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authorThomas White <taw@physics.org>2010-01-22 15:50:41 +0100
committerThomas White <taw@physics.org>2010-01-22 15:50:41 +0100
commit75d30a3f2a7d8484575f5b6ba6ed07587dc19f1e (patch)
tree58c78fbccd5544eabe7d8484fbaf6358ed87327d /src/diffraction.c
parentef9281fb30a07b8ee099ada3e1f7a0a10cbca5c0 (diff)
Add --near-bragg and --simulate options to indexamajig
Diffstat (limited to 'src/diffraction.c')
-rw-r--r--src/diffraction.c4
1 files changed, 3 insertions, 1 deletions
diff --git a/src/diffraction.c b/src/diffraction.c
index a0248450..b7bdb75a 100644
--- a/src/diffraction.c
+++ b/src/diffraction.c
@@ -142,7 +142,9 @@ void get_diffraction(struct image *image, int na, int nb, int nc)
double a, b, c, d;
/* Generate the array of reciprocal space vectors in image->qvecs */
- get_ewald(image);
+ if ( image->qvecs == NULL ) {
+ get_ewald(image);
+ }
if ( image->molecule == NULL ) {
image->molecule = load_molecule();