhibit direct transition emission, the silicon laser field is at a juncture where the importance of this discovery needs to be evaluated. Most theoretical models predicted a monotonic increase in the bandgap and experimental information currently available on the electronic structure at the Γ valley of these promising materials is circumstantial as it is obtained from emission measurements where competing non-radiative relaxation and recombination processes only provide an incomplete picture of the electronic structure of Si-NCs. Optical absorption, the most immediate probe of the electronic structure beyond the band-edges, showing the evolution of the Γ valley states with nanocrystal size has not been measured. Here, we show such measurements, performed with high dynamic range, allowing us to observe directly the effect of crystal size on the Γ valley splitting far above the band-edges. We show that the splitting is 100 s of meV more pronounced than predicted by pseudo potential calculations and Luttinger-Kohn model. We also show that ultrafast red-shifting emission can be observed in plasma enhanced chemical vapor deposition prepared Si-NCs.

Spin-Orbit Coupling, Quantum Dots, and Qubits in Monolayer Transition Metal Dichalcogenides

We derive an effective Hamiltonian which describes the dynamics of electrons in the conduction band of transition metal dichalcogenides (TMDC) in the presence of perpendicular electric and magnetic fields. We discuss in detail both the intrinsic and the Bychkov-Rashba spin-orbit coupling (SOC) induced by an external electric field. We point out interesting differences in the spin-split conduction band between different TMDC compounds. An important consequence of the strong intrinsic SOC is an effective out-of-plane $g$-factor for the electrons which differs from the free-electron g-factor $g\simeq 2$. We identify a new term in the Hamiltonian of the Bychkov-Rashba SOC which does not exist in III-V semiconductors. Using first-principles calculations, we give estimates of the various parameters appearing in the theory. Finally, we consider quantum dots (QDs) formed in TMDC materials and derive an effective Hamiltonian which allows us to calculate the magnetic field dependence of the bound states in the QDs. We find that all states are both valley and spin split, which suggests that these QDs could be used as valley-spin filters. We explore the possibility of using spin and valley states in TMDCs as quantum bits, and conclude that, due to the relatively strong intrinsic spin-orbit splitting in the conduction band, the most realistic option appears to be a combined spin-valley (Kramers) qubit at low magnetic fields.

Valley Splitting in a Silicon Quantum Device Platform

By suppressing an undesirable surface Umklapp process, it is possible to resolve the two most occupied states (1Γ and 2Γ) in a buried two-dimensional electron gas (2DEG) in silicon. The 2DEG exists because of an atomically sharp profile of phosphorus dopants which have been formed beneath the Si(001) surface (a δ-layer). The energy separation, or valley splitting, of the two most occupied bands has critical implications for the properties of δ-layer derived devices, yet until now, has not been directly measurable. Density functional theory (DFT) allows the 2DEG band structure to be calculated, but without experimental verification the size of the valley splitting has been unclear. Using a combination of direct spectroscopic measurements and DFT we show that the measured band structure is in good qualitative agreement with calculations and reveal a valley splitting of 132 ± 5 meV. We also report the effective mass and occupation of the 2DEG states and compare the dispersions and Fermi surface with DFT.

Genetic design of enhanced valley splitting towards a spin qubit in silicon

The long spin coherence time and microelectronics compatibility of Si makes it an attractive material for realizing solid-state qubits. Unfortunately, the orbital (valley) degeneracy of the conduction band of bulk Si makes it difficult to isolate individual two-level spin-1/2 states, limiting their development. This degeneracy is lifted within Si quantum wells clad between Ge-Si alloy barrier layers, but the magnitude of the valley splittings achieved so far is small—of the order of 1 meV or less—degrading the fidelity of information stored within such a qubit. Here we combine an atomistic pseudopotential theory with a genetic search algorithm to optimize the structure of layered-Ge/Si-clad Si quantum wells to improve this splitting. We identify an optimal sequence of multiple Ge/Si barrier layers that more effectively isolates the electron ground state of a Si quantum well and increases the valley splitting by an order of magnitude, to ∼9 meV.