Chapter 7. The Eigenvalue Problem
Chapter 7. The Eigenvalue Problem
Chapter 7. The Eigenvalue Problem
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<strong>7.</strong> <strong>The</strong> <strong>Eigenvalue</strong> <strong>Problem</strong>, December 17, 2009 27<br />
Appendix <strong>7.</strong>2. Matrix diagonalization<br />
<strong>The</strong> following theorem is often used to simplify proofs and calculations.<br />
<strong>The</strong>orem. For any Hermitian matrix Ĥ there is a unitary matrix U such that<br />
U −1 ĤU is a diagonal matrix Λ (143)<br />
and the eigenvalues of H are the diagonal elements of Λ.<br />
Whenever we talk about equations involving matrices, their elements are<br />
calculated with the same basis set {|e(i)} N i=1. Since Ĥ is Hermitian, it has<br />
a set of eigenkets {|x(i)} N i=1 that satisfy the eigenvalue equation<br />
Ĥ|x(i) = λ i |x(i), i =1,...,N (144)<br />
Define the operator Û through |x(i) ≡Û|e(i) (145)<br />
Because {|e(i)} N i=1 and {|x(i)} N i=1 are both orthonormal, complete basis sets,<br />
Û is unitary (see Property 14 in <strong>Chapter</strong> 4). Replace |x(i) in the eigenvalue<br />
equation (Eq. 144) with Û|e(i) andthenapplyÛ −1 to both sides of the<br />
resulting equation. <strong>The</strong> result is<br />
Û −1 ĤÛ|e(i) = λ i|e(i), i =1,...,N (146)<br />
Act on this with e(j)| and use e(j) | e(i) = δ ji to obtain<br />
e(j) | Û −1 ĤÛ | e(i) = λ iδ ji ≡ Λ ji , i,j =1,...,N (147)<br />
<strong>The</strong> expression e(j) | Û −1 ĤÛ | e(i) is the matrix element of the operator<br />
Û −1 ĤÛ in the {|e(j)} representation. <strong>The</strong> matrix Λ (having elements Λ ji =<br />
λ i δ ji ) is diagonal:<br />
⎛<br />
⎞<br />
λ 1 0 0 ··· 0<br />
0 λ 2 0 ··· 0<br />
Λ =<br />
0 0 λ 3 ··· 0<br />
(148)<br />
⎜<br />
. ⎝ . . . .. .<br />
⎟<br />
⎠<br />
0 0 0 ··· λ N