American Mineralogist Crystal Structure Database

3 matching records for this search.

Burkeite
Download hom/burkeite.pdf
Giuseppetti G, Mazzi F, Tadini C
 
Neues Jahrbuch fur Mineralogie, Monatshefte 1988 (1988) 203-221
The crystal structure of synthetic burkeite Na4SO4(CO3)t(SO4)1-t
Sample A
Note sign of y-coordinate for O3 and O5 altered to reproduce reported bond lengths
Locality: synthetic
_database_code_amcsd 0014823
5.170 9.217 7.058 90 90 90 *Pmnm
.25 0 .25
atom     x      y     z occ Biso
Na1    .25  .7509 .0051     2.24
Na2    .25  .4254   .25     5.46
Na3    .75  .8754   .25     2.19
CT1    .75  .5584   .25 .61 1.61
ST1    .75  .5584   .25 .39 1.61
ST2  .2951  .0913   .25  .5 1.16
O1     .75  .4226   .25 .85  3.8
O2   .5357  .6403   .25 .88  2.9
O3     .75 -.4693 .0819 .15  5.5
O4   .9307  .5809 .0951 .12  6.0
O5   .1927 -.1645 .0815  .5  2.5
O6   .2164 -.0632   .25  .5  1.5
O7   .5798  .1057   .25  .5  2.2
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Burkeite
Download hom/burkeite.pdf
Giuseppetti G, Mazzi F, Tadini C
 
Neues Jahrbuch fur Mineralogie, Monatshefte 1988 (1988) 203-221
The crystal structure of synthetic burkeite
Sample B
Note sign of y-coordinate for O3 and O5 altered to reproduce reported bond lengths
Locality: synthetic
_database_code_amcsd 0014824
5.177 9.224 7.066 90 90 90 *Pmnm
.25 0 .25
atom     x      y     z occ Biso
Na1    .25  .7510 .0054     2.38
Na2    .25  .4257   .25     5.70
Na3    .75  .8788   .25     2.29
C      .75  .5590   .25 .55 1.65
S1     .75  .5590   .25 .45 1.65
S2   .2939  .0908   .25  .5 1.25
O1     .75  .4219   .25 .83  4.3
O2   .5355  .6427   .25 .86  3.0
O3     .75 -.4700 .0784 .17  5.3
O4   .9281  .5783 .0941 .14  5.2
O5   .1896 -.1632 .0813  .5  2.5
O6   .2156 -.0641   .25  .5  1.6
O7   .5757  .1061   .25  .5  2.4
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Burkeite
Download hom/burkeite.pdf
Giuseppetti G, Mazzi F, Tadini C
 
Neues Jahrbuch fur Mineralogie, Monatshefte 1988 (1988) 203-221
The crystal structure of synthetic burkeite
Sample C
Note sign of y-coordinate for O3 and O5 altered to reproduce reported bond lengths
Locality: synthetic
_database_code_amcsd 0014825
5.198 9.255 7.085 90 90 90 *Pmnm
.25 0 .25
atom     x      y     z occ  Biso
Na1    .25  .7512 .0047      2.39
Na2    .25  .4250   .25      5.79
Na3    .75  .8805   .25      2.45
C      .75  .5606   .25 .49  1.84
S1     .75  .5606   .25 .51  1.84
S2   .2942  .0896   .25  .5  1.30
O1     .75  .4216   .25 .83   4.2
O2   .5358  .6429   .25 .83   2.7
O3     .75 -.4701 .0854 .17   5.9
O4   .9310  .5834 .0888 .17   4.5
O5   .1892 -.1606 .0816  .5   2.9
O6   .2177 -.0651   .25  .5   1.7
O7   .5755  .1071   .25  .5   2.3
Download AMC data (View Text File)
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: 3
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