remove trailing whitespace

This commit is contained in:
Axel Kohlmeyer
2018-03-16 12:37:27 -04:00
parent ee862d8bf5
commit 59dbb49cf9
204 changed files with 1543 additions and 1543 deletions

View File

@ -207,7 +207,7 @@ void ComputeCentroAtom::compute_peratom()
// check whether to include local crystal symmetry axes
if (!axes_flag) {
// if not nnn neighbors, centro = 0.0
if (n < nnn) {
@ -234,9 +234,9 @@ void ComputeCentroAtom::compute_peratom()
}
}
} else {
// calculate local crystal symmetry axes
// rsq1, rsq2 are two smallest values of R^2
@ -248,7 +248,7 @@ void ComputeCentroAtom::compute_peratom()
double* r1 = &array_atom[i][1];
double* r2 = &array_atom[i][4];
double* r3 = &array_atom[i][7];
if (n < nnn) {
centro[i] = 0.0;
MathExtra::zero3(r1);
@ -272,7 +272,7 @@ void ComputeCentroAtom::compute_peratom()
delz = x[jj][2] + x[kk][2] - 2.0*ztmp;
double rsq = delx*delx + dely*dely + delz*delz;
pairs[n++] = rsq;
if (rsq < rsq2) {
if (rsq < rsq1) {
rsq2 = rsq1;