American Mineralogist Crystal Structure Database

2 matching records for this search.

Ferrobustamite
Download hom/ferrobustamite.pdf
Rapoport P A, Burnham C W
Ferrobustamite: The crystal structures of two Ca,Fe bustamite-type pyroxenoids
Download zk/vol138/ZK138_419.pdf
Zeitschrift fur Kristallographie 138 (1973) 419-438
Note: Sample Wo50Fs50
Locality: synthetic
_database_code_amcsd 0020117
7.691 7.112 13.765 90.367 95.317 103.967 A-1
atom     x     y     z occ Biso
Ca1  .2067 .4266 .3731 .23  .93
Ca2  .1989 .9391 .3759 .78  .82
Ca3     .5   .25   .25 .07  .72
Ca4     .5   .75   .25 .92  .70
Fe1  .2067 .4266 .3731 .77  .93
Fe2  .1989 .9391 .3759 .22  .82
Fe3     .5   .25   .25 .93  .72
Fe4     .5   .75   .25 .08  .70
Si1  .1751 .3904 .6368      .65
Si2  .1775 .9426 .6312      .71
Si3  .3935 .7179 .5226      .62
O1   .4304 .2376 .4011      .80
O2   .4021 .7096 .4068     1.18
O3   .3141 .4724 .7312     1.18
O4   .3032 .9279 .7303     1.00
O5   .0276 .6155 .3510     1.56
O6   .0295 .1638 .3744     1.76
O7   .2540 .5108 .5424     1.05
O8    .274 .8800 .5388     1.01
O9   .1866 .1703 .6176     2.15
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Ferrobustamite
Download hom/ferrobustamite.pdf
Rapoport P A, Burnham C W
Ferrobustamite: The crystal structures of two Ca,Fe bustamite-type pyroxenoids
Download zk/vol138/ZK138_419.pdf
Zeitschrift fur Kristallographie 138 (1973) 419-438
Note: Sample Wo79Fs21
Locality: Skye, Scotland
_database_code_amcsd 0020118
7.832 7.229 13.925 90.017 95.4 103.35 A-1
atom     x     y     z occ Biso
Ca1  .2000 .4218 .3776      .71
Ca2  .1994 .9284 .3755 .82 1.05
Ca3     .5   .25   .25 .55  .13
Ca4     .5   .75   .25 .55 1.47
Fe2  .1994 .9284 .3755 .18 1.05
Fe3     .5   .25   .25 .45  .13
Fe4     .5   .75   .25 .45 1.47
Si1  .1877 .3980 .6344     1.34
Si2  .1902 .9475 .6346     1.53
Si3  .3973 .7244 .5226      .90
O1    .425  .233  .403      2.1
O2    .414  .727  .410      1.1
O3    .318  .471  .731      1.4
O4    .302  .936  .724      2.1
O5    .014  .629  .362      2.2
O6    .009  .127  .371      1.6
O7    .274  .507  .543      1.7
O8    .268  .883  .541      2.2
O9    .224  .183  .620      2.9
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: 2
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