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authorThomas White <taw@physics.org>2019-08-23 12:21:00 +0200
committerThomas White <taw@physics.org>2019-08-23 12:21:00 +0200
commit184a21098ac1325c2c02a24ac315584a464532a7 (patch)
treebf866c4dd9579e431c7797e782c0bee846575aae
parent4efec1fa1dc08f4472531ef5b24de4d4e1b74aa9 (diff)
Fix Niggli reduction logic
-rw-r--r--libcrystfel/src/cell-utils.c7
1 files changed, 5 insertions, 2 deletions
diff --git a/libcrystfel/src/cell-utils.c b/libcrystfel/src/cell-utils.c
index 2af3f293..6e7cebb5 100644
--- a/libcrystfel/src/cell-utils.c
+++ b/libcrystfel/src/cell-utils.c
@@ -1893,9 +1893,10 @@ IntegerMatrix *reduce_g6(struct g6 g, double epsrel)
debug_lattice(g, eps, 1);
+ }
- } else if ( GT(g.B, g.C)
- || (EQ(g.B, g.C) && GT(fabs(g.E), fabs(g.F))) )
+ if ( GT(g.B, g.C)
+ || (EQ(g.B, g.C) && GT(fabs(g.E), fabs(g.F))) )
{
/* Swap b and c */
double temp;
@@ -1909,6 +1910,8 @@ IntegerMatrix *reduce_g6(struct g6 g, double epsrel)
mult_in_place(T, M);
debug_lattice(g, eps, 2);
+
+ /* ..."and go to 1." */
done_s1s2 = 0;
}