diff options
| author | Thomas White <taw@physics.org> | 2010-07-14 12:08:12 +0200 |
|---|---|---|
| committer | Thomas White <taw@physics.org> | 2012-02-22 15:26:53 +0100 |
| commit | d8c885d3057a05cbb7f3104540f61699d6ef075b (patch) | |
| tree | 9ece901890c4eb66e68a228ca597b15b3c2ac12a /src/symmetry.c | |
| parent | 9c34a0bf65ae8d2fa4ed5bd2cf60b1c9ac5f2351 (diff) | |
process_hkl: Improve de-twinning
Diffstat (limited to 'src/symmetry.c')
| -rw-r--r-- | src/symmetry.c | 7 |
1 files changed, 3 insertions, 4 deletions
diff --git a/src/symmetry.c b/src/symmetry.c index 31470db7..69a2e55c 100644 --- a/src/symmetry.c +++ b/src/symmetry.c @@ -265,9 +265,8 @@ const char *get_holohedral(const char *sym) * To count the number of possibilities, use num_items() on the result. */ static ReflItemList *coset_decomp(signed int hs, signed int ks, signed int ls, - const char *mero) + const char *holo, const char *mero) { - const char *holo = get_holohedral(mero); int n_mero, n_holo; int i; signed int h, k, l; @@ -313,7 +312,7 @@ static ReflItemList *coset_decomp(signed int hs, signed int ks, signed int ls, * To use the result, call get_general_equiv() on each reflection using * the holohedral point group (use get_holohedral() for this), and for "idx" * give each "op" field from the list returned by this function. */ -ReflItemList *get_twins(ReflItemList *items, const char *sym) +ReflItemList *get_twins(ReflItemList *items, const char *holo, const char *mero) { int i; ReflItemList *ops = new_items();; @@ -334,7 +333,7 @@ ReflItemList *get_twins(ReflItemList *items, const char *sym) k = item->k; l = item->l; - new_ops = coset_decomp(h, k, l, sym); + new_ops = coset_decomp(h, k, l, holo, mero); union_op_items(ops, new_ops); delete_items(new_ops); |