Book contents
- Frontmatter
- Contents
- Preface
- 1 Introductory discussion of the perovskites
- 2 Review of the quantum mechanics of N-electron systems
- 3 Empirical LCAO model
- 4 LCAO energy band model for cubic perovskites
- 5 Analysis of bands at symmetry points
- 6 Density of states
- 7 Optical properties of the d-band perovskites
- 8 Photoemission from perovskites
- 9 Surface states on d-band perovskites
- 10 Distorted perovskites
- 11 High-temperature superconductors
- Appendices
- A Physical constants and the complete elliptic integral of the first kind
- B The delta function
- C Lattice Green's function
- D Surface and bulk Madelung potentials for the ABO3 structure
- Index
B - The delta function
from Appendices
Published online by Cambridge University Press: 23 December 2009
- Frontmatter
- Contents
- Preface
- 1 Introductory discussion of the perovskites
- 2 Review of the quantum mechanics of N-electron systems
- 3 Empirical LCAO model
- 4 LCAO energy band model for cubic perovskites
- 5 Analysis of bands at symmetry points
- 6 Density of states
- 7 Optical properties of the d-band perovskites
- 8 Photoemission from perovskites
- 9 Surface states on d-band perovskites
- 10 Distorted perovskites
- 11 High-temperature superconductors
- Appendices
- A Physical constants and the complete elliptic integral of the first kind
- B The delta function
- C Lattice Green's function
- D Surface and bulk Madelung potentials for the ABO3 structure
- Index
Summary
As we have seen in Chapter 6 the δ function (sometimes called the Dirac delta function) is a useful mathematical tool. In this Appendix we derive formulae for the representation of the delta functions employed in Chapter 6.
The δ function is defined by its properties:
where f(x) and its derivative are continuous, single-valued functions and the integral is over any range containing x0. The result, ∫ δ(x – x0) dx = 1, follows from (B.2) for f(x) = 1. Another property, δ(x – x0) → ∞ as x → x0, is implied by (B.1) and (B.2). Clearly if (B.1) holds, the δ function must be arbitrarily large at x0 if (B.2) is valid.
There are numerous analytical representations of the delta function. We shall use a frequently employed representation wherein δ(x – x0) is the limit of a particular function:
where “ℑM” indicates the imaginary part of the quantity and λ is a small positive number. In using this representation there is an implied order of doing things. The limiting process λ → 0 (λ > 0) is to be performed last. This means one must calculate the imaginary part first, then take the limit as λ → 0. This limiting process is often indicated by using the symbol 0+ as we did in Chapter 6.
The imaginary part of (B.3) is
It is easy to show that the delta function defined by (B.4) satisfies the equations (B.1) and (B.2).
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- Electronic and Optical Properties of d-Band Perovskites , pp. 288 - 290Publisher: Cambridge University PressPrint publication year: 2006