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The Variational Principle

The stationary Schrödinger equation
$\displaystyle \hat{H}\Psi = \varepsilon \Psi$     (3.1)

can be derived from a variational principle. For the ground state of the system, this is formulated as a problem of finding the wave vector \bgroup\color{col1}$ \Psi$\egroup of the system among all possible wave vectors such that the expectation value of the energy (i.e., the Hamiltonian) is minimized,
$\displaystyle \langle \Psi\vert \hat{H} \vert \Psi \rangle =$   min$\displaystyle ,\quad \langle \Psi \vert \Psi\rangle =1,$     (3.2)

under the additional condition that \bgroup\color{col1}$ \Psi$\egroup be normalised. We are therefore looking for a minimum of the energy functional
$\displaystyle E[\Psi]\equiv \langle \Psi\vert \hat{H} \vert \Psi \rangle$     (3.3)

under the additional condition that \bgroup\color{col1}$ \Psi$\egroup be normalised.



Subsections

Tobias Brandes 2005-04-26