diff options
Diffstat (limited to 'src/reflist-utils.c')
| -rw-r--r-- | src/reflist-utils.c | 16 |
1 files changed, 8 insertions, 8 deletions
diff --git a/src/reflist-utils.c b/src/reflist-utils.c index 016fa317..c0784dbb 100644 --- a/src/reflist-utils.c +++ b/src/reflist-utils.c @@ -104,7 +104,7 @@ unsigned char *flags_from_list(RefList *list) } -int check_list_symmetry(RefList *list, const char *sym) +int check_list_symmetry(RefList *list, const SymOpList *sym) { unsigned char *flags; Reflection *refl; @@ -122,10 +122,10 @@ int check_list_symmetry(RefList *list, const char *sym) get_indices(refl, &h, &k, &l); - for ( j=0; j<num_equivs(h, k, l, sym); j++ ) { + for ( j=0; j<num_equivs(sym); j++ ) { signed int he, ke, le; - get_equiv(h, k, l, &he, &ke, &le, sym, j); + get_equiv(sym, j, h, k, l, &he, &ke, &le); if ( abs(he) > INDMAX ) continue; if ( abs(le) > INDMAX ) continue; @@ -149,17 +149,17 @@ int check_list_symmetry(RefList *list, const char *sym) int find_equiv_in_list(RefList *list, signed int h, signed int k, - signed int l, const char *sym, signed int *hu, + signed int l, const SymOpList *sym, signed int *hu, signed int *ku, signed int *lu) { int i; int found = 0; - for ( i=0; i<num_equivs(h, k, l, sym); i++ ) { + for ( i=0; i<num_equivs( sym); i++ ) { signed int he, ke, le; Reflection *f; - get_equiv(h, k, l, &he, &ke, &le, sym, i); + get_equiv(sym, i, h, k, l, &he, &ke, &le); f = find_refl(list, he, ke, le); /* There must only be one equivalent. If there are more, it @@ -362,7 +362,7 @@ RefList *read_reflections(const char *filename) } -RefList *asymmetric_indices(RefList *in, const char *sym) +RefList *asymmetric_indices(RefList *in, const SymOpList *sym) { Reflection *refl; RefListIterator *iter; @@ -380,7 +380,7 @@ RefList *asymmetric_indices(RefList *in, const char *sym) get_indices(refl, &h, &k, &l); - get_asymm(h, k, l, &ha, &ka, &la, sym); + get_asymm(sym, h, k, l, &ha, &ka, &la); cr = add_refl(new, ha, ka, la); assert(cr != NULL); |