Garin J, Parthe E
Acta Crystallographica B28 (1972) 3672-3674
The crystal structure of Cu3PSe4 and other ternary normal tetrahedral
structure compounds with composition 1_356_4
Locality: synthetic
_database_code_amcsd 0009468
5.385 5.385 10.754 90 90 90 I-42m
atom x y z Biso
Cu1 0 0 .5 3.62
Cu2 0 .5 .25 3.59
Sb 0 0 0 .59
S .255 .255 .1320 2.54
Pfitzner A, Bernert T
Zeitschrift fur Kristallographie 219 (2004) 20-26
The system Cu3AsS4 - Cu3SbS4 and investigations on normal tetrahedral structures
Sample: Cu3As0.3Sb0.7S4
_database_code_amcsd 0011106
5.353 5.353 10.652 90 90 90 I-42m
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Sb 0 0 0 .736 .0119 .0119 .0119 .0120 0 0 0
As 0 0 0 .264 .0119 .0119 .0119 .0120 0 0 0
Cu1 .5 0 .25 .0233 .0224 .0224 .0251 0 0 0
Cu2 .5 .5 0 .0230 .0228 .0228 .0233 0 0 0
S .2501 .2501 .1273 .0161 .0156 .0156 .0173 .0004 .0008 .0008
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