Commit a68f3a93 authored by Tim Mattox's avatar Tim Mattox
Browse files

USER-DPD Kokkos: bugfix, add a misisng line of code in pair_exp6_rx_kokkos.cpp

parent fff43a46

src/KOKKOS/pair_exp6_rx_kokkos.cpp

+1 −0
Original line number Diff line number Diff line
@@ -917,6 +917,7 @@ void PairExp6rxKokkos<DeviceType>::getMixingWeights(int id,double &epsilon1,doub 
      nMoleculesOld2 = dvector(ispecies+nspecies,id);

      nMolecules2 = dvector(ispecies,id);

      fractionOld2 = dvector(ispecies+nspecies,id)/nTotalold;

      fraction2 = nMolecules2/nTotal;

    }



    // If Site1 or Site2 matches is a fluid, then compute the paramters

CRA Git | Maintained and supported by SUSTech CRA and CCSE