American Mineralogist Crystal Structure Database

4 matching records for this search.

Fluornatromicrolite
 
Witzke T, Steins M, Doering T, Schuckmann W, Wegner R, Pollmann H
 
The Canadian Mineralogist 49 (2011) 1105-1110
Fluornatromicrolite, (Na,Ca,Bi)2Ta2O6F, a new mineral species
from Quixaba, Paraiba, Brazil
Locality: Quixaba, Paraiba, Brazil
_database_code_amcsd 0018616
10.4451 10.4451 10.4451 90 90 90 *Fd3m
.125 .125 .125
atom      x    y    z  occ  Uiso U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3)  U(2,3)
Na        0    0    0 .555  .038   .038   .038   .038  -.0098  -.0098  -.0098
Ca        0    0    0 .325  .038   .038   .038   .038  -.0098  -.0098  -.0098
Bi        0    0    0 .075  .038   .038   .038   .038  -.0098  -.0098  -.0098
Ta       .5   .5   .5      .0149  .0149  .0149  .0149 -.00072 -.00072 -.00072
O    -.1828 .125 .125      .0183   .020   .017   .017       0       0    .006
F      .125 .125 .125       .027   .027   .027   .027       0       0       0
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Muckeite
Download hom/muckeite.pdf
Bente K, Doering T, Edenharter A, Kupcik V, Steins M, Wendschuh-Josties M
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-2701&volume=46&spage=127
Acta Crystallographica C46 (1990) 127-128
Structure of the new mineral muckeite, BiCuNiS3
_database_code_amcsd 0010090
7.514 12.557 4.8880 90 90 90 P2_12_12_1
atom      x      y      z occ Biso B(1,1) B(2,2) B(3,3)  B(1,2)  B(1,3)  B(2,3)
Sb   .37685 .13292 .93528  .1  1.8 .00882 .00266 .01825  .00017  .00008 -.00016
Bi   .37685 .13292 .93528  .9  1.8 .00882 .00266 .01825  .00017  .00008 -.00016
CuM1 .38250 .43787 .97540  .5  2.3 .01014 .00329 .02693  .00035 -.00031  .00032
NiM1 .38250 .43787 .97540  .5  2.3 .01014 .00329 .02693  .00035 -.00031  .00032
CuM2 .12824 .25020 .50418  .5  1.6 .00767 .00232 .01695 -.00028  .00092  .00007
NiM2 .12824 .25020 .50418  .5  1.6 .00767 .00232 .01695 -.00028  .00092  .00007
S1    .1289 .40728  .7166      1.9 .00917 .00241  .0217 -.00035  -.0043 -.00011
S2   .37848 .29743  .2816      1.8 .00731 .00298  .0202 -.00027   .0003  .00036
S3    .1262 .09262  .2901      1.9 .00903 .00229  .0220 -.00026   .0050 -.00049
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Gustavite
Download hom/gustavite.pdf
Bente K, Engel M, Steins M
Download zk/vol205/ZK205_327.pdf
Zeitschrift fur Kristallographie 205 (1993) 327-328
Crystal structure of lead silver tribismuth sulfide, PbAgBi3S6
Locality: synthetic
Note: natural gustavite exhibits ordered Bi/Ag
_database_code_amcsd 0011039
4.077 13.477 19.88 90 90 90 Cmcm
atom  x     y     z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Pb    0 .1835   .25       .025   .031   .070      0      0      0
Ag2  .5 .4150 .3645  .5   .023   .030   .030      0   .003      0
Bi2  .5 .4150 .3645  .5   .023   .030   .030      0   .003      0
Bi1  .5 .1377 .0502      .0188  .0186   .022      0  .0008      0
S1    0     0     0       .016   .026    .03      0      0      0
S2    0 .2612 .0968       .023   .028   .030      0  -.011      0
S3   .5  .327   .25       .029   .012    .05      0      0      0
S4   .5 .0450 .1659       .018   .026   .024      0  -.001      0
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Gottlobite
 
Witzke T, Steins M, Doering T, Kolitsch U
 
Neues Jahrbuch fur Mineralogie, Monatshefte 2000 (2000) 444-454
Gottlobite, CaMg(VO4,AsO4)(OH), a new mineral from Friedrichroda, Thuringia, Germany
Locality: Glucksstern min, Gottlob hill, Friedrichroda, Thuringia, Germany
_database_code_amcsd 0014906
7.510 9.004 5.948 90 90 90 P2_12_12_1
atom     x      y      z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ca   .1302  .3284  .5246      .0094  .0074  .0113  .0004 -.0018   .000
Mg   .7410  .4949  .7555      .0060  .0080  .0032 -.0008  .0009   .000
V    .8834 .18037  .0158 .75  .0035  .0050  .0047  .0003  .0000 -.0001
As   .8834 .18037  .0158 .25  .0035  .0050  .0047  .0003  .0000 -.0001
OH1  .6059  .4251   .494       .011   .012   .013   .000  -.004   .000
O2   .0630  .0615 -.0099       .012   .015   .009   .001   .005  -.003
O3   .8523  .2739 -.2331       .013   .010   .012   .002   .001   .002
O4   .8949  .2963  .2422       .013   .022   .013   .001  -.003   .000
O5   .7137  .0638  .0787       .012   .015   .023  -.003  -.001   .003
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Total number of retrieved datasets: 4
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