remove whitespace
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@ -2,7 +2,7 @@
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/* ----------------------------------------------------------------------
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LAMMPS - Large-scale Atomic/Molecular Massively Parallel Simulator
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https://www.lammps.org/, Sandia National Laboratories
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Steve Plimpton, sjplimp@sandia.gov
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LAMMPS Development team: developers@lammps.org
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Copyright (2003) Sandia Corporation. Under the terms of Contract
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DE-AC04-94AL85000 with Sandia Corporation, the U.S. Government retains
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@ -448,7 +448,7 @@ FixAveGrid::~FixAveGrid()
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delete[] value2data;
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// deallocate Grid class and buffers
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if (dimension == 2) delete grid2d;
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else delete grid3d;
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@ -468,7 +468,7 @@ FixAveGrid::~FixAveGrid()
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}
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delete grid_output;
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if (modeatom) {
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memory->destroy(bin);
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memory->destroy(skip);
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@ -671,7 +671,7 @@ void FixAveGrid::end_of_step()
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// normalize sample grid by Nrepeat
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if (modeatom) {
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if (normflag == ALL) {
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if (normflag == ALL) {
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normalize_atom(nrepeat,grid_sample);
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normalize_count(nrepeat,grid_sample);
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copy_grid(grid_sample,grid_nfreq);
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@ -1504,7 +1504,7 @@ FixAveGrid::GridData *FixAveGrid::allocate_one_grid()
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grid->vec3d = nullptr;
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grid->array3d = nullptr;
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grid->count3d = nullptr;
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if (dimension == 2) {
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if (nvalues == 1)
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memory->create2d_offset(grid->vec2d, nylo_out, nyhi_out,
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@ -1531,7 +1531,7 @@ FixAveGrid::GridData *FixAveGrid::allocate_one_grid()
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}
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zero_grid(grid);
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return grid;
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}
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@ -1870,7 +1870,7 @@ void FixAveGrid::pack_reverse_grid(int /*flag*/, void *vbuf, int nlist, int *lis
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if (nvalues == 1) data = &grid_sample->vec3d[nzlo_out][nylo_out][nxlo_out];
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else data = &grid_sample->array3d[nzlo_out][nylo_out][nxlo_out][0];
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}
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if (nvalues == 1) {
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for (i = 0; i < nlist; i++) {
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buf[m++] = count[list[i]];
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@ -1942,7 +1942,7 @@ void FixAveGrid::pack_remap_grid(void *vbuf, int nlist, int *list)
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if (aveflag == WINDOW) window_flag = 1;
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m = 0;
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for (i = 0; i < nlist; i++) {
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for (i = 0; i < nlist; i++) {
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m += pack_one_grid(grid_sample_previous,list[i],&buf[m]);
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m += pack_one_grid(grid_nfreq_previous,list[i],&buf[m]);
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if (running_flag) m += pack_one_grid(grid_running_previous,list[i],&buf[m]);
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@ -2071,7 +2071,7 @@ void FixAveGrid::reset_grid()
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gridnew->set_distance(maxdist);
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gridnew->setup_grid(tmp[0], tmp[1], tmp[2], tmp[3], tmp[4], tmp[5],
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tmp[6], tmp[7], tmp[8], tmp[9], tmp[10], tmp[11]);
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if (grid3d->identical(gridnew)) {
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delete gridnew;
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return;
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@ -2101,7 +2101,7 @@ void FixAveGrid::reset_grid()
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if (dimension == 2) grid2d_previous = grid2d;
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else grid3d_previous = grid3d;
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nxlo_out_previous = nxlo_out;
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nylo_out_previous = nylo_out;
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nzlo_out_previous = nzlo_out;
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