Commit 27553283 authored by Axel Kohlmeyer's avatar Axel Kohlmeyer
Browse files

fix bug with pair_modify <style> compute not triggering the correct global change

parent df56b2d6

src/pair.cpp

+1 −1
Original line number Diff line number Diff line
@@ -75,7 +75,7 @@ Pair::Pair(LAMMPS *lmp) : Pointers(lmp) 
  ewaldflag = pppmflag = msmflag = dispersionflag = tip4pflag = dipoleflag = 0;

  reinitflag = 1;



  // pair_modify settingsx

  // pair_modify settings



  compute_flag = 1;

  manybody_flag = 0;

src/pair_hybrid.cpp

+9 −3
Original line number Diff line number Diff line
@@ -832,6 +832,12 @@ void PairHybrid::modify_params(int narg, char **arg) 
    Pair::modify_params(narg,arg);

    for (int m = 0; m < nstyles; m++) styles[m]->modify_params(narg,arg);

  }



  // reset global compute_flag since there may have been changes

  // to any of the substyles

  compute_flag = 0;

  for (int m = 0; m < nstyles; m++)

    if (styles[m]->compute_flag) compute_flag = 1;

}



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