Commit 1fc3b461 authored by Axel Kohlmeyer's avatar Axel Kohlmeyer
Browse files

remove dead code and silence compiler warnings

parent eae9d27f
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+1 −1
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@@ -107,7 +107,7 @@ void PairBodyRoundedPolygon::compute(int eflag, int vflag)
  int nei,nej,iefirst,jefirst;
  double xtmp,ytmp,ztmp,delx,dely,delz,evdwl;
  double rsq,rsqinv,r,radi,radj,eradi,eradj,rradi,rradj,k_nij,k_naij;
  double xi[3],xj[3],facc[3];
  double facc[3];
  int *ilist,*jlist,*numneigh,**firstneigh;

  evdwl = 0.0;
+0 −8
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@@ -274,14 +274,6 @@ double PairNMCut::init_one(int i, int j)
    }
    MPI_Allreduce(count,all,2,MPI_DOUBLE,MPI_SUM,world);

    double rr1 = mm[i][j]*(nn[i][j]-1)*pow(r0[i][j],nn[i][j]);
    double rr2 = nn[i][j]*(mm[i][j]-1)*pow(r0[i][j],mm[i][j]);
    double p1 = 1-nn[i][j];
    double p2 = 1-mm[i][j];

    double rrr1 = pow(r0[i][j],nn[i][j])*(1-nn[i][j]);
    double rrr2 = pow(r0[i][j],mm[i][j])*(1-mm[i][j]);

    double cut3 = cut[i][j]*cut[i][j]*cut[i][j];
    ptail_ij = 2.*MY_PI/3.*all[0]*all[1]*e0nm[i][j]*nm[i][j]*cut3 *
      (pow(r0[i][j]/cut[i][j],nn[i][j])/(nn[i][j]-3) - pow(r0[i][j]/cut[i][j],mm[i][j])/(mm[i][j]-3));
+0 −8
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@@ -324,14 +324,6 @@ double PairNMCutCoulCut::init_one(int i, int j)
    }
    MPI_Allreduce(count,all,2,MPI_DOUBLE,MPI_SUM,world);

    double rr1 = mm[i][j]*(nn[i][j]-1)*pow(r0[i][j],nn[i][j]);
    double rr2 = nn[i][j]*(mm[i][j]-1)*pow(r0[i][j],mm[i][j]);
    double p1 = 1-nn[i][j];
    double p2 = 1-mm[i][j];

    double rrr1 = pow(r0[i][j],nn[i][j])*(1-nn[i][j]);
    double rrr2 = pow(r0[i][j],mm[i][j])*(1-mm[i][j]);

    double cut_lj3 = cut_lj[i][j]*cut_lj[i][j]*cut_lj[i][j];
    ptail_ij = 2.*MY_PI/3.*all[0]*all[1]*e0nm[i][j]*nm[i][j]*cut_lj3 *
      (pow(r0[i][j]/cut_lj[i][j],nn[i][j])/(nn[i][j]-3) - pow(r0[i][j]/cut_lj[i][j],mm[i][j])/(mm[i][j]-3));
+0 −8
Original line number Diff line number Diff line
@@ -371,14 +371,6 @@ double PairNMCutCoulLong::init_one(int i, int j)
    }
    MPI_Allreduce(count,all,2,MPI_DOUBLE,MPI_SUM,world);

    double rr1 = mm[i][j]*(nn[i][j]-1)*pow(r0[i][j],nn[i][j]);
    double rr2 = nn[i][j]*(mm[i][j]-1)*pow(r0[i][j],mm[i][j]);
    double p1 = 1-nn[i][j];
    double p2 = 1-mm[i][j];

    double rrr1 = pow(r0[i][j],nn[i][j])*(1-nn[i][j]);
    double rrr2 = pow(r0[i][j],mm[i][j])*(1-mm[i][j]);

    double cut_lj3 = cut_lj[i][j]*cut_lj[i][j]*cut_lj[i][j];
    ptail_ij = 2.*MY_PI/3.*all[0]*all[1]*e0nm[i][j]*nm[i][j]*cut_lj3 *
      (pow(r0[i][j]/cut_lj[i][j],nn[i][j])/(nn[i][j]-3) - pow(r0[i][j]/cut_lj[i][j],mm[i][j])/(mm[i][j]-3));
+1 −1
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@@ -943,7 +943,7 @@ double FixCMAP::dihedral_angle_atan2(double fx, double fy, double fz,
{
  // calculate the dihedral angle

  double angle, arg1, arg2;
  double angle = 0.0, arg1, arg2;

  arg1 = absg*(fx*bx+fy*by+fz*bz);
  arg2 = ax*bx+ay*by+az*bz;
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