American Mineralogist Crystal Structure Database

2 matching records for this search.

Brewsterite-Ba
Download hom/brewsteriteba.pdf
Akizuki M, Kudoh Y, Kuribayashi T
Download am/vol81/AM81_1501.pdf
American Mineralogist 81 (1996) 1501-1506
Crystal structures of the {011}, {610}, and {010} growth sectors in brewsterite
Sample: {610} sector
_database_code_amcsd 0001844
6.779 17.530 7.750 89.98 94.49 90.13 P-1
atom        x      y      z occ Biso
SiTa    .3218  .0806  .8229 .75  .95
AlTa    .3218  .0806  .8229 .25  .95
SiTa'   .3205  .4185  .8223 .70  .95
AlTa'   .3205  .4185  .8223 .30  .95
SiTb    .4060  .0568  .2115 .65 1.09
AlTb    .4060  .0568  .2115 .35 1.09
SiTb'   .4055  .4432  .2105 .55 1.09
AlTb'   .4055  .4432  .2105 .45 1.09
SiTc    .5560  .1583  .5340 .50 1.01
AlTc    .5560  .1583  .5340 .50 1.01
SiTc'   .5542  .3421  .5333 .70  .90
AlTc'   .5542  .3421  .5333 .30  .90
SiTd    .9085  .0528  .6407      .94
SiTd'   .9077  .4472  .6411      .90
Sr     .24969 .25010 .17711 .40 1.60
BaM    .24969 .25010 .17711 .55 1.60
KM     .24969 .25010 .17711 .01 1.60
O1      .3506  .1045  .0288      1.5
O1'     .3494  .3936  .0285      1.4
O2      .4234  .1243  .3592      2.0
O2'     .4218  .3761  .3619      1.9
O3      .7855  .1216  .5463      1.8
O3'     .7806  .3797  .5449      1.5
O4      .4497  .1406  .7160      1.8
O4'     .4501  .3589  .7120      1.8
O5      .0848  .0900  .7637      2.0
O5'     .0834  .4076  .7606      1.9
O6      .2250  .9967  .2412      2.6
O6'     .2213  .5030  .2389      2.5
O7      .3854  .9912  .7948      1.6
O7'     .3847  .5081  .7961      1.5
O8          0      0     .5      3.0
O8'         0     .5     .5      2.8
O9      .5715  .2512  .4991      2.4
Wat10   .0580  .2507  .4700      3.6
Wat11   .9285  .1461  .1506      4.9
Wat11'  .9252  .3543  .1493      4.9
Wat12   .6031  .2490  .0238      4.9
Wat13   .0639  .2494  .8631      4.9
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Brewsterite-Ba
Download hom/brewsteriteba.pdf
Cabella R, Lucchetti G, Palenzona A, Quartieri S, Vezzalini G
 
European Journal of Mineralogy 5 (1993) 353-360
First occurrence of a Ba-dominant brewsterite: structural features
_database_code_amcsd 0006480
6.790 17.581 7.735 90 94.50 90 P2_1/m
atom      x     y     z  occ Biso
BaBA1 .2458   1/4 .1734  .82  1.3
NaBA1 .2458   1/4 .1734 .035  1.3
KBA1  .2458   1/4 .1734  .02  1.3
MgBA1 .2458   1/4 .1734  .04  1.3
BaBA2  .264   1/4  .043  .04  4.0
BaBA3  .211   1/4  .297  .04  4.0
AlTA  .3215 .0803 .8230  .35  1.1
SiTA  .3215 .0803 .8230  .65  1.1
AlTB  .4070 .0566 .2116  .35  1.1
SiTB  .4070 .0566 .2116  .65  1.1
AlTC  .5534 .1581 .5349  .35   .9
SiTC  .5534 .1581 .5349  .65   .9
SiTD  .9067 .0526 .6412       1.1
O1    .3537 .1034  .028       1.3
O2     .426 .1222  .360       1.8
O3     .784 .1212  .547       1.7
O4     .446 .1403  .714       1.8
O5     .081 .0911  .765       2.5
O6     .227 .9969  .240       2.6
O7     .383 .9920  .795       1.7
O8        0     0   1/2       2.8
O9     .564   1/4  .501       2.1
Wat1   .051   1/4  .469  .96  3.2
Wat2   .920 .1414  .142       5.0
Wat3   .607   1/4  .022  .96  4.1
Wat4   .060   1/4  .854  .96  3.5
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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