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src/minimize_energy.jl

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@@ -123,6 +123,8 @@ can also be employed. Note, that in principle all such solvers should work, but
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tested a small fraction and you can expect that minor modifications are needed to make
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some solvers work (PRs appreciated!). In general only first-order or second-order methods work.
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See [`GeometryOptimization.clamp_atoms`](@ref) for an experimental way how to clamp atoms.
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## Keyword arguments:
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- `variablecell`: Determines whether the cell is fixed or allowed to change during optimization
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- `maxiters`: Maximal number of iterations

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