git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9600 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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@ -189,12 +189,12 @@ Respa::Respa(LAMMPS *lmp, int narg, char **arg) : Integrate(lmp, narg, arg)
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}
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if (level_pair == -1 && level_middle == -1) {
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if (level_inner < level_improper || level_outer < level_inner ||
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level_kspace != level_outer)
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level_kspace < level_outer)
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error->all(FLERR,"Invalid order of forces within respa levels");
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}
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if (level_pair == -1 && level_middle >= 0) {
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if (level_inner < level_improper || level_middle < level_inner ||
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level_outer < level_inner || level_kspace != level_outer)
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level_outer < level_inner || level_kspace < level_outer)
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error->all(FLERR,"Invalid order of forces within respa levels");
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}
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