diff options
| -rw-r--r-- | src/ambigator.c | 5 |
1 files changed, 2 insertions, 3 deletions
diff --git a/src/ambigator.c b/src/ambigator.c index 1e417ce2..d86dc63c 100644 --- a/src/ambigator.c +++ b/src/ambigator.c @@ -146,7 +146,6 @@ static float corr(Crystal *a, Crystal *b, int *pn) s_x2 += aint*aint; s_y2 += bint*bint; n++; - } *pn = n; @@ -156,7 +155,7 @@ static float corr(Crystal *a, Crystal *b, int *pn) if ( (t1 < 0.0) || (t2 <= 0.0) ) return 0.0; - return (s_xy - s_x*s_y)/n/sqrt(t1*t2); + return ((s_xy - s_x*s_y)/n)/sqrt(t1*t2); } @@ -181,8 +180,8 @@ static void detwin(Crystal **crystals, int n_crystals, SymOpList *amb, cc = corr(crystals[i], crystals[j], &n); - if ( i == j ) continue; if ( n < 3 ) continue; + if ( i == j ) continue; if ( assignments[i] == assignments[j] ) { f += cc; |