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The Boltzmann Transport Equation and Its Projection onto Spherical Harmonics

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Part of the book series: Computational Microelectronics ((COMPUTATIONAL))

Abstract

In the framework of the semiclassical transport theory, the BTE governs the spatiotemporal evolution of the particle gas. In this chapter, the BTE in the three-dimensional wave vector space is introduced in Sect. 2.1. The PE is required for the calculation of the electric field, which enters the BTE. If only one carrier type is simulated, a drift-diffusion model is solved for the other type. The PE and drift-diffusion model are discussed in Sect. 2.2. In Sect. 2.3, basic properties of the spherical harmonics are reviewed. A generalized coordinate transform from the wavevector space to the energy space is introduced, and some important relations between transport coefficients in the energy space are explicitly derived. The spherical harmonics expansion of the BTE is shown in Sect. 2.5. Finally, noise analysis within the Langevin-Boltzmann framework is discussed in Sect. 2.6.

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Notes

  1. 1.

    In the case of the Si valence bands, the minimum of the band energy is found at this point.

  2. 2.

    In the literature, the order l and the sub-order m are usually called the degree l and the order m, respectively.

  3. 3.

    Since the coordinate transform is applied to the six-dimensional phase space, this is only a part of the total Jacobian matrix, corresponding to the k space. Because the transform for the real space is just an identity transform, the entire 6 ×6 Jacobian matrix can be inverted blockwise.

  4. 4.

    This definition does not include the integration over the solid angle. The generalized DOS is therefore for the case that it does not depend on the angles by a factor of 4π smaller than the conventional expression.

  5. 5.

    The polar optical phonon, which is important for III–V materials, cannot be properly treated as a velocity-randomizing one. In this case, higher-order expansions of the transition rate should be considered, as shown in [15].

  6. 6.

    Noise analysis under large-signal conditions has been demonstrated for bulk simulations within the framework of the deterministic BTE solver in [17].

  7. 7.

    From this definition, the expectation of a fluctuation is always zero.

  8. 8.

    A formulation which keeps the spin variable can be found in [21].

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Hong, SM., Pham, AT., Jungemann, C. (2011). The Boltzmann Transport Equation and Its Projection onto Spherical Harmonics. In: Deterministic Solvers for the Boltzmann Transport Equation. Computational Microelectronics. Springer, Vienna. https://doi.org/10.1007/978-3-7091-0778-2_2

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  • DOI: https://doi.org/10.1007/978-3-7091-0778-2_2

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