/dports/science/liggghts/LIGGGHTS-PUBLIC-3.8.0-26-g6e873439/src/ |
H A D | bond.cpp | 71 maxeatom = maxvatom = 0; in Bond() 141 if (vflag_atom && atom->nmax > maxvatom) { in ev_setup() 142 maxvatom = atom->nmax; in ev_setup() 144 memory->create(vatom,comm->nthreads*maxvatom,6,"bond:vatom"); in ev_setup() 258 bytes += comm->nthreads*maxvatom*6 * sizeof(double); in memory_usage()
|
H A D | fix.cpp | 130 maxvatom = 0; in Fix() 189 if (vflag_atom && atom->nlocal > maxvatom) { in v_setup() 190 maxvatom = atom->nmax; in v_setup() 192 memory->create(vatom,maxvatom,6,"fix:vatom"); in v_setup()
|
H A D | dihedral.cpp | 71 maxeatom = maxvatom = 0; in Dihedral() 127 if (vflag_atom && atom->nmax > maxvatom) { in ev_setup() 128 maxvatom = atom->nmax; in ev_setup() 130 memory->create(vatom,comm->nthreads*maxvatom,6,"bond:vatom"); in ev_setup() 286 bytes += comm->nthreads*maxvatom*6 * sizeof(double); in memory_usage()
|
H A D | angle.cpp | 70 maxeatom = maxvatom = 0; in Angle() 127 if (vflag_atom && atom->nmax > maxvatom) { in ev_setup() 128 maxvatom = atom->nmax; in ev_setup() 130 memory->create(vatom,comm->nthreads*maxvatom,6,"angle:vatom"); in ev_setup() 264 bytes += comm->nthreads*maxvatom*6 * sizeof(double); in memory_usage()
|
H A D | improper.cpp | 68 maxeatom = maxvatom = 0; in Improper() 123 if (vflag_atom && atom->nmax > maxvatom) { in ev_setup() 124 maxvatom = atom->nmax; in ev_setup() 126 memory->create(vatom,comm->nthreads*maxvatom,6,"bond:vatom"); in ev_setup() 282 bytes += comm->nthreads*maxvatom*6 * sizeof(double); in memory_usage()
|
H A D | kspace.cpp | 98 maxeatom = maxvatom = 0; in KSpace() 233 if (vflag_atom && atom->nmax > maxvatom) { in ev_setup() 234 maxvatom = atom->nmax; in ev_setup() 236 memory->create(vatom,maxvatom,6,"kspace:vatom"); in ev_setup()
|
H A D | improper.h | 87 int maxeatom,maxvatom; variable
|
H A D | dihedral.h | 88 int maxeatom,maxvatom; variable
|
H A D | angle.h | 90 int maxeatom,maxvatom; variable
|
H A D | bond.h | 89 int maxeatom,maxvatom; variable
|
H A D | kspace.h | 193 int maxeatom,maxvatom; variable
|
H A D | pair.h | 228 int maxeatom,maxvatom; variable
|
/dports/science/lammps/lammps-stable_29Sep2021/src/ |
H A D | fix.cpp | 100 maxeatom = maxvatom = 0; in Fix() 218 if (vflag_atom && atom->nlocal > maxvatom) { in ev_setup() 219 maxvatom = atom->nmax; in ev_setup() 221 memory->create(vatom,maxvatom,6,"fix:vatom"); in ev_setup() 263 if (vflag_atom && atom->nlocal > maxvatom) { in v_setup() 264 maxvatom = atom->nmax; in v_setup() 266 memory->create(vatom,maxvatom,6,"fix:vatom"); in v_setup()
|
H A D | bond.cpp | 45 maxeatom = maxvatom = 0; in Bond() 117 if (vflag_atom && atom->nmax > maxvatom) { in ev_setup() 118 maxvatom = atom->nmax; in ev_setup() 121 memory->create(vatom,comm->nthreads*maxvatom,6,"bond:vatom"); in ev_setup() 326 bytes += (double)comm->nthreads*maxvatom*6 * sizeof(double); in memory_usage()
|
H A D | angle.cpp | 39 maxeatom = maxvatom = maxcvatom = 0; in Angle() 123 if (vflag_atom && atom->nmax > maxvatom) { in ev_setup() 124 maxvatom = atom->nmax; in ev_setup() 127 memory->create(vatom,comm->nthreads*maxvatom,6,"angle:vatom"); in ev_setup() 355 bytes += (double)comm->nthreads*maxvatom*6 * sizeof(double); in memory_usage()
|
H A D | improper.cpp | 38 maxeatom = maxvatom = maxcvatom = 0; in Improper() 122 if (vflag_atom && atom->nmax > maxvatom) { in ev_setup() 123 maxvatom = atom->nmax; in ev_setup() 126 memory->create(vatom,comm->nthreads*maxvatom,6,"improper:vatom"); in ev_setup() 416 bytes += (double)comm->nthreads*maxvatom*6 * sizeof(double); in memory_usage()
|
H A D | dihedral.cpp | 40 maxeatom = maxvatom = maxcvatom = 0; in Dihedral() 123 if (vflag_atom && atom->nmax > maxvatom) { in ev_setup() 124 maxvatom = atom->nmax; in ev_setup() 127 memory->create(vatom,comm->nthreads*maxvatom,6,"dihedral:vatom"); in ev_setup() 416 bytes += (double)comm->nthreads*maxvatom*6 * sizeof(double); in memory_usage()
|
H A D | kspace.cpp | 89 maxeatom = maxvatom = 0; in KSpace() 258 if (vflag_atom && atom->nmax > maxvatom) { in ev_setup() 259 maxvatom = atom->nmax; in ev_setup() 262 memory->create(vatom,maxvatom,6,"kspace:vatom"); in ev_setup()
|
H A D | bond.h | 67 int maxeatom, maxvatom; variable
|
H A D | angle.h | 67 int maxeatom, maxvatom, maxcvatom; variable
|
H A D | improper.h | 65 int maxeatom, maxvatom, maxcvatom; variable
|
H A D | dihedral.h | 65 int maxeatom, maxvatom, maxcvatom; variable
|
H A D | kspace.h | 201 int maxeatom, maxvatom; variable
|
H A D | pair.h | 256 int maxeatom, maxvatom, maxcvatom; variable
|
/dports/science/lammps/lammps-stable_29Sep2021/src/KIM/ |
H A D | pair_kim.cpp | 981 if (atom->nmax > maxvatom) { in set_argument_pointers() 982 maxvatom = atom->nmax; in set_argument_pointers() 984 memory->create(vatom,comm->nthreads*maxvatom,6,"pair:vatom"); in set_argument_pointers()
|