Removing itemized energy, added pvector support

  bytes += matmax * sizeof(double);

  return bytes;

}

/* ----------------------------------------------------------------------

   print out the itemized energies to the log file

   this is not currently called, but should

   be made available to the user in some way

------------------------------------------------------------------------- */

void PairREAX::output_itemized_energy(double energy_charge_equilibration)

{

  double etmp[14],etmp2[14];

  etmp[0] = FORTRAN(cbkenergies, CBKENERGIES).eb;

  etmp[1] = FORTRAN(cbkenergies, CBKENERGIES).ea;

  etmp[2] = FORTRAN(cbkenergies, CBKENERGIES).elp;

  etmp[3] = FORTRAN(cbkenergies, CBKENERGIES).emol;

  etmp[4] = FORTRAN(cbkenergies, CBKENERGIES).ev;

  etmp[5] = FORTRAN(cbkenergies, CBKENERGIES).epen;

  etmp[6] = FORTRAN(cbkenergies, CBKENERGIES).ecoa;

  etmp[7] = FORTRAN(cbkenergies, CBKENERGIES).ehb;

  etmp[8] = FORTRAN(cbkenergies, CBKENERGIES).et;

  etmp[9] = FORTRAN(cbkenergies, CBKENERGIES).eco;

  etmp[10] = FORTRAN(cbkenergies, CBKENERGIES).ew;

  etmp[11] = FORTRAN(cbkenergies, CBKENERGIES).ep;

  etmp[12] = FORTRAN(cbkenergies, CBKENERGIES).efi;

  etmp[13] = energy_charge_equilibration;

  MPI_Allreduce(etmp,etmp2,14,MPI_DOUBLE,MPI_SUM,world);

  if (comm->me == 0) {

    if (screen) {

      fprintf(screen,"eb = %g \n",etmp2[0]);

      fprintf(screen,"ea = %g \n",etmp2[1]);

      fprintf(screen,"elp = %g \n",etmp2[2]);

      fprintf(screen,"emol = %g \n",etmp2[3]);

      fprintf(screen,"ev = %g \n",etmp2[4]);

      fprintf(screen,"epen = %g \n",etmp2[5]);

      fprintf(screen,"ecoa = %g \n",etmp2[6]);

      fprintf(screen,"ehb = %g \n",etmp2[7]);

      fprintf(screen,"et = %g \n",etmp2[8]);

      fprintf(screen,"eco = %g \n",etmp2[9]);

      fprintf(screen,"ew = %g \n",etmp2[10]);

      fprintf(screen,"ep = %g \n",etmp2[11]);

      fprintf(screen,"efi = %g \n",etmp2[12]);

      fprintf(screen,"eqeq = %g \n",etmp2[13]);

    }

    if (logfile) {

      fprintf(logfile,"eb = %g \n",etmp2[0]);

      fprintf(logfile,"ea = %g \n",etmp2[1]);

      fprintf(logfile,"elp = %g \n",etmp2[2]);

      fprintf(logfile,"emol = %g \n",etmp2[3]);

      fprintf(logfile,"ev = %g \n",etmp2[4]);

      fprintf(logfile,"epen = %g \n",etmp2[5]);

      fprintf(logfile,"ecoa = %g \n",etmp2[6]);

      fprintf(logfile,"ehb = %g \n",etmp2[7]);

      fprintf(logfile,"et = %g \n",etmp2[8]);

      fprintf(logfile,"eco = %g \n",etmp2[9]);

      fprintf(logfile,"ew = %g \n",etmp2[10]);

      fprintf(logfile,"ep = %g \n",etmp2[11]);

      fprintf(logfile,"efi = %g \n",etmp2[12]);

      fprintf(logfile,"eqeq = %g \n",etmp2[13]);

    }

  }

}