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Imaginary-time formulation of strongly correlated nonequilibrium

Ryan Heary

Published Jan 1, 2009• 0 citations
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We extend the imaginary-time formulation of the equilibrium quantum many-body theory to steady-state nonequilibrium with an application to strongly correlated transport. By introducing the Matsubara voltage, we maintain the finite chemical potential shifts in the Fermi-Dirac function, in agreement with the Keldysh formulation. The formulation is applied to strongly correlated transport in the Kondo regime using the quantum Monte Carlo method.

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We examine the recently proposed imaginary-time formulation for strongly correlated steady-state nonequilibrium for its range of validity and discuss significant improvements in the analytic continuation of the Matsubara voltage as well as the fermionic Matsubara frequency. The discretization error in the conventional Hirsch-Fye algorithm has been compensated in the Fourier transformation with reliable small frequency behavior of self-energy. Here we give detailed discussions for generalized spectral representation ansatz by including high-order vertex corrections and its numerical analytic continuation procedures. The differential conductance calculations agree accurately with available data from other nonequilibrium transport theories. It is verified that, at finite source-drain voltage, the Kondo resonance is destroyed at bias comparable to the Kondo temperature. Calculated scaling coefficients of differential conductance for zero-bias anomaly fall within the range of experimental estimates.

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Unified description of equilibrium and steady-state nonequilibrium: application to strongly correlated transport

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We examine the recently proposed imaginary-time formulation for strongly correlated steady-state nonequilibrium for its range of validity and discuss significant improvements in the analytic continuation of the Matsubara voltage as well as the fermionic Matsubara frequency. The discretization error in the conventional Hirsch-Fye algorithm has been compensated in the Fourier transformation with reliable small frequency behavior of self-energy. Here we give detailed discussions for generalized spectral representation ansatz by including high-order vertex corrections and its numerical analytic continuation procedures. The differential conductance calculations agree accurately with available data from other nonequilibrium transport theories. It is verified that, at finite source-drain voltage, the Kondo resonance is destroyed at bias comparable to the Kondo temperature. Calculated scaling coefficients of differential conductance for zero-bias anomaly fall within the range of experimental estimates.