Commit e493b6a6 authored by Markus Hoehnerbach's avatar Markus Hoehnerbach
Browse files

Fix sigcut class variable actually used

parent 8c3f6947

src/MANYBODY/pair_airebo.cpp

+1 −3
Original line number Diff line number Diff line
@@ -534,7 +534,7 @@ void PairAIREBO::FLJ(int eflag, int vflag) 
  double delij[3],rijsq,delik[3],rik,deljk[3];

  double rkj,wkj,dC,VLJ,dVLJ,VA,Str,dStr,Stb;

  double vdw,slw,dvdw,dslw,drij,swidth,tee,tee2;

  double rljmin,rljmax,sigcut,sigmin;

  double rljmin,rljmax;

  double delkm[3],rkm,deljm[3],rmj,wmj,r2inv,r6inv,scale,delscale[3];

  int *ilist,*jlist,*numneigh,**firstneigh;

  int *REBO_neighs_i,*REBO_neighs_k;
@@ -550,8 +550,6 @@ void PairAIREBO::FLJ(int eflag, int vflag) 
  evdwl = 0.0;

  rljmin = 0.0;

  rljmax = 0.0;

  sigcut = 0.0;

  sigmin = 0.0;



  double **x = atom->x;

  double **f = atom->f;

src/USER-OMP/pair_airebo_omp.cpp

+1 −3
Original line number Diff line number Diff line
@@ -294,7 +294,7 @@ void PairAIREBOOMP::FLJ_thr(int ifrom, int ito, int evflag, int eflag, 
  double delij[3],rijsq,delik[3],rik,deljk[3];

  double rkj,wkj,dC,VLJ,dVLJ,VA,Str,dStr,Stb;

  double vdw,slw,dvdw,dslw,drij,swidth,tee,tee2;

  double rljmin,rljmax,sigcut,sigmin;

  double rljmin,rljmax;

  double delkm[3],rkm,deljm[3],rmj,wmj,r2inv,r6inv,scale,delscale[3];

  int *ilist,*jlist,*numneigh,**firstneigh;

  int *REBO_neighs_i,*REBO_neighs_k;
@@ -310,8 +310,6 @@ void PairAIREBOOMP::FLJ_thr(int ifrom, int ito, int evflag, int eflag, 
  evdwl = 0.0;

  rljmin = 0.0;

  rljmax = 0.0;

  sigcut = 0.0;

  sigmin = 0.0;



  const double * const * const x = atom->x;

  double * const * const f = thr->get_f();

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