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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@402 f3b2605a-c512-4ea7-a41b-209d697bcdaa

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sjplimp
2007-03-15 23:38:38 +00:00
parent ced2f61033
commit 3bf07918d4
19 changed files with 185 additions and 188 deletions
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12
src/dump_custom.cpp
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@ -311,7 +311,7 @@ int DumpCustom::count()
nstride = 3;
} else if (thresh_array[ithresh] == XS) {
double **x = atom->x;
double boxxlo = domain->boxxlo;
double boxxlo = domain->boxlo[0];
double invxprd = 1.0/domain->xprd;
for (i = 0; i < nlocal; i++)
dchoose[i] = (x[i][0] - boxxlo) * invxprd;
@ -319,7 +319,7 @@ int DumpCustom::count()
nstride = 1;
} else if (thresh_array[ithresh] == YS) {
double **x = atom->x;
double boxylo = domain->boxylo;
double boxylo = domain->boxlo[1];
double invyprd = 1.0/domain->yprd;
for (i = 0; i < nlocal; i++)
dchoose[i] = (x[i][1] - boxylo) * invyprd;
@ -327,7 +327,7 @@ int DumpCustom::count()
nstride = 1;
} else if (thresh_array[ithresh] == ZS) {
double **x = atom->x;
double boxzlo = domain->boxzlo;
double boxzlo = domain->boxlo[2];
double invzprd = 1.0/domain->zprd;
for (i = 0; i < nlocal; i++)
dchoose[i] = (x[i][2] - boxzlo) * invzprd;
@ -1155,7 +1155,7 @@ void DumpCustom::pack_xs(int n)
double **x = atom->x;
int nlocal = atom->nlocal;
double boxxlo = domain->boxxlo;
double boxxlo = domain->boxlo[0];
double invxprd = 1.0/domain->xprd;
for (int i = 0; i < nlocal; i++)
@ -1172,7 +1172,7 @@ void DumpCustom::pack_ys(int n)
double **x = atom->x;
int nlocal = atom->nlocal;
double boxylo = domain->boxylo;
double boxylo = domain->boxlo[1];
double invyprd = 1.0/domain->yprd;
for (int i = 0; i < nlocal; i++)
@ -1189,7 +1189,7 @@ void DumpCustom::pack_zs(int n)
double **x = atom->x;
int nlocal = atom->nlocal;
double boxzlo = domain->boxzlo;
double boxzlo = domain->boxlo[2];
double invzprd = 1.0/domain->zprd;
for (int i = 0; i < nlocal; i++)