American Mineralogist Crystal Structure Database

4 matching records for this search.

Kintoreite
Download hom/kintoreite.pdf
Grey I E, Mumme W G, Mills S J, Birch W D, Wilson N C
 
American Mineralogist 94 (2009) 676-683
The crystal chemical role of Zn in alunite-type minerals:
Structure refinements for kintoreite and zincian kintoreite
Locality: Schone Aussicht mine, near Dernbach, Germany
_database_code_amcsd 0004931
7.2963 7.2963 16.8491 90 90 120 R-3m
atom     x      y      z occ  Uiso
Pb   .0537      0      0 1/6 .0196
Fe      .5      0     .5     .0094
P        0      0  .3148     .0088
O1       0      0  .5954     .0135
O2   .2193 -.2193 -.0516     .0173
O3   .1272 -.1272  .1324     .0093
H     .184  -.184   .100       .03
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View JMOL 3-D Structure
 
Kintoreite
Download hom/kintoreite.pdf
Grey I E, Mumme W G, Mills S J, Birch W D, Wilson N C
 
American Mineralogist 94 (2009) 676-683
The crystal chemical role of Zn in alunite-type minerals:
Structure refinements for kintoreite and zincian kintoreite
Locality: Kintore mine at Broken Hill, New South Wales
_database_code_amcsd 0004932
7.3789 7.3789 16.8552 90 90 120 R-3m
atom     x      y      z   occ  Uiso
Pb   .0630      0      0   1/6 .0313
Fe      .5      0     .5       .0133
Zn   .0653 -.0653  .4954 .0517  .025
PX       0      0 .31364   .54 .0102
SX       0      0 .31364   .08 .0102
AsX      0      0 .31364  .383 .0102
O1       0      0  .5937        .024
O2   .2158 -.2158 -.0534       .0193
OH3  .1272 -.1272  .1330       .0153
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Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Whiteite-(CaMnMn)
 
Grey I E, Mumme W G, Neville S M, Wilson N C, Birch W D
 
Mineralogical Magazine 74 (2010) 969-978
Jahnsite - whiteite solid solutions and associated minerals in
the phosphate pegmatite at Hagendorf-Sud, Bavaria, Germany
Locality: Hagendorf-Sud, Bavaria, Germany
_database_code_amcsd 0018316
14.941 6.9495 10.054 90 111.00 90 P2/a
atom      x     y     z  occ  Uiso
CaX     .25 .9770     0 1.18  .032
MnM1    .25 .4798     0      .0150
FeM2a    .5     0    .5  .86 .0203
MgM2a    .5     0    .5  .14 .0203
FeM2b   .25 .4966    .5  .85 .0188
MgM2b   .25 .4966    .5  .15 .0188
AlM3a     0     0     0  .80  .032
FeM3a     0     0     0  .20  .032
AlM3b     0    .5     0  .96  .007
FeM3b     0    .5     0  .04  .007
P1    .1786 .2574 .1859      .0167
P2    .0793 .7489 .8035      .0148
O1    .2707 .2319 .1503       .028
O2    .2007 .2870 .3415       .030
O3    .1178 .0771 .1342       .038
O4    .1315 .4353 .0956       .028
O5    .1879 .7087 .8547       .031
O6    .0420 .7766 .6450       .021
O7    .0681 .9307 .8809       .028
O8    .0282 .5867 .8407       .025
OH9   .0222 .7506 .0792       .015
Wat10 .2255 .7314 .3413       .040
Wat11 .4532 .2157 .3393       .036
Wat12 .6364 .9984 .4769       .036
Wat13 .3955 .5121 .5074       .034
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Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Nordgauite
 
Birch W D, Grey I E, Mills S J, Pring A, Bougerol C, Ribabldi-Tunnicliffe A,
Wilson N C, Keck E
 
Mineralogical Magazine 75 (2011) 269-278
Nordgauite, MnAl2(PO4)2(F,OH)2*5H2O, a new mineral from the Hagendorf-Sud
pegmatite, Bavaria, Germany: description and crystal structure
Locality: the Hagendorf-Sud pegmatite, Bavaria, Germany
_database_code_amcsd 0018376
9.887 9.796 6.054 92.70 99.83 97.10 P-1
atom      x     y     z occ Uiso
Mn    .5912 .4114 .3502 .87 .017
Ca    .5912 .4114 .3502 .07 .017
Fe    .5912 .4114 .3502 .04 .017
Zn    .5912 .4114 .3502 .01 .017
Mg    .5912 .4114 .3502 .01 .017
P(1)  .8916 .7300 .7074     .013
P(2)  .6689 .4390 .9183     .014
Al(1)     0    .5     0     .011
Al(2)     0     0    .5     .013
Al(3) .7963 .7182 .1841     .012
O(1)  .7961 .6899 .4824     .016
O(2)  .7981 .7456 .8815     .014
O(3)  .9847 .8665 .6996     .016
O(4)  .9892 .6220 .7707     .015
O(5)  .8152 .4215 .8860     .016
O(6)  .6007 .3091 .0098     .019
O(7)  .5843 .4725 .6950     .017
O(8)  .6722 .5539 .1068     .015
F(1)  .9084 .8831 .2610     .020
F(2)  .9466 .6235 .1914     .016
Ow1   .8239 .0576 .5524     .021
Ow2   .6402 .8210 .1723     .018
Ow3   .4573 .2194 .3759     .024
Ow4   .7906 .3354 .4509     .020
Ow5   .7476 .0746 .9839     .030
H(11) .8100 .1390 .5140     .041
H(12) .8050 .0490 .6520     .060
H(21) .6560 .8950 .1310     .042
H(22) .5690 .7820 .1130     .025
H(31) .4420 .2000 .5120     .031
H(32) .3750 .2270 .2880     .070
H(41) .8520 .3490 .3580     .037
H(42) .8170 .3580 .5770     .049
H(51) .8380 .0890 10560     .047
H(52) .7240 .1590 .9950     .090
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
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Total number of retrieved datasets: 4
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