The Influence of Boundary Roughness



next up previous
Next: The Influence of Up: Conductance and conductance fluctuations Previous: Model and Methods

The Influence of Boundary Roughness

  For the investigation of the transport properties of quantum wires with rough edges we use the geometry of the system which is shown at the top of Fig. 2. The average value of the width is taken to be and the width of the leads will be fixed at throughout this section. Here we shall analyse results for four types of calculation: conductance of a single quantum wire and ensemble average quantities related to the conductance, as functions of Fermi energy and wire length . Firstly, we discuss the results for the conductance of a single quantum wire sample, presented in Fig. 2.

  
Figure 2: as a function of energy of a single sample of quantum wire with rough edges and no island disorder, for wire lengths: and , and average wire width and leads width . Reference step functions are the conductances of the perfect wire of the width , length , and leads with (full line), and (i.e. no difference between leads and wire - broken line). The inset is the conductance of a quantum wire sample as a function of the wire length. The top picture shows the geometry of the lead-wire-lead system used in the calculations.

The edge roughness destroys the conductance quantization steps, firstly near the band center for very small disorder (see case in Fig. 2). The deterioration of the quantization spreads towards the band edge both as the disorder and as the length of the wire is increased. In the mesoscopic regime, when , the conductance curve shows sample specific fluctuations as a function of energy and length. However, the amplitude of these fluctuations is of order , independent of energy (Fig. 2, L=10, L=30) or length (see inset of Fig. 2). This is a quantum interference effect similar to the universal conductance fluctuations observed in the mesoscopic regime (Lee and Stone 1985)) of other systems. The particular value for the conductance is determined by the electron wavelength (i.e. electron energy), the length of the quantum wire and the actual realization of the disorder in a sample. The conditions for the destructive or constructive interference of an electron wavefront are, generally, very sensitive to all of these parameters. The scale of the sensitivity to energy, however, differs with the length of the wire (which is evident from Fig. 2 for and ) or with the level of disorder. This observation supports the idea that the fluctuations do not arise from classical scattering from the rough boundary but from the phase modulation of the electron wavefunction due to multiple elastic scattering in the wire (Takagaki and Ferry 1992). We estimate that the typical spacing between peaks and valleys in the conductance as a function of energy depends on the wire length as: . This is a weaker dependence on the wire length than in the case of the universal conductance fluctuations in the metallic regime, where (Lee and Stone 1985)). It should also be noted that the conductance falls faster near the band center than elsewhere (this will be clear from the results for the average conductance). When the system is in the strong localization regime, the conductance is reduced to a set of peaks of different amplitudes, with maximum value of (see Fig. 2 ). The mechanism of electron transport is resonant tunnelling through the quantum wire (Bryant 1991). When the energy of an electron coincides with an eigenenergy of the wire the electron can be transmitted through the wire via this localized state. The height of the peak of depends on the overlap between the wavefunctions of this spatially localized state inside the wire and the propagating states in the leads. As the length of the wire is further increased, the number of peaks and their amplitudes reduce and their positions change. The highest such peaks are probably due to tunnelling through multiple resonant states, so-called `necklace' states (Pendry 1987).

  
Figure 3: Average conductance as a function of energy, for quantum wires with rough boundary and no island disorder, for different wire lengths: , , and . Number of samples taken for calculating average values are: for wire lengths respectively.

Next we discuss the results for the ensemble average conductance and for the conductance fluctuations. Fig. 3 shows results for and . Conductance quantization disappears very quickly, although the presence of a short plateau for the first subband can be observed for the shorter wires. The boundary roughness has less impact for longer wavelengths (smaller energies) and hence the average conductance tends to decrease with increasing energy. As the length of the wire increases there is a rapid decrease of near the band center. In the strong localization regime, a broad peak emerges near the band edge (see Fig. 3 for ), which corresponds to the peak in the localization length(Nikolic and MacKinnon 1993). In this regime, the average conductance of quasi-1D systems falls off exponentially with the length (johnstone and Kunz 1983):

 

  
Figure 4: Conductance fluctuations which correspond to the case in Fig. 4 for the wire lengths: , and (three bold lines). Two thin lines are the localization length and the density of states (both rescaled: and ) for quantum wires with boundary roughness.

The conductance fluctuations for the case of the quantum wire with boundary roughness only, calculated for the examples from Fig. 3 by using definition Eq. (16), are presented in Fig. 4. Three characteristic regimes are shown:

  1. the quasi-ballistic regime - the wire length is comparable with the mean free path length, (e.g. for most of the energies and for the level of disorder assumed in our samples);
  2. the mesoscopic regime where the wire length is (e.g. );
  3. the strong localization regime - (e.g. ).
Since the elastic mean free path and the localization length are both functions of energy, a particular wire can move between these regimes as the energy is changed. The fluctuations for the case in Fig. 4 show interesting similarities with the density of states for the same type of quantum wires. There is a peak near the band edge which corresponds to the peak in the DOS, which is the last remaining feature of the inverse square root singularities from the DOS of clean quasi-1D systems (see Nikolic and MacKinnon 1993). This behaviour can be explained in the following way. For short wires (i.e. quasi-ballistic transport) the important length is the elastic mean free path . If increases (as a function of energy) in the quasi-ballistic regime, then the conductance fluctuations decrease - as the scattering in the wire is reduced, and vice versa. Since is roughly inversely proportional to the DOS (when the DOS is increased the scattering rate increases and therefore decreases), then the conductance fluctuations might be expected to mirror the DOS. As is increased with respect to (and still ) then the fluctuations will increase towards their maximal value, which is reached in the mesoscopic regime. The quantum wires of length in Fig. 4 show a relatively wide region of energy in which the conductance fluctuations are independent of energy, with a value which is close to the universal value for quasi-1D systems ( (Lee and Stone 1985)).

For long wires () we have the strong localization regime and follows the curve for the localization length (see Fig. 4), i.e. the average conductance, since these are related (Eq. 17). That and are proportional can be understood by using the picture of `open' and `shut' channels, or `maximal fluctuations', in a quantum wire in the strong localization regime (Pendry et al. 1992). This terminology is associated with the distribution function for the eigenvalues () of , where is the transmission matrix: it has a peak at , and a tail which extends to (Pendry et al. 1992, MacKinnon 1992). Each eigenvector of defines a conducting `micro-channel' with the corresponding conductance in units of (Pendry et al. 1992). As the size of the system is increased, the peak at strengthens at the expense of the tail, but the shape of the tail remains the same.

For long lengths, therefore, most of the micro-channels will have conductance of order 0 since the bulk of the distribution is around 0. Only a small fraction of the channels, with values for of order 1 (roughly ), will contribute to the conductance. Such a distribution of , implies that the fluctuations tend to the maximum possible value consistent with their mean. However, the moments of the conductance, , for 2D and 3D cases do not show the same size dependence as the moments of , within the metallic regime. Universal conductance fluctuations are affected by the correlations between the s rather than by the distribution of the s themselves. UCFs (i.e. with a universal value ca. ) are restricted to disordered systems in the metallic regime where perturbation theory is applicable. When localization effects are important, however, the correlations between the micro-channels change and a different sort of fluctuations is observed (Pendry et al. 1992). The statistics of a single micro-channel were found to be crucial in the strong localization regime.

The average conductance of the disordered quasi-1D system shows an asymptotically exponential decrease with the length (johnstone and Kunz 1983). This single parameter dependence suggests that the conductance statistics of quasi-1D samples, with a length much longer than the localization length, is dominated by a single channel. Hence a similar size dependence for the conductance moments should be expected as for , since the distribution of s is important, rather than the correlation between them. This picture of the conductance statistics in the strong localization regime shows that the conductance fluctuations are proportional to the average conductance.

  
Figure 5: Average conductance as a function of wire length for real wire without islands for energies and - top figure. The corresponding conductance fluctuations are shown in the lower figure as well as fluctuations for energies and . Number of samples is .

In Fig. 5 results are given for the conductance as a function of wire length, for a fixed energy. The results for the average conductance are presented for two values of the energy and two more examples of conductance fluctuations are added. The decrease of conductance is more marked in the quasi-ballistic (near ballistic) regime (short wires), where the difference between and is negligible. The difference between the two averages increases as the disorder or length of the wire is increased (Figures 3 and 5). This shows that the average is dominated by a small number of samples with conductance of order . The divergence of the two curves indicates that the conductance distribution is transforming to the form which has a peak for small conductances and a long tail towards larger conductances, i.e. it is transforming to a log-normal distribution (johnstone and Kunz 1983). For wires of length the decrease of the average conductance with the length of the wire is mainly determined by the localization length. The value for the localization length can be obtained from Fig. 5, where is fitted with a straight line and is determined from its slope,

 

for wires of length .

The results for the conductance fluctuations are also shown in Fig. 5. The fluctuations first increase for very short wire lengths (). This is the nearly ballistic regime where the fluctuations grow as the disorder (or wire length) increases. On the other side, for long wires, i.e. the strong localization regime (), the fluctuations decrease as the wire becomes longer, due to the overall decrease of the conductance. In this regime the fluctuations between wires of the same length depend only on the localization length (see Fig. 5). The fluctuations take maximal values between these two regimes. Fluctuations for wires with many subbands ( and in Fig. 5) have a sharp peak for short lengths and then start to decrease well before the wire has become longer than . The fluctuations in the wires with a few subbands ( and Fig. 5) even appear to be independent of length for several ranges of in the intermediate region. This could be called the universal region (Ando and Tamura 1992, Tamura and Ando 1991), although the constant value of the conductance fluctuations is not equal to the universal value obtained for quasi-1D systems in the perturbation theory (Lee and Stone 1985).



next up previous
Next: The Influence of Up: Conductance and conductance fluctuations Previous: Model and Methods



Angus MacKinnon
Fri Nov 18 13:59:27 gmt 1994