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Merge pull request #248 from akohlmey/collected-small-fixes

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collected small bugfixes and updates
This commit is contained in:
sjplimp
2016-11-04 10:58:42 -06:00
committed by GitHub
parent 32e0a58343 7d23a0737e
commit f0131393e0
61 changed files with 100 additions and 50 deletions
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src/KSPACE/pair_lj_long_coul_long.cpp
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@ -130,6 +130,7 @@ PairLJLongCoulLong::~PairLJLongCoulLong()
memory->destroy(offset);
}
if (ftable) free_tables();
if (fdisptable) free_disp_tables();
}
/* ----------------------------------------------------------------------
@ -282,8 +283,8 @@ void PairLJLongCoulLong::init_style()
// setup force tables
if (ncoultablebits) init_tables(cut_coul,cut_respa);
if (ndisptablebits) init_tables_disp(cut_lj_global);
if (ncoultablebits && (ewald_order&(1<<1))) init_tables(cut_coul,cut_respa);
if (ndisptablebits && (ewald_order&(1<<6))) init_tables_disp(cut_lj_global);
}