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Method

The system under investigation consists of an interacting region of one or more quantum dots connected between leads or electron reservoirs of specified chemical potential. In general the reservoirs will have different chemical potentials, causing a current to flow through the dots. This makes it inherently a non-equilibrium process. Therefore the system will be best described using non-equilibrium Green's functions, now commonly referred to as the Keldysh method [10, 11]. This formalism is not only valid in the linear response regime, but also for higher bias voltages. A full description not only requires knowledge of the retarded and advanced Green's functions, as in equilibrium, but also of the `distribution' Green's function tex2html_wrap_inline1106 between the reservoir and dot sites.


eqnarray25
where tex2html_wrap_inline1108 and c are the usual creation and annihilation operators. In steady state the diagonal elements of tex2html_wrap_inline1112 are proportional to the local density of states, whereas tex2html_wrap_inline1114 plays the role of the density matrix. They are related by the distribution matrix tex2html_wrap_inline1116, defined by tex2html_wrap_inline1118. In equilibrium tex2html_wrap_inline1116 is simply a scalar and is identical to the Fermi-Dirac distribution function.

Having introduced the non-equilibrium Green's functions, the obvious next step is to find an expression for the Landauer formula [12] relating the current to the local properties of the system, such as the chemical potentials of the reservoirs, the density of states and the average occupation of the dots. It is assumed that the left and right electron reservoirs are large enough to have well-defined Fermi-Dirac distributions, tex2html_wrap_inline1122 and tex2html_wrap_inline1124, and chemical potentials tex2html_wrap_inline1126 and tex2html_wrap_inline1128. Any interaction effects in the reservoirs can be neglected as a result of the screening by the free flow of charge carriers. Transport proceeds by electrons hopping between the reservoirs and the interacting region. The Landauer formula can be written as [13]
 equation45
where tex2html_wrap_inline1130 are matrices coupling the interacting region to the reservoirs. tex2html_wrap_inline1132 are the hopping potentials between the reservoirs and the interacting region and tex2html_wrap_inline1134 is the density of states in the reservoirs. It is worth noting that the Green's functions in this formula are to be calculated from the full Hamiltonian including the reservoirs, even though the reservoirs are already present in the couplings tex2html_wrap_inline1136 of the current equation.

For negligible bias voltages, knowledge of the retarded (and hence the advanced) Green's functions allows the distribution Green's functions to be calculated. The next step is to choose a particular Hamiltonian H and to calculate the retarded Green's functions explicitly. This can be done using the equation of motion method which consists of differentiating the Green's function with respect to time, thus creating higher order Green's functions. In Fourier space this amounts to the following iteration rule (tex2html_wrap_inline1140):
 equation69
where tex2html_wrap_inline1142 can be any combination of different creation and annihilation operators and tex2html_wrap_inline1144 is the Fourier transform of the retarded Green's function. The above equation can be applied successively to produce multiple particle Green's functions. For a system of two reservoirs and N dots with n energy levels a multiple particle operator consists of a product of at most 4 (n N+2)-1 single particle operators, i.e. the creation and annihilation operators for both spin orientations in each dot level or reservoir. Therefore, it is in principle possible to obtain a closed set of equations. Clearly, it is a daunting task to calculate and solve all possible simultaneous equations, so one usually resorts to making some approximations in order to close the set of coupled equations.


next up previous
Next: Single Dot Up: Coherent tunnelling through two Previous: Coherent tunnelling through two

Angus MacKinnon - Aonghus Mac Fhionghuin Fri Nov 8 17:44:15 gmt 1996