[QMSE] W03 - Completeness and Orthogonality
sets of functions
- the set of eigenfunctions for a particle in a box has a property called completeness
physical example of completeness
- consider loudspeaker cone producing sound
- the cone diaphragm movement is completely described by the observed position in time
- equivalently it is also described by the set of the various frequencies that drive it
- this is together called completeness
formally
- the position of the diaphragm as a function of time can be replaced by
- a set of different frequency components with different amplitudes
- the phases of the different components has to be known
- i.e. where the sine waves start
- this replacement is done using fourier analysis
- the method of representing the motion in terms of different frequency components
- is called fourier series
- a set of different frequency components with different amplitudes
- fourier analysis is just a specific case of a more general mathematical concept
completeness of eigenfunctions
- consider some random function of a particle in a box that is formally zero at the walls
- this function can be written as a sum of
- weighted sum of EFs (eigenfunctions)
- EFs are a mathematical set of functions that can be used
- to completely describe any function that sits between the walls
- in terms of the heights of the function at each different horizontal position
fourier series over time
- suppose we are interested in the behavior of some function
- such a loudspeaker cone displacement, which generates sound
- from time \(0\) to time \(t_0\)
- presuming it starts and ends at \( 0 \) displacement
- the corresponding fourier series would be \[ f(t) = \sum_{n=1}^{\infty} a_n \left( \frac{n\pi t}{t_0} \right) \]
- i.e. any function \(f(t)\) can be written as a sum of sine waves of different frequencies
- the frequencies differ by the factor \(n\)
- \(a_n\) are the amplitudes of corresponding component sine waves
fourier series over space
- consider some function \(f(z)\) over the distance \(L_z\)
- from \(z = 0 \) to \( z = L_z \)
- and that started and ended at 0 height
- i.e. amplitude is \(0\) at the walls
- the fourier series is given by
\[ f(z) = \sum_{n=1}^{\infty} a_n \sin{ \left( \frac{n \pi z }{L_z}\right)} \]
- the frequencies differ by the factor \(n\)
- \(a_n\) are the amplitudes of corresponding component sine waves
normalized eigenfuntions
- consider the set of normalized eigenfunctions derived for a particle in a box \[ \psi_n(z) = \sqrt{ \frac{2}{L_z}} \sin{\left( \frac{n\pi z}{L_z} \right) } \]
- with a substitution, the normalized waves can be used as the building blocks of the fourier series \[ f(z) = \sum_{n=1}^{\infty} a_n \sin{\left( \frac{n\pi z}{L_z} \right)} = \sum_{n=1}^{\infty} b_n \psi_n(z) \] \[ \text{ where } b_n = a_n \sqrt{ \frac{L_z}{2}} \]
- this \( b_n\) based function is a mathematical statement that is true for any function between \(0\) and \(L_z\)
- whose amplitude is \(0\) at the walls at \(0\) and \(L_z\)
- is not necessarily a solution to the particle in a box problem
expansion in eigenfunctions
- restating the mathematics of normalized wave functions
\[ f(z) = \sum_{n=1}^{\infty} b_n \psi_n(z) \]
- is the expansion of \( f(z) \) in the complete set of normalized eigenfunctions \( \psi_n(z) \)
- fourier series is connected to the normalized set of any eigenfunctions
- by the means of completeness property
- this is a purely mathematical statement
- can be applied to any other set of eigenfunctions
- a set of functions such as the \( \psi_n(z) \) can be used to represent a function \(f(z)\)
- \( \psi_n(z) \) acts as ‘basis set of functions’ or simply ‘basis’ of its space
- keeping in mind \(f(z)\) is some function
- in the space of the set of functions \( \psi_n(z) \)
- and whose amplitude is \(0\) at the walls
- the set of expansion coefficients \(b_n\) (amplitudes) in \(f(z)\)
- is the representation of \(f(z)\)
- in the basis \(\psi_n(z)\)
- this works because of the completeness of the set of basis functions
orthogonality of functions
- in addition to being a complete set, the eigenfunctions are also “orthogonal” to one another
- orthogonality in this sense is least like the other
orthogonal functions
-
two non-zero functions \( g(z) \) and \( h(z) \) defined from \(0\) to \(L_z\) if \[ \int_{0}^{L_z} g^{*}(z) h(z) dz = 0 \]
-
all functions in a set of eigenfunctions such as \( \psi_n(z) \) are orthonormal to each other
orthogonality and parity
- functions with opposite parity are always orthogonal
- even parity functions are orthogonal to odd parity functions
- such as the first two particle-in-a-box eigenfunctions
- with sine functions like in the particle-in-a-box eigenfunctions
- even functions with same parity are orthogonal
orthonormality - kronecker delta
- kronecker delta
- \( \delta_{nm} = 0 \text{ for } n \neq m \)
- \( \text{ else } \delta_{nn} = 1 \)
- the orthogonality and the normalization as one condition
\[ \int_{0}^{L_z} \psi_n^{*}(z) \psi_m(z)dz = \delta_{nm} \]
- the orthonormality conditions
- a set of functions that is both
- normalized and
- mutually orthogonal
- is orthonormal
- orthonormal sets allow one particularly useful operation
- finding expansion coefficients
expansion coefficients
- to write the function \( f(x) \) in terms of a complete set of orthonormal functions \( \psi_n(x) \)
\[ f(x) = \sum_{n} c_n \psi_n(x) \]
- where \( c_n \): expansion coefficients
- to find \( c_n \), pre-multiply by \( \psi_m^{*}(x) \) and integrate
\[ \begin{align}
\int \psi_m^{*}(x) f(x) dx & = \int \psi_m^{*}(x) \left[ \sum_n c_n \psi_n(x) \right] dx \\
& = \sum_{n} c_n \int \psi_m^{*} (x) \psi_{n}(x) dx \\
& = \sum_{n} c_n \delta_{mn} \\
& = c_m \end{align} \] - any function in a orthonormal complete set is expandable
- \( \int\psi_{m}^{*}(x)f(x)dx \)
- also called the ‘overlap integral’