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Comparing the Eight-Band Luttinger-Kohn-Pikus-Bir-Hamiltonian with the Four-Band Empiric k·p Hamiltonian

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Abstract

The purpose of this chapter is to compare on one side the Luttinger Kohn Hamiltonian with the Pikus Bir modification to account for the strained lattices of nanostructured semiconductors, commonly used by the solid state physicists, with, on the other side, the Empiric k·p Hamiltonian proposed and described in Chap. 3, and more oriented to the research and development of optoelectronic devices. The concept of spin is explained, mainly to fix the nomenclature. It is pointed out that the \(\left| {\text{S}} \right\rangle ,\left| {\text{X}} \right\rangle ,\left| {\text{Y}} \right\rangle ,\left| {\text{Z}} \right\rangle\) Γ-Bloch functions used in Chap. 3 may have up and down spins becoming \(\left| {{\text{S}}{\uparrow}} \right\rangle ,\left| {{\text{S}}{\downarrow}} \right\rangle \ldots\) etc. However these are not the Γ-Bloch functions in this chapter. These are instead \(\left| {{\text{cb}} + } \right\rangle ,\left| {{\text{hh}} + } \right\rangle ,\left| {{\text{lh}} + } \right\rangle ,\left| {{\text{so}} + } \right\rangle\), and their four counterparts with minus signs, which are linear combinations of \(\left| {{\text{S}}{\uparrow}} \right\rangle ,\left| {{\text{S}}{\downarrow}} \right\rangle \ldots\) etc. The eight-band Luttinger Kohn Pikus Bir Hamiltonian is described, making it possible for the reader to use it with a strain distribution. An approximate four-band Luttinger Kohn Pikus Bir Hamiltonian is also presented. Fittings are made to match the calculated values with the experimental values of the effective masses and bandgaps. The eigenvalues and eigenfunctions of the new Hamiltonians are calculated, and subsequently the sub-bandgap absorption coefficients and the quantum efficiency for the exemplary InAs/GaAs cell modeled along this book. The latter is compared with the experimental data and with the calculations based on the Empiric k·p Hamiltonian. An assessment of the calculation time with the different methods is presented.

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Notes

  1. 1.

    If a and b are the two non orthogonal eigenvectors forming a vector subspace the vector b′ = b − (a · b)a belongs to the same subspace and is orthogonal to a. It must be subsequently normalized for easy operation.

  2. 2.

    The order for the rows we use is that of Mathematica© which is in the order of decreasing absolute value of the eigenvalues to which each eigenvector corresponds: first row, cb; second row so; third row, lh; fourth row, hh. The order given by Mathematica© do not keep the aforementioned relation with the bands for higher ks, but we have corrected it in our calculations to keep the rows properly associated to the bands. The columns, corresponding to the envelopes, is given in the usual order along this Chapter [that of the +bands in Eq. (7.9)]: first column, \(\left| {\text{cb}} \right\rangle\); second column, \(\left| {\text{hh}} \right\rangle\); third column, \(\left| {\text{lh}} \right\rangle\); fourth column, \(\left| {\text{so}} \right\rangle\).

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Luque, A., Mellor, A.V. (2015). Comparing the Eight-Band Luttinger-Kohn-Pikus-Bir-Hamiltonian with the Four-Band Empiric k·p Hamiltonian. In: Photon Absorption Models in Nanostructured Semiconductor Solar Cells and Devices. SpringerBriefs in Applied Sciences and Technology. Springer, Cham. https://doi.org/10.1007/978-3-319-14538-9_7

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  • DOI: https://doi.org/10.1007/978-3-319-14538-9_7

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