next up previous
Next: About this document ... Up: Variational Theory and the Previous: Example I: The harmonic

Example II: The harmonic oscillator revisited

Suppose we guessed, instead, a trial wave function of the form:

\begin{displaymath}
\psi(x) = {1 \over x^2 + a^2} \equiv \psi(x;a)
\end{displaymath}

The potential and this trial wavefunction are illustrated in the figure below:



figure=lec10_fig3.eps,height=4.0in,width=4.5in

Figure 2:


We now regard $a$ as a variational parameter. Thus,

\begin{displaymath}
\langle \psi\vert\psi\rangle = \int_{-\infty}^{\infty}\;dx\;{1 \over (x^2+a^2)^2}
\end{displaymath}

This integral can be evaluated easily by a trigonometric substitution:
$\displaystyle x$ $\textstyle =$ $\displaystyle a\tan\theta$  
$\displaystyle dx$ $\textstyle =$ $\displaystyle a\sec^2\theta$  

from which
$\displaystyle \langle \psi\vert\psi\rangle$ $\textstyle =$ $\displaystyle \int_{-\pi/2}^{\pi/2}\;{a\sec^2\theta d\theta \over
a^4(1+\tan^2\theta)^2 }$  
       
  $\textstyle =$ $\displaystyle {1 \over a^3}\int_{-\pi/2}^{\pi/2}\cos^2\theta\;d\theta = {\pi \over 2a^3}$  

With a little algebra, it can be similarly shown that

\begin{displaymath}
\langle \psi\vert H\vert\psi\rangle = {\pi \hbar^2 \over 8ma^5} + {\pi m\omega^2 \over 4a}
\end{displaymath}

Thus,

\begin{displaymath}
{\langle \psi\vert H\vert\psi\rangle \over \langle \psi\vert...
...e } = {\hbar^2 \over 4ma^2} +
{1 \over 2}m\omega^2 a^2 = E(a)
\end{displaymath}

Now, minimizing with respect to $a$, we find
$\displaystyle E'(a) = {dE \over da}$ $\textstyle =$ $\displaystyle 0$  
$\displaystyle -{\hbar^2 \over 2ma^3} + m\omega^2 a$ $\textstyle =$ $\displaystyle 0$  
$\displaystyle a^2$ $\textstyle =$ $\displaystyle {\hbar \sqrt{2}m\omega}$  

and the energy is obtained by
$\displaystyle E(a_{\rm min})$ $\textstyle =$ $\displaystyle {\hbar^2 \over 4m}{\sqrt{2}m\omega \over \hbar} +
{1 \over 2}m\omega^2 {\hbar \over \sqrt{2}m\omega}$  
  $\textstyle =$ $\displaystyle {\hbar \omega \over \sqrt{2}} > {\hbar \omega \over 2}$  

The result is larger than the true ground state energy, as expected. The error made by this trial wavefunction is

\begin{displaymath}
{E(a_{{\rm min}}) - E_0 \over E_0} =
{\hbar \omega/\sqrt{2}...
...omega/2 \over \hbar\omega/2} = \sqrt{2}-1 \approx 0.41 = 41 \%
\end{displaymath}

which is a relatively large error.


next up previous
Next: About this document ... Up: Variational Theory and the Previous: Example I: The harmonic
Mark Tuckerman 2005-01-27