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Program Structure

The mchf program, Figure  6.10 performs data initialization (using inita() and initr()), data(), and applies the SCF procedure. Output data, including the wave function approximation are written by (output(), summry(), wfn(), eig_out()).

Figure 6.10: main() of the mchf program: data initialization, scf() iterations, data output
\begin{figure}\centerline{ \psfig{file=tex/fig/mchf_main.epsi}}\end{figure}



Subsections

2001-10-11