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CC=Collection Code: [AB2X4]=ANX Form: [cF56]=Pearson: [e d a]=Wyckoff Symbol: [Al2MgO4]=Structure Type:
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CC=67252 Help
TitleRefinement of the crystal structures of Cu Te2 Br and Cu Te 2I.
AuthorsMilius, W.
ReferenceZeitschrift fuer Naturforschung, Teil B. (1989) 44, 990-992
Link XRef SCOPUS Google
CompoundBr1 Cu1 Te2 - Copper tellurium bromide (1/2/1) [AN2X] [mP16] [e4] []
Cell8.345(8), 4.928(4), 15.733(5), 90., 135.3(2), 90.
P121/C1 (14) V=455.1
RemarksR=0.055000 : P =23-200 :
The coordinates are those given in the paper but the atomic distances do not agree with those calculated during testing.The coordinates are probably correct.
PDF 23-200
Cell in P121/n1-setting: c'=11.424, beta'=104.38

Atom (site) Oxid. x, y, z, B, Occupancy
Cu1(4e)1
Te1(4e)0
Te2(4e)0
Br1(4e)-1
0.780.140.2401
0.990.490.3601
0.290.280.3501
0.680.890.3801
Atom (site) Oxid. U11, U22, U33, U12, U13, U23
Cu1(4e)1
Te1(4e)0
Te2(4e)0
Br1(4e)-1
0.030.030.040.000.030.00
0.020.020.020.000.020.00
0.020.030.02-.000.010.00
0.020.030.030.000.020.00

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