ICODE-ADC/lammps
4
0
Fork 0
Code Issues Pull Requests Actions Packages Projects Releases Wiki Activity

Update pair_lj_charmmfsw_coul_long_kokkos.cpp

Browse Source
This commit is contained in:
alphataubio
2024-07-07 16:55:39 -04:00
parent 06e8f8eab2
commit c77d2d952d
1 changed files with 0 additions and 1 deletions
Download Patch File Download Diff File Expand all files Collapse all files

1
src/KOKKOS/pair_lj_charmmfsw_coul_long_kokkos.cpp
View File

@ -463,7 +463,6 @@ double PairLJCharmmfswCoulLongKokkos<DeviceType>::init_one(int i, int j)
k_params.h_view(i,j).lj2 = lj2[i][j]; k_params.h_view(i,j).lj2 = lj2[i][j];
k_params.h_view(i,j).lj3 = lj3[i][j]; k_params.h_view(i,j).lj3 = lj3[i][j];
k_params.h_view(i,j).lj4 = lj4[i][j]; k_params.h_view(i,j).lj4 = lj4[i][j];
//k_params.h_view(i,j).offset = offset[i][j];
k_params.h_view(i,j).cut_ljsq = cut_ljsq; k_params.h_view(i,j).cut_ljsq = cut_ljsq;
k_params.h_view(i,j).cut_coulsq = cut_coulsq; k_params.h_view(i,j).cut_coulsq = cut_coulsq;