— DEV — Modeling type-II superlattice using interface Hamiltonian within 8-band kp method

Contents


Files for the tutorial located in nextnano++\examples
  • T2SL_H-if_zb_III-V_Livneh_PRB_2012_1D_bandstructure.in (Figure 2.4.289)

  • T2SL_H-if_zb_III-V_Livneh_PRB_2012_1D_absorption.in (Figure 2.4.290)

Parameters
  • $if_interface: 1 or 0, switches on and off the interface Hamiltonian

  • $Nperiods: Number of periods in the superlattice.

Output files
  • bias_00000\Quantum\Dispersions\dispersion_quantum_region_kp8_inplane_11_00_10.dat (Figure 2.4.289)

  • bias_00000\Quantum\Dispersions\dispersion_quantum_region_kp8_superlattice.dat (Figure 2.4.289)

  • bias_00000\OpticsQuantum\absorption_quantum_region_TE_y_nm.dat (Figure 2.4.290)


Introduction

This tutorial validates nextnano++ interface Hamiltonoian implementation with the results from [LivnehPRB2012]. The model and the implementation are described in detail in the Interface Hamiltonian 8-band Zinc-Blende section.

The objective is to calculate dispersion and optical properties of type-II InAs/GaSb superlattice.

The samples modeled are described in the table below, The thickness of the layers is expressed in monolayers (ML). In the original paper, the dispersion relation of sample 1 is given in figure 4, and the optical absorption of sample 2 is given in figure 6.

Parameter

Sample 1

Sample 2

InAs thickness, ML

13.8

8.7

GaSb thickness, ML

7.8

10.6

Temperature, K

77

77

Results

The disperson relation of the sample one is computed using the input file T2SL_H-if_zb_III-V_Livneh_PRB_2012_1D_bandstructure.in. For calculating dispersion, it is enough to include single period in the simulation. The dispersion relation is plotted in the figure below.

../../../_images/T2SL_H-if_zb_III-V_Livneh_PRB_2012_1D_dispersion.svg

Figure 2.4.289 Dispersion relation of the sample 1, k-parallel dispersion on the left and superlattice dispersion on the right. Solid lines are nextnano++ results, dots represent data from [LivnehPRB2012].

The optical absorption of the sample two is computed using the input file T2SL_H-if_zb_III-V_Livneh_PRB_2012_1D_absorption.in. For adequat computation of the absorption in superlattice, few periods has to be included. In the figure below, 20 periods were fused in the computation.

../../../_images/T2SL_H-if_zb_III-V_Livneh_PRB_2012_1D_absorption.svg

Figure 2.4.290 Absorption coefficient calculated for the sample 2 with and without the interface (IF) Hamiltonian.

In the figure Figure 2.4.290, one can see the blue shift of the absorption edge with inclusion of the interface Hamiltonian.


Last update: 31/01/2025