antons-l
Hello! Could anyone help me with using the wild card character in Topas 6.
The idea is to use macros:
Flatten(C* O* O* O*, 0.0107887918`, flatten_tol, flatten_weight)
AI_Anti_Bump(C*, C*, bump_dist, bump_weight)
to obtain flattened CO3 polyhedra and to prevent all C atoms from bumping. I put these strings in my .inp file but end up with an error: "Cannot find site: C*". If I write C1, then the error would be "Cannot find site: O*". So it seems the program can't get what C* means. Thus the question is, could I use the wild card character in Topas v.6?
Thank you in advance!
alancoelho
Sites flatten cannot have the wild card character. In fact no more that around 6 sites should be entered as Sites Flatten with many sites can be slow. Therefore so something like:
Flatten(C1 O1 O2 O3 O4 O5, 0.0107887918`, flatten_tol, flatten_weight)