C. Marcos et al., VILLAMANINITE, A CASE OF NONCUBIC PYRITE-TYPE STRUCTURE, Acta crystallographica. Section B, Structural science, 52, 1996, pp. 899-904
This paper reports the results obtained in a study of the crystal stru
cture of two villamaninite samples from Villamanin (Leon, Spain), labe
led (1) and (2). Villamaninite, (Cu,Ni,Co,Pe)(S,Se)(2), is a pyrite-ty
pe disulfide. Different long-period elements, including Au, in ionic s
ubstitution are also observed. Previous authors have assumed a cubic P
a(3) over bar symmetry for this mineral. The result of our single crys
tal study shows a deviation from the cubic symmetry Pa(3) over bar pyr
ite-type to a pseudocubic symmetry, which is in agreement with the obs
erved optical anisotropy shown by both samples. The structural refinem
ent process leads to a monoclinic model, space group P12(1)1. with a =
5.709(2), b = 5.707 (2), c = 5.708 (2) Angstrom, beta = 90.01(1)degre
es for sample (1), and a = 5.704(3), b = 5.703 (3), c = 5.704(3)Angstr
om, beta = 89.99(2)degrees for sample (2), with Z = 4. Previous Mossba
uer spectroscopic studies stating two different cation sites for Au su
pport the monoclinic model.