Loading src/create_atoms.cpp +6 −1 Original line number Diff line number Diff line Loading @@ -809,6 +809,7 @@ void CreateAtoms::add_lattice() void CreateAtoms::lattice_mask() { // Nmask will be used to choose which lattice points to insert Nmask = new int[nlattpts]; for (int i = 0; i < nlattpts; i++) Nmask[i] = 1; Loading @@ -833,6 +834,10 @@ void CreateAtoms::lattice_mask() nboxme = round(nbox*nlattpts/total_lattpts); // limit nboxme to available lattice points on this processor if (nboxme > nlattpts) nboxme = nlattpts; // readjust so that all nboxme's add to exactly nbox int sum_nboxme; Loading Loading @@ -867,7 +872,7 @@ void CreateAtoms::lattice_mask() // should have guaranteed success at this point if (failed_all == nprocs) error->warning(FLERR,"This is an uncaught error. Ask developer"); } delete [] allnlattpts; } else nboxme = nbox; // let's insert N particles onto available lattice points by instead Loading Loading
src/create_atoms.cpp +6 −1 Original line number Diff line number Diff line Loading @@ -809,6 +809,7 @@ void CreateAtoms::add_lattice() void CreateAtoms::lattice_mask() { // Nmask will be used to choose which lattice points to insert Nmask = new int[nlattpts]; for (int i = 0; i < nlattpts; i++) Nmask[i] = 1; Loading @@ -833,6 +834,10 @@ void CreateAtoms::lattice_mask() nboxme = round(nbox*nlattpts/total_lattpts); // limit nboxme to available lattice points on this processor if (nboxme > nlattpts) nboxme = nlattpts; // readjust so that all nboxme's add to exactly nbox int sum_nboxme; Loading Loading @@ -867,7 +872,7 @@ void CreateAtoms::lattice_mask() // should have guaranteed success at this point if (failed_all == nprocs) error->warning(FLERR,"This is an uncaught error. Ask developer"); } delete [] allnlattpts; } else nboxme = nbox; // let's insert N particles onto available lattice points by instead Loading
