American Mineralogist Crystal Structure Database

2 matching records for this search.

Bonshtedtite
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Tjy C T L, Nadezhina T N, Pobedimskaya E A, Khomyakov A P
 
Mineralogiceskij Zhurnal 6 (1984) 79-84
Crystal chemical characteristics of bradleyite, sidorenkite and bonshtedtite
Note: atomic parameters from ICSD
_database_code_amcsd 0018485
8.955 5.149 6.629 90 90 90.45 P2_1/m
atom     x     y     z Biso
Na1  .2633 .2497 .0032 1.26
Na2  .9177 .2346   .75 1.66
Fe   .6447 .2217   .25  .80
P    .5859 .2967   .75  .55
C    .9392 .2696   .25  .75
O1   .8741 .0478   .25 1.08
O2   .8572 .4753   .25 1.19
O3   .0808 .2850   .25 1.41
O4   .6805 .2209  .563 1.07
O5   .4343 .1630   .75  .89
O6   .4390 .4065   .25  .95
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Bonshtedtite
Download hom/bonshtedtite.pdf
Krivovichev S V, Chernyatieva A Y, Britvin S N, Yakovenchuk V N, Krivovichev V G
 
Zapiski Rossiiskogo Mineralogicheskogo Obshchetstva 142 (2013) 46-54
Refinement of the crystal structure of bonshtedtite Na3Fe(PO4)(CO3)
Locality: Khibiny Massif, Kola Peninsula, Russia
_database_code_amcsd 0020683
5.137 6.644 8.908 90 90.554 90 P2_1/m
atom     x      y     z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Na1  .2495 -.0037 .7633 .0153  .0152  .0148  .0159 -.0009 -.0009 -.0025
Na2  .2652    .25 .4181 .0220  .0141  .0393  .0127      0 -.0023      0
Fe   .7209    .25 .8556 .0150  .0129  .0174  .0147      0 -.0006      0
P    .2041    .25 .0852 .0101  .0080  .0125  .0099      0 -.0005      0
C    .7700    .25 .5620 .0093  .0090  .0100  .0091      0 -.0003      0
O1   .9080    .25 .0595 .0125  .0056  .0200  .0120      0 -.0013      0
O2   .9747    .25 .6452 .0151  .0074  .0203  .0176      0 -.0045      0
O3   .5455    .25 .6262 .0143  .0071  .0227  .0131      0  .0002      0
O4   .3399    .25 .9334 .0117  .0090  .0170  .0090      0  .0017      0
O5   .7208 -.0646 .8204 .0128  .0160  .0107  .0116  .0018 -.0024  .0017
O6   .2138   -.25 .5809 .0175  .0212  .0218  .0094      0  .0013      0
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Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
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Total number of retrieved datasets: 2
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