diff --git a/src/MANYBODY/pair_atm.cpp b/src/MANYBODY/pair_atm.cpp index 81adef5871..f7eda909e6 100644 --- a/src/MANYBODY/pair_atm.cpp +++ b/src/MANYBODY/pair_atm.cpp @@ -128,9 +128,9 @@ void PairATM::compute(int eflag, int vflag) rij[0] = x[j][0] - xi; if (rij[0] < 0.0) continue; rij[1] = x[j][1] - yi; - if (rij[0] == 0.0 and rij[1] < 0.0) continue; + if (rij[0] == 0.0 && rij[1] < 0.0) continue; rij[2] = x[j][2] - zi; - if (rij[0] == 0.0 and rij[1] == 0.0 and rij[2] < 0.0) continue; + if (rij[0] == 0.0 && rij[1] == 0.0 && rij[2] < 0.0) continue; rij2 = rij[0]*rij[0] + rij[1]*rij[1] + rij[2]*rij[2]; if (rij2 > cutoff_squared) continue; @@ -141,9 +141,9 @@ void PairATM::compute(int eflag, int vflag) rik[0] = x[k][0] - xi; if (rik[0] < 0.0) continue; rik[1] = x[k][1] - yi; - if (rik[0] == 0.0 and rik[1] < 0.0) continue; + if (rik[0] == 0.0 && rik[1] < 0.0) continue; rik[2] = x[k][2] - zi; - if (rik[0] == 0.0 and rik[1] == 0.0 and rik[2] < 0.0) continue; + if (rik[0] == 0.0 && rik[1] == 0.0 && rik[2] < 0.0) continue; rik2 = rik[0]*rik[0] + rik[1]*rik[1] + rik[2]*rik[2]; if (rik2 > cutoff_squared) continue; diff --git a/src/OPENMP/npair_half_size_multi_newton_omp.cpp b/src/OPENMP/npair_half_size_multi_newton_omp.cpp index cdc68e1b42..bcf87d385c 100644 --- a/src/OPENMP/npair_half_size_multi_newton_omp.cpp +++ b/src/OPENMP/npair_half_size_multi_newton_omp.cpp @@ -108,7 +108,7 @@ void NPairHalfSizeMultiNewtonOmp::build(NeighList *list) // if j is ghost, only store if j coords are "above and to the right" of i for (j = js; j >= 0; j = bins[j]) { - if(icollection != jcollection and j < i) continue; + if(icollection != jcollection && j < i) continue; if (j >= nlocal) { if (x[j][2] < ztmp) continue; diff --git a/src/REAXFF/fix_reaxff_species.cpp b/src/REAXFF/fix_reaxff_species.cpp index 856020227d..897f36d988 100644 --- a/src/REAXFF/fix_reaxff_species.cpp +++ b/src/REAXFF/fix_reaxff_species.cpp @@ -253,7 +253,7 @@ FixReaxFFSpecies::~FixReaxFFSpecies() else fclose(fp); if (posflag && multipos_opened) fclose(pos); } - + modify->delete_compute("SPECATOM"); modify->delete_fix("SPECBOND"); }