print warning about minimization energy with fix box/relax
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@ -123,6 +123,12 @@ Minimization requires that neigh_modify settings be delay = 0, every =
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changed them and will restore them to their original values after the
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minimization.
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W: Energy due to X extra global DOFs will be included in minimizer energies
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When using fixes like box/relax, the potential energy used by the minimizer
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is augmented by an additional energy provided by the fix. Thus the printed
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converged energy may be different from the total potential energy.
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E: Minimization could not find thermo_pe compute
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This compute is created by the thermo command. It must have been
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