/dports/science/liggghts/LIGGGHTS-PUBLIC-3.8.0-26-g6e873439/src/ |
H A D | bond.cpp | 71 maxeatom = maxvatom = 0; in Bond() 136 if (eflag_atom && atom->nmax > maxeatom) { in ev_setup() 137 maxeatom = atom->nmax; in ev_setup() 139 memory->create(eatom,comm->nthreads*maxeatom,"bond:eatom"); in ev_setup() 257 double bytes = comm->nthreads*maxeatom * sizeof(double); in memory_usage()
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H A D | dihedral.cpp | 71 maxeatom = maxvatom = 0; in Dihedral() 122 if (eflag_atom && atom->nmax > maxeatom) { in ev_setup() 123 maxeatom = atom->nmax; in ev_setup() 125 memory->create(eatom,comm->nthreads*maxeatom,"bond:eatom"); in ev_setup() 285 double bytes = comm->nthreads*maxeatom * sizeof(double); in memory_usage()
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H A D | angle.cpp | 70 maxeatom = maxvatom = 0; in Angle() 122 if (eflag_atom && atom->nmax > maxeatom) { in ev_setup() 123 maxeatom = atom->nmax; in ev_setup() 125 memory->create(eatom,comm->nthreads*maxeatom,"angle:eatom"); in ev_setup() 263 double bytes = comm->nthreads*maxeatom * sizeof(double); in memory_usage()
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H A D | improper.cpp | 68 maxeatom = maxvatom = 0; in Improper() 118 if (eflag_atom && atom->nmax > maxeatom) { in ev_setup() 119 maxeatom = atom->nmax; in ev_setup() 121 memory->create(eatom,comm->nthreads*maxeatom,"bond:eatom"); in ev_setup() 281 double bytes = comm->nthreads*maxeatom * sizeof(double); in memory_usage()
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H A D | kspace.cpp | 98 maxeatom = maxvatom = 0; in KSpace() 228 if (eflag_atom && atom->nmax > maxeatom) { in ev_setup() 229 maxeatom = atom->nmax; in ev_setup() 231 memory->create(eatom,maxeatom,"kspace:eatom"); in ev_setup()
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H A D | improper.h | 87 int maxeatom,maxvatom; variable
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H A D | dihedral.h | 88 int maxeatom,maxvatom; variable
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H A D | angle.h | 90 int maxeatom,maxvatom; variable
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H A D | bond.h | 89 int maxeatom,maxvatom; variable
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H A D | kspace.h | 193 int maxeatom,maxvatom; variable
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H A D | pair.h | 228 int maxeatom,maxvatom; variable
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/dports/science/lammps/lammps-stable_29Sep2021/src/ |
H A D | bond.cpp | 45 maxeatom = maxvatom = 0; in Bond() 110 if (eflag_atom && atom->nmax > maxeatom) { in ev_setup() 111 maxeatom = atom->nmax; in ev_setup() 114 memory->create(eatom,comm->nthreads*maxeatom,"bond:eatom"); in ev_setup() 325 double bytes = (double)comm->nthreads*maxeatom * sizeof(double); in memory_usage()
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H A D | angle.cpp | 39 maxeatom = maxvatom = maxcvatom = 0; in Angle() 116 if (eflag_atom && atom->nmax > maxeatom) { in ev_setup() 117 maxeatom = atom->nmax; in ev_setup() 120 memory->create(eatom,comm->nthreads*maxeatom,"angle:eatom"); in ev_setup() 354 double bytes = (double)comm->nthreads*maxeatom * sizeof(double); in memory_usage()
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H A D | fix.cpp | 100 maxeatom = maxvatom = 0; in Fix() 213 if (eflag_atom && atom->nlocal > maxeatom) { in ev_setup() 214 maxeatom = atom->nmax; in ev_setup() 216 memory->create(eatom,maxeatom,"fix:eatom"); in ev_setup()
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H A D | improper.cpp | 38 maxeatom = maxvatom = maxcvatom = 0; in Improper() 115 if (eflag_atom && atom->nmax > maxeatom) { in ev_setup() 116 maxeatom = atom->nmax; in ev_setup() 119 memory->create(eatom,comm->nthreads*maxeatom,"improper:eatom"); in ev_setup() 415 double bytes = (double)comm->nthreads*maxeatom * sizeof(double); in memory_usage()
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H A D | dihedral.cpp | 40 maxeatom = maxvatom = maxcvatom = 0; in Dihedral() 116 if (eflag_atom && atom->nmax > maxeatom) { in ev_setup() 117 maxeatom = atom->nmax; in ev_setup() 120 memory->create(eatom,comm->nthreads*maxeatom,"dihedral:eatom"); in ev_setup() 415 double bytes = (double)comm->nthreads*maxeatom * sizeof(double); in memory_usage()
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H A D | kspace.cpp | 89 maxeatom = maxvatom = 0; in KSpace() 251 if (eflag_atom && atom->nmax > maxeatom) { in ev_setup() 252 maxeatom = atom->nmax; in ev_setup() 255 memory->create(eatom,maxeatom,"kspace:eatom"); in ev_setup()
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H A D | bond.h | 67 int maxeatom, maxvatom; variable
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H A D | angle.h | 67 int maxeatom, maxvatom, maxcvatom; variable
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H A D | improper.h | 65 int maxeatom, maxvatom, maxcvatom; variable
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H A D | dihedral.h | 65 int maxeatom, maxvatom, maxcvatom; variable
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H A D | kspace.h | 201 int maxeatom, maxvatom; variable
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H A D | pair.h | 256 int maxeatom, maxvatom, maxcvatom; variable
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H A D | fix.h | 253 int maxeatom, maxvatom; variable
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/dports/science/lammps/lammps-stable_29Sep2021/src/KIM/ |
H A D | pair_kim.cpp | 944 if (atom->nmax > maxeatom) { in set_argument_pointers() 945 maxeatom = atom->nmax; in set_argument_pointers() 947 memory->create(eatom,comm->nthreads*maxeatom,"pair:eatom"); in set_argument_pointers()
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