Subroutine do

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Subroutine `do_relax`

$\begin{boxedminipage}{\textwidth} \begin{verbatim}call do_relax(mpot,at,rel_tol,rel_iter, & [n_iter,const_vol])\end{verbatim} \end{boxedminipage}$

mpot -- type(MetaPotential), intent(inout)

at -- type(Atoms), intent(inout)

rel_tol -- real(dp), intent(in)

rel_iter -- integer, intent(in)

n_iter -- integer, intent(out), optional

const_vol -- logical, intent(in), optional

calc_energy subroutine

gabor 2009-06-30