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Matthieu Verstraete edited Schroedinger equation.tex
over 9 years ago
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In one dimensional systems the Hamiltonian for $N$ electrons has the following form
\begin{equation}
\label{eq:1dham}
\hat{H}=\sum_{j=1}^N \left(-\frac{d^2}{dx_j^2}+v_{ext}(x_j)\right)+\sum_{\stackrel{\scriptstyle j,k=1}{j\neq
k}}^N\frac{1}{\sqrt{(x_j-x_k)^2+1}}, k}}^N v_{int}(x_j, x_k),
\end{equation}
where the
usual Coulomb interaction
has been potential is usually Coulombic, though for the following any type (including more than 2 body) will do. In 1D $v_{int}$ is often replaced by the soft-Coulomb
interaction, interaction ($ \frac{1}{\sqrt{(x_j-x_k)^2+1}$), the last term in Eq.\ (\ref{eq:1dham}), in order to avoid the divergence at $x_j=x_k$ which is
non-integrable in one dimension. non-integrable. Mathematically, the Hamiltonian (\ref{eq:1dham}) is equivalent to
the one that of a single electron in $N$
dimensions dimensions, with the $N$-dimensional external potential
\begin{equation}
v_{ext}^{Nd}(x_1...x_N)=\sum_{j=1}^N v_{ext}(x_j)+\sum_{\stackrel{\scriptstyle j,k=1}{j\neq
k}}^N\frac{1}{\sqrt{(x_j-x_k)^2+1}}. k}}^N v_{int}(x_j, x_k)}.
\end{equation}
For small $N$ one can numerically solve the $N$-dimensional Schr\"odinger equation
\begin{equation}