49,011 research outputs found

    Assessment of density-functional approximations: Long-range correlations and self-interaction effects

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    The complex nature of electron-electron correlations is made manifest in the very simple but nontrivial problem of two electrons confined within a sphere. The description of highly nonlocal correlation and self-interaction effects by widely used local and semilocal exchange-correlation energy density functionals is shown to be unsatisfactory in most cases. Even the best such functionals exhibit significant errors in the Kohn-Sham potentials and density profiles

    Quantum conductance of homogeneous and inhomogeneous interacting electron systems

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    We obtain the conductance of a system of electrons connected to leads, within time-dependent density-functional theory, using a direct relation between the conductance and the density response function. Corrections to the non-interacting conductance appear as a consequence of the functional form of the exchange-correlation kernel at small frequencies and wavevectors. The simple adiabatic local-density approximation and non-local density-terms in the kernel both give rise to significant corrections in general. In the homogeneous electron gas, the former correction remains significant, and leads to a failure of linear-response theory for densities below a critical value.Comment: for resolution of the here published results see Phys. Rev. B 76, 125433 (2007

    Comment on "Dynamical corrections to the DFT-LDA electron conductance in nanoscale systems"

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    In a recent paper Sai et al. [1] identified a correction R^{dyn}totheDCconductanceofnanoscalejunctionsarisingfromdynamicalexchangecorrelation(XC)effectswithintimedependentdensityfunctionaltheory.Thisquantitycontributestothetotalresistancethrough to the DC conductance of nanoscale junctions arising from dynamical exchange-correlation (XC) effects within time-dependent density functional theory. This quantity contributes to the total resistance through R=R_{s}+R^{dyn}where where R_{s}istheresistanceevaluatedintheabsenceofdynamical is the resistance evaluated in the absence of dynamical XCeffects.InthisCommentweshowthatthenumericalestimationof effects. In this Comment we show that the numerical estimation of R^{dyn}$ in example systems of the type they considered should be considerably reduced, once a more appropriate form for the shear electron viscosity ¿ is used

    Field Tuning the G-Factor in InAs Nanowire Double Quantum Dots

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    We study the effects of magnetic and electric fields on the g-factors of spins confined in a two-electron InAs nanowire double quantum dot. Spin sensitive measurements are performed by monitoring the leakage current in the Pauli blockade regime. Rotations of single spins are driven using electric-dipole spin resonance. The g-factors are extracted from the spin resonance condition as a function of the magnetic field direction, allowing determination of the full g-tensor. Electric and magnetic field tuning can be used to maximize the g-factor difference and in some cases altogether quench the EDSR response, allowing selective single spin control.Comment: Related papers at http://pettagroup.princeton.ed

    Radio frequency charge sensing in InAs nanowire double quantum dots

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    We demonstrate charge sensing of an InAs nanowire double quantum dot (DQD) coupled to a radio frequency (rf) circuit. We measure the rf signal reflected by the resonator using homodyne detection. Clear single dot and DQD behavior are observed in the resonator response. rf-reflectometry allows measurements of the DQD charge stability diagram in the few-electron regime even when the dc current through the device is too small to be measured. For a signal-to-noise ratio of one, we estimate a minimum charge detection time of 350 microseconds at interdot charge transitions and 9 microseconds for charge transitions with the leads.Comment: Related papers at http://pettagroup.princeton.ed
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