American Mineralogist Crystal Structure Database

4 matching records for this search.

Brewsterite-Sr
Download hom/brewsteritesr.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: {011} sector
_database_code_amcsd 0001843
6.786 17.517 7.742 89.85 94.07 90.12 P-1
atom        x      y      z occ Biso
SiTa    .3166  .0791  .8224 .65  .99
AlTa    .3166  .0791  .8224 .35  .99
SiTa'   .3163  .4208  .8227 .60 1.05
AlTa'   .3163  .4208  .8227 .40 1.05
SiTb    .4117  .0582  .2095 .80 1.01
AlTb    .4117  .0582  .2095 .20 1.01
SiTb'   .4102  .4417  .2109 .80  .99
AlTb'   .4102  .4417  .2109 .20  .99
SiTc    .5547  .1582  .5225 .60  .91
AlTc    .5547  .1582  .5225 .40  .91
SiTc'   .5541  .3417  .5344 .60  .91
AlTc'   .5541  .3417  .5344 .40  .91
SiTd    .9045  .0520  .6416 .90  .99
AlTd    .9045  .0520  .6416 .10  .99
SiTd'   .9043  .4480  .6412      .94
O1      .3542  .1052  .0279      1.4
O1'     .3518  .3950  .0308      1.4
O2      .4289  .1255  .3537      2.0
O2'     .4259  .3745  .3550      2.0
O3      .7811  .1219  .5454      1.7
O3'     .7807  .3786  .5466      1.5
O4      .4414  .1385  .7080      1.9
O4'     .4419  .3609  .7092      2.0
O5      .0774  .0898  .7711      2.1
O5'     .0758  .4104  .7691      2.0
O6      .2348  .9985  .2444      2.6
O6'     .2346  .5014  .2485      2.5
O7      .3807  .9888  .7987      1.3
O7'     .3822  .5115  .7986      1.4
O8          0      0     .5      2.9
O8'         0     .5     .5      2.8
O9      .5688  .2501  .5044      2.6
Sr     .24861 .25009 .17502 .50 1.74
Ba     .24861 .25009 .17502 .45 1.74
K      .24861 .25009 .17502 .01 1.74
Wat10   .0569  .2503  .4667      3.7
Wat11   .9340  .1465  .1446      4.8
Wat11'  .9302  .3535  .1458      4.8
Wat12   .5996  .2504  .0289      4.1
Wat13    .081  .2499  .8619      4.0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
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)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Brewsterite-Sr
Download hom/brewsteritesr.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: {010} sector
_database_code_amcsd 0001845
6.785 17.546 7.740 89.98 94.25 90.06 P-1
atom       x      y      z occ Biso
SiTa   .3192  .0797  .8229 .65 1.38
AlTa   .3192  .0797  .8229 .35 1.38
SiTa'  .3187  .4201  .8230 .60 1.39
AlTa'  .3187  .4201  .8230 .40 1.39
SiTb   .4093  .0573  .2110 .80 1.41
AlTb   .4093  .0573  .2110 .20 1.41
SiTb'  .4091  .4425  .2107 .80 1.40
AlTb'  .4091  .4425  .2107 .20 1.40
SiTc   .5550  .1583  .5335 .50 1.37
AlTc   .5550  .1583  .5335 .50 1.37
SiTc'  .5539  .3421  .5333 .60 1.32
AlTc'  .5539  .3421  .5333 .40 1.32
SiTd   .9065  .0527  .6415 .95 1.39
AlTd   .9065  .0527  .6415 .05 1.39
SiTd'  .9060  .4474  .6417 .95 1.37
AlTd'  .9060  .4474  .6417 .05 1.37
Sr     .2495 .24969 .17696 .67 1.26
Ba     .2495 .24969 .17696 .24 1.26
K      .2495 .24969 .17696 .01 1.26
O1     .3532  .1051  .0310      1.9
O1'    .3533  .3945  .0315      1.9
O2     .4240  .1249  .3562      2.7
O2'    .4246  .3753  .3576      2.6
O3     .7851  .1226  .5479      2.3
O3'    .7820  .3780  .5465      2.2
O4     .4457  .1400  .7130      2.5
O4'    .4450  .3604  .7114      2.5
O5     .0814  .0898  .7689      2.5
O5'    .0798  .4098  .7677      2.4
O6     .2313  .9977  .2417      3.1
O6'    .2309  .5020  .2423      3.0
O7     .3829  .9899  .7967      1.9
O7'    .3827  .5105  .7964      2.0
O8         0      0     .5      3.8
O8'        0     .5     .5      3.5
O9      .568  .2503  .5011      2.9
Wat10   .056  .2497  .4676      4.1
Wat11   .931  .1470   .147      5.6
Wat11'  .930  .3527   .148      5.6
Wat12   .603  .2493   .029      5.2
Wat13   .076  .2495  .8628      4.8
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Stilbite-Ca
Download hom/stilbiteca.pdf
Akizuki M, Kudoh Y, Satoh Y
 
European Journal of Mineralogy 5 (1993) 839-843
Crystal structure of the orthorhombic {001} growth sector of stilbite
_database_code_amcsd 0006490
13.616 18.238 17.835 90 90 90 Fmmm
atom     x     y     z  occ  Biso
Ca   .5000 .0000 .2939 .945  4.09
Mg   .5000 .0000 .2939 .055  4.09
Na   .2022 .4442 .2782 .047  5.53
Mg   .2022 .4442 .2782 .013  5.53
Si1  .3860 .3070 .3764  .74  1.18
Al1  .3860 .3070 .3764  .26  1.18
Si3  .3023 .4110 .5000  .74  1.12
Al3  .3023 .4110 .5000  .26  1.12
Si4  .3883 .1831 .5000  .74   .98
Al4  .3883 .1831 .5000  .26   .98
Si5  .2500 .2500 .2500  .74  1.53
Al5  .2500 .2500 .2500  .26  1.53
O1   .3183 .3039 .3013       2.81
O3   .3719 .2321 .4249       2.51
O4   .3560 .3802 .4238       2.92
O7   .5000 .3161 .3477       2.41
O8   .3158 .1136 .5000       2.52
O9   .3083 .5000 .5000       2.27
O10  .5000 .1493 .5000       2.53
Wat1 .0000 .3728 .3020  .97 10.52
Wat2 .0417 .5000 .4217  .46  9.21
Wat3 .0998 .5000 .1777  .97 15.91
Wat4 .1334 .5000 .3749  .40 10.53
Wat5 .1426 .4171 .3135  .42 13.16
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: 4
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