| /dports/science/lammps/lammps-stable_29Sep2021/src/REAXFF/ |
| H A D | compute_spec_atom.cpp | 194 int nlocal = atom->nlocal; in pack_q() local
211 int nlocal = atom->nlocal; in pack_x() local
228 int nlocal = atom->nlocal; in pack_y() local
245 int nlocal = atom->nlocal; in pack_z() local
262 int nlocal = atom->nlocal; in pack_vx() local
279 int nlocal = atom->nlocal; in pack_vy() local
296 int nlocal = atom->nlocal; in pack_vz() local
312 int nlocal = atom->nlocal; in pack_abo01() local
326 int nlocal = atom->nlocal; in pack_abo02() local
340 int nlocal = atom->nlocal; in pack_abo03() local
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| /dports/science/liggghts/LIGGGHTS-PUBLIC-3.8.0-26-g6e873439/src/ |
| H A D | compute_property_atom.cpp | 405 int nlocal = atom->nlocal; in pack_id() local
420 int nlocal = atom->nlocal; in pack_molecule() local
435 int nlocal = atom->nlocal; in pack_type() local
451 int nlocal = atom->nlocal; in pack_vol() local
475 int nlocal = atom->nlocal; in pack_eq_radius() local
496 int nlocal = atom->nlocal; in pack_mass() local
519 int nlocal = atom->nlocal; in pack_x() local
534 int nlocal = atom->nlocal; in pack_y() local
549 int nlocal = atom->nlocal; in pack_z() local
564 int nlocal = atom->nlocal; in pack_xs() local
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| H A D | fix_store_state.cpp | 345 int nlocal = atom->nlocal; in FixStoreState() local
623 int nlocal = atom->nlocal; in pack_id() local
638 int nlocal = atom->nlocal; in pack_molecule() local
653 int nlocal = atom->nlocal; in pack_type() local
670 int nlocal = atom->nlocal; in pack_mass() local
693 int nlocal = atom->nlocal; in pack_x() local
708 int nlocal = atom->nlocal; in pack_y() local
723 int nlocal = atom->nlocal; in pack_z() local
738 int nlocal = atom->nlocal; in pack_xs() local
756 int nlocal = atom->nlocal; in pack_ys() local
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| H A D | atom_vec_superquadric.cpp | 895 int nlocal = atom->nlocal; in unpack_exchange() local
959 int nlocal = atom->nlocal; in size_restart() local
1035 int nlocal = atom->nlocal; in unpack_restart() local
1103 int nlocal = atom->nlocal; in create_atom() local
1137 rmass[nlocal] = volume[nlocal] * density[nlocal]; in create_atom()
1152 int nlocal = atom->nlocal; in data_atom() local
1207 rmass[nlocal] = volume[nlocal] * density[nlocal]; in data_atom()
1256 int nlocal = atom->nlocal; in pack_data() local
1290 int nlocal = atom->nlocal; in pack_data() local
1359 int nlocal = atom->nlocal; in pack_vel() local
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| H A D | atom_vec_full.cpp | 707 int nlocal = atom->nlocal; in unpack_exchange() local
768 atom->nlocal++; in unpack_exchange()
781 int nlocal = atom->nlocal; in size_restart() local
868 int nlocal = atom->nlocal; in unpack_restart() local
922 nspecial[nlocal][0] = nspecial[nlocal][1] = nspecial[nlocal][2] = 0; in unpack_restart()
930 atom->nlocal++; in unpack_restart()
941 int nlocal = atom->nlocal; in create_atom() local
962 nspecial[nlocal][0] = nspecial[nlocal][1] = nspecial[nlocal][2] = 0; in create_atom()
974 int nlocal = atom->nlocal; in data_atom() local
984 if (type[nlocal] <= 0 || type[nlocal] > atom->ntypes) in data_atom()
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| H A D | atom_vec_sph.cpp | 645 int nlocal = atom->nlocal; in unpack_exchange() local
672 atom->nlocal++; in unpack_exchange()
685 int nlocal = atom->nlocal; in size_restart() local
738 int nlocal = atom->nlocal; in unpack_restart() local
770 atom->nlocal++; in unpack_restart()
781 int nlocal = atom->nlocal; in create_atom() local
805 atom->nlocal++; in create_atom()
815 int nlocal = atom->nlocal; in data_atom() local
823 if (type[nlocal] <= 0 || type[nlocal] > atom->ntypes) in data_atom()
894 int nlocal = atom->nlocal; in pack_data() local
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| H A D | atom_vec_molecular.cpp | 694 int nlocal = atom->nlocal; in unpack_exchange() local
754 atom->nlocal++; in unpack_exchange()
767 int nlocal = atom->nlocal; in size_restart() local
853 int nlocal = atom->nlocal; in unpack_restart() local
906 nspecial[nlocal][0] = nspecial[nlocal][1] = nspecial[nlocal][2] = 0; in unpack_restart()
914 atom->nlocal++; in unpack_restart()
925 int nlocal = atom->nlocal; in create_atom() local
945 nspecial[nlocal][0] = nspecial[nlocal][1] = nspecial[nlocal][2] = 0; in create_atom()
957 int nlocal = atom->nlocal; in data_atom() local
967 if (type[nlocal] <= 0 || type[nlocal] > atom->ntypes) in data_atom()
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| H A D | fix_contact_history_mesh.cpp | 281 const int nlocal = atom->nlocal; in pre_exchange() local
321 const int nlocal = atom->nlocal; in pre_force() local
377 const int nlocal = atom->nlocal; in sort_contacts() local
413 const int nlocal = atom->nlocal; in markAllContacts() local
468 const int nlocal = atom->nlocal; in cleanUpContactJumps() local
512 const int nlocal = atom->nlocal; in reset_history() local
586 if (!partner_[nlocal] || !contacthistory_[nlocal]) in unpack_exchange()
631 npartner_[nlocal] = ubuf(extra[nlocal][m++]).i; in unpack_restart()
633 partner_[nlocal] = ipage_->get(npartner_[nlocal]); in unpack_restart()
636 if (!partner_[nlocal] || !contacthistory_[nlocal]) in unpack_restart()
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| H A D | fix_contact_property_atom.cpp | 183 int nlocal = atom->nlocal; in pre_exchange() local
334 npartner_[nlocal] = ubuf(buf[m++]).i; in unpack_exchange()
336 partner_[nlocal] = ipage_->get(npartner_[nlocal]); in unpack_exchange()
337 contacthistory_[nlocal] = dpage_->get(dnum_*npartner_[nlocal]); in unpack_exchange()
339 if (partner_[nlocal] == NULL || contacthistory_[nlocal] == NULL) in unpack_exchange()
437 npartner_[nlocal] = ubuf(extra[nlocal][m++]).i; in unpack_restart()
439 partner_[nlocal] = ipage_->get(npartner_[nlocal]); in unpack_restart()
440 contacthistory_[nlocal] = dpage_->get(npartner_[nlocal]*dnum_); in unpack_restart()
442 if (partner_[nlocal] == NULL || contacthistory_[nlocal] == NULL) in unpack_restart()
446 partner_[nlocal][n] = ubuf(extra[nlocal][m++]).i; in unpack_restart()
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| H A D | special.cpp | 95 int nlocal = atom->nlocal; in build() local
466 int nlocal = atom->nlocal; in dedup() local
536 int nlocal = atom->nlocal; in combine() local
680 int nlocal = atom->nlocal; in angle_trim() local
802 int nlocal = atom->nlocal; in dihedral_trim() local
904 int nlocal = atom->nlocal; in ring_one() local
923 int nlocal = atom->nlocal; in ring_two() local
947 int nlocal = atom->nlocal; in ring_three() local
978 int nlocal = atom->nlocal; in ring_four() local
1013 int nlocal = atom->nlocal; in ring_five() local
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| H A D | atom_vec_sphere.cpp | 882 int nlocal = atom->nlocal; in unpack_exchange() local
922 int nlocal = atom->nlocal; in size_restart() local
976 int nlocal = atom->nlocal; in unpack_restart() local
1022 int nlocal = atom->nlocal; in create_atom() local
1040 radius[nlocal]*radius[nlocal]*density[nlocal]; in create_atom()
1042 radius[nlocal]*radius[nlocal]*radius[nlocal] * density[nlocal]; in create_atom()
1057 int nlocal = atom->nlocal; in data_atom() local
1080 radius[nlocal]*radius[nlocal]*density[nlocal]; in data_atom()
1082 radius[nlocal]*radius[nlocal]*radius[nlocal] * density[nlocal]; in data_atom()
1120 radius[nlocal]*radius[nlocal]*radius[nlocal] * density[nlocal]; in data_atom_hybrid()
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| H A D | delete_atoms.cpp | 116 int nlocal = atom->nlocal; in command() local
119 while (i < nlocal) { in command()
121 avec->copy(nlocal-1,i,1); in command()
123 nlocal--; in command()
127 atom->nlocal = nlocal; in command()
181 int nlocal = atom->nlocal; in delete_group() local
207 int nlocal = atom->nlocal; in delete_region() local
254 int nlocal = cptr->atom->nlocal; in molring() local
333 int nlocal = atom->nlocal; in delete_overlap() local
401 if (j < nlocal) { in delete_overlap()
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| H A D | atom_vec_sph_var.cpp | 766 int nlocal = atom->nlocal; in unpack_exchange() local
792 atom->nlocal++; in unpack_exchange()
805 int nlocal = atom->nlocal; in size_restart() local
857 int nlocal = atom->nlocal; in unpack_restart() local
888 atom->nlocal++; in unpack_restart()
899 int nlocal = atom->nlocal; in create_atom() local
923 atom->nlocal++; in create_atom()
933 int nlocal = atom->nlocal; in data_atom() local
941 if (type[nlocal] <= 0 || type[nlocal] > atom->ntypes) in data_atom()
1022 int nlocal = atom->nlocal; in pack_data() local
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| H A D | atom_vec_charge.cpp | 549 int nlocal = atom->nlocal; in unpack_exchange() local
571 atom->nlocal++; in unpack_exchange()
584 int nlocal = atom->nlocal; in size_restart() local
631 int nlocal = atom->nlocal; in unpack_restart() local
658 atom->nlocal++; in unpack_restart()
669 int nlocal = atom->nlocal; in create_atom() local
686 atom->nlocal++; in create_atom()
696 int nlocal = atom->nlocal; in data_atom() local
704 if (type[nlocal] <= 0 || type[nlocal] > atom->ntypes) in data_atom()
720 atom->nlocal++; in data_atom()
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| /dports/science/lammps/lammps-stable_29Sep2021/src/ |
| H A D | compute_property_atom.cpp | 475 int nlocal = atom->nlocal; in pack_id() local
490 int nlocal = atom->nlocal; in pack_molecule() local
504 int nlocal = atom->nlocal; in pack_proc() local
520 int nlocal = atom->nlocal; in pack_type() local
537 int nlocal = atom->nlocal; in pack_mass() local
560 int nlocal = atom->nlocal; in pack_x() local
575 int nlocal = atom->nlocal; in pack_y() local
590 int nlocal = atom->nlocal; in pack_z() local
605 int nlocal = atom->nlocal; in pack_xs() local
623 int nlocal = atom->nlocal; in pack_ys() local
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| H A D | fix_store_state.cpp | 347 int nlocal = atom->nlocal; in FixStoreState() local
662 int nlocal = atom->nlocal; in pack_id() local
677 int nlocal = atom->nlocal; in pack_molecule() local
692 int nlocal = atom->nlocal; in pack_type() local
709 int nlocal = atom->nlocal; in pack_mass() local
732 int nlocal = atom->nlocal; in pack_x() local
747 int nlocal = atom->nlocal; in pack_y() local
762 int nlocal = atom->nlocal; in pack_z() local
777 int nlocal = atom->nlocal; in pack_xs() local
795 int nlocal = atom->nlocal; in pack_ys() local
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| H A D | special.cpp | 75 int nlocal = atom->nlocal; in build() local
164 int nlocal = atom->nlocal; in atom_owners() local
204 int nlocal = atom->nlocal; in onetwo_build_newton() local
265 for (i = 0; i < nlocal; i++) in onetwo_build_newton()
301 int nlocal = atom->nlocal; in onetwo_build_newton_off() local
330 int nlocal = atom->nlocal; in onethree_build() local
433 int nlocal = atom->nlocal; in onefour_build() local
544 int nlocal = atom->nlocal; in dedup() local
616 int nlocal = atom->nlocal; in combine() local
780 int nlocal = atom->nlocal; in angle_trim() local
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| /dports/science/lammps/lammps-stable_29Sep2021/unittest/commands/ |
| H A D | test_mpi_load_balancing.cpp | 88 ASSERT_EQ(lmp->atom->nlocal, 8); in TEST_F()
91 ASSERT_EQ(lmp->atom->nlocal, 0); in TEST_F()
94 ASSERT_EQ(lmp->atom->nlocal, 0); in TEST_F()
97 ASSERT_EQ(lmp->atom->nlocal, 0); in TEST_F()
106 ASSERT_EQ(lmp->atom->nlocal, 4); in TEST_F()
109 ASSERT_EQ(lmp->atom->nlocal, 0); in TEST_F()
112 ASSERT_EQ(lmp->atom->nlocal, 4); in TEST_F()
115 ASSERT_EQ(lmp->atom->nlocal, 0); in TEST_F()
124 ASSERT_EQ(lmp->atom->nlocal, 2); in TEST_F()
127 ASSERT_EQ(lmp->atom->nlocal, 2); in TEST_F()
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| /dports/science/lammps/lammps-stable_29Sep2021/src/REPLICA/ |
| H A D | fix_event.cpp | 80 int nlocal = atom->nlocal; in store_event() local
96 int nlocal = atom->nlocal; in restore_event() local
125 int nlocal = atom->nlocal; in store_state_quench() local
148 int nlocal = atom->nlocal; in restore_state_quench() local
170 int nlocal = atom->nlocal; in store_state_dephase() local
192 int nlocal = atom->nlocal; in restore_state_dephase() local
296 xold[nlocal][0] = buf[3]; in unpack_exchange()
297 xold[nlocal][1] = buf[4]; in unpack_exchange()
298 xold[nlocal][2] = buf[5]; in unpack_exchange()
299 vold[nlocal][0] = buf[6]; in unpack_exchange()
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| /dports/science/liggghts/LIGGGHTS-PUBLIC-3.8.0-26-g6e873439/src/MOLECULE/ |
| H A D | atom_vec_full.cpp | 707 int nlocal = atom->nlocal; in unpack_exchange() local
768 atom->nlocal++; in unpack_exchange()
781 int nlocal = atom->nlocal; in size_restart() local
868 int nlocal = atom->nlocal; in unpack_restart() local
922 nspecial[nlocal][0] = nspecial[nlocal][1] = nspecial[nlocal][2] = 0; in unpack_restart()
930 atom->nlocal++; in unpack_restart()
941 int nlocal = atom->nlocal; in create_atom() local
962 nspecial[nlocal][0] = nspecial[nlocal][1] = nspecial[nlocal][2] = 0; in create_atom()
974 int nlocal = atom->nlocal; in data_atom() local
984 if (type[nlocal] <= 0 || type[nlocal] > atom->ntypes) in data_atom()
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| H A D | atom_vec_molecular.cpp | 694 int nlocal = atom->nlocal; in unpack_exchange() local
754 atom->nlocal++; in unpack_exchange()
767 int nlocal = atom->nlocal; in size_restart() local
853 int nlocal = atom->nlocal; in unpack_restart() local
906 nspecial[nlocal][0] = nspecial[nlocal][1] = nspecial[nlocal][2] = 0; in unpack_restart()
914 atom->nlocal++; in unpack_restart()
925 int nlocal = atom->nlocal; in create_atom() local
945 nspecial[nlocal][0] = nspecial[nlocal][1] = nspecial[nlocal][2] = 0; in create_atom()
957 int nlocal = atom->nlocal; in data_atom() local
967 if (type[nlocal] <= 0 || type[nlocal] > atom->ntypes) in data_atom()
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| H A D | atom_vec_bond.cpp | 590 int nlocal = atom->nlocal; in unpack_exchange() local
624 atom->nlocal++; in unpack_exchange()
637 int nlocal = atom->nlocal; in size_restart() local
696 int nlocal = atom->nlocal; in unpack_restart() local
723 nspecial[nlocal][0] = nspecial[nlocal][1] = nspecial[nlocal][2] = 0; in unpack_restart()
731 atom->nlocal++; in unpack_restart()
742 int nlocal = atom->nlocal; in create_atom() local
759 nspecial[nlocal][0] = nspecial[nlocal][1] = nspecial[nlocal][2] = 0; in create_atom()
771 int nlocal = atom->nlocal; in data_atom() local
781 if (type[nlocal] <= 0 || type[nlocal] > atom->ntypes) in data_atom()
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| /dports/science/lammps/lammps-stable_29Sep2021/src/KOKKOS/ |
| H A D | fix_langevin_kokkos.cpp | 69 for (int i = 0; i < atomKK->nlocal; i++) { in FixLangevinKokkos()
149 int nlocal = atomKK->nlocal; in initial_integrate() local
153 Kokkos::parallel_for(nlocal,functor); in initial_integrate()
200 int nlocal = atomKK->nlocal; in post_force() local
211 if (nlocal > maxatom1) { in post_force()
679 int nlocal = atomKK->nlocal; in compute_target() local
707 for (int i = 0; i < nlocal; i++) in compute_target()
749 int nlocal = atomKK->nlocal; in compute_scalar() local
790 int nlocal = atomKK->nlocal; in end_of_step() local
801 Kokkos::parallel_for(nlocal,functor); in end_of_step()
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| /dports/science/lammps/lammps-stable_29Sep2021/src/MISC/ |
| H A D | fix_srp.cpp | 155 nlocal = nlocal_old = atom->nlocal; in setup_pre_force()
182 while (i < nlocal) { in setup_pre_force()
186 nlocal--; in setup_pre_force()
191 atom->nlocal = nlocal; in setup_pre_force()
311 nlocal = atom->nlocal; in setup_pre_force()
342 int nlocal = atom->nlocal; in pre_exchange() local
469 int nlocal = atom->nlocal; in post_run() local
490 nlocal--; in post_run()
494 atom->nlocal = nlocal; in post_run()
562 array[nlocal][0] = extra[nlocal][m++]; in unpack_restart()
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| /dports/science/sparta/sparta-20Oct2021/src/ |
| H A D | grid_comm.cpp | 194 if (ownflag) icell = nlocal; in unpack_one()
197 if (ownflag) nlocal++; in unpack_one()
592 particle->nlocal = npnew; in unpack_particles()
687 int ncurrent = nlocal; in compress()
700 if (icell != nlocal) { in compress()
707 cells[nlocal].ilocal = nlocal; in compress()
725 sinfo[cells[nlocal].isplit].csubs[-cells[nlocal].nsplit] = nlocal; in compress()
729 nlocal++; in compress()
750 if (icell != nlocal) { in compress()
757 cells[nlocal].ilocal = nlocal; in compress()
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