American Mineralogist Crystal Structure Database

5 matching records for this search.

Stilbite-Ca
Download hom/stilbiteca.pdf
Cruciani G, Artioli G, Gualtieri A, Stahl K, Hanson J C
Download am/vol82/AM82_729.pdf
American Mineralogist 82 (1997) 729-739
Dehydration dynamics of stilbite using synchrotron X-ray powder diffraction
Sample: at T = 315 K
_database_code_amcsd 0001919
13.6334 18.2443 17.8449 90 90.320 90 F2/m
atom      x     y     z occ Uiso
Si1   .3617 .3067 .1255 .76 .023
Al1   .3617 .3067 .1255 .24 .023
Si2   .1370 .3108 .1255 .76 .023
Al2   .1370 .3108 .1255 .24 .023
Si3  -.0536 .0901 .2448 .76 .023
Al3  -.0536 .0901 .2448 .24 .023
Si4  -.1358 .3149   .25 .76 .023
Al4  -.1358 .3149   .25 .24 .023
Si5       0 .2487     0 .76 .023
Al5       0 .2487     0 .24 .023
Ca    .2373     0 .0433 .99 .092
Na    .4736 .0563  .027 .22 .092
O1    .4208 .3046 .0449     .036
O2    .0608 .3051 .0558     .036
O3   -.1298 .2720 .1696     .036
O4   -.1071 .1170 .1683     .036
O5    .1170 .2376 .1771     .036
O6    .1092 .3792 .1808     .036
O7    .2507 .3181 .0985     .036
O8    .0636 .1114 .2503     .036
O9   -.0763     0 .2394     .036
O10    -.25 .3451   .25     .036
Wat1   .085  .089  .060 .41 .112
Wat2   .288  .130  .060     .112
Wat3   .183     0  .190     .112
Wat4   .404     0  .109     .112
Wat5   .383    .5  .075 .66 .112
Wat6   .138    .5  .046 .87 .112
Wat8   .227     0 -.094 .73 .112
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
Cruciani G, Artioli G, Gualtieri A, Stahl K, Hanson J C
Download am/vol82/AM82_729.pdf
American Mineralogist 82 (1997) 729-739
Dehydration dynamics of stilbite using synchrotron X-ray powder diffraction
Sample: at T = 416 K
_database_code_amcsd 0001920
13.6520 18.1575 17.790 90 90.227 90 F2/m
atom      x     y     z occ Uiso
Si1   .3592 .3034 .1265 .76 .023
Al1   .3592 .3034 .1265 .24 .023
Si2   .1366 .3132 .1280 .76 .023
Al2   .1366 .3132 .1280 .24 .023
Si3  -.0509 .0899 .2427 .76 .023
Al3  -.0509 .0899 .2427 .24 .023
Si4  -.1358 .3157 .2505 .76 .023
Al4  -.1358 .3157 .2505 .24 .023
Si5       0 .2447     0 .76 .023
Al5       0 .2447     0 .24 .023
Ca    .2440     0 .0387 .62 .094
Na     .334  .122  .083 .36 .094
O1    .4191 .3042 .0466     .040
O2    .0557 .2967 .0625     .040
O3   -.1206 .2747 .1693     .040
O4   -.1165 .1193 .1711     .040
O5    .1206 .2380 .1761     .040
O6    .1019 .3807 .1818     .040
O7    .2490 .3256 .0955     .040
O8    .0693 .1092 .2462     .040
O9   -.0644     0 .2494     .040
O10    -.25 .3487   .25     .040
Wat1   .110  .074  .078 .36 .120
Wat2   .250  .139  .059 .64 .120
Wat3   .194     0  .198 .88 .120
Wat4   .417     0  .072 .97 .120
Wat5   .383    .5  .082 .58 .120
Wat6   .110    .5  .051 .98 .120
Wat8   .214     0 -.100 .70 .120
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
Cruciani G, Artioli G, Gualtieri A, Stahl K, Hanson J C
Download am/vol82/AM82_729.pdf
American Mineralogist 82 (1997) 729-739
Dehydration dynamics of stilbite using synchrotron X-ray powder diffraction
Sample: at T = 441 K
_database_code_amcsd 0001921
13.7200 17.6808 17.4461 90 90 90 Amma
atom      x     y     z occ Uiso
Si1   .1383 .3289 .1327 .76 .036
Al1   .1383 .3289 .1327 .24 .036
Si1p  .1372 .2897 .3782 .76 .036
Al1p  .1372 .2897 .3782 .24 .036
Si3   .0493 .4084 .2760 .76 .036
Al3   .0493 .4084 .2760 .24 .036
Si4   .1359 .1864 .2336 .76 .036
Al4   .1359 .1864 .2336 .24 .036
Si5       0 .2935     0 .76 .036
Al5       0 .2935     0 .24 .036
Na1     .25  .315  .082 .06 .078
Ca1     .25  .315  .082 .11 .078
Na2    .205     0  .251 .04 .078
Ca2    .205     0  .251 .07 .078
Na4     .25    .5 .1119 .11 .078
Ca4     .25    .5 .1119 .19 .078
Na5     .25    .5  .422 .10 .078
Ca5     .25    .5  .422 .17 .078
O1    .0673 .3468 .0577     .052
O1p   .0666 .2668 .4520     .052
O3    .1212 .2417 .1601     .052
O3p   .1232 .2143 .3225     .052
O4    .1015 .3888 .1955     .052
O4p   .1250 .3740 .3375     .052
O7      .25 .3635 .1153     .052
O7p     .25 .2783 .4051     .052
O8    .0652 .1162 .2104     .052
O9    .0672    .5 .2979     .052
O10     .25 .1579 .2265     .052
Wat1   .142     0  .389 .49 .090
Wat2  .0443     0 .5851     .090
Wat3   .107     0 -.052 .58 .090
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
Cruciani G, Artioli G, Gualtieri A, Stahl K, Hanson J C
Download am/vol82/AM82_729.pdf
American Mineralogist 82 (1997) 729-739
Dehydration dynamics of stilbite using synchrotron X-ray powder diffraction
Sample: at T = 521 K
_database_code_amcsd 0001922
13.5849 17.6213 17.1148 90 90 90 Amma
atom      x     y     z occ Uiso
Si1   .1421 .3381 .1329 .76 .036
Al1   .1421 .3381 .1329 .24 .036
Si1d  .1412 .4124 .1106 .76 .036
Al1d  .1412 .4124 .1106 .24 .036
Si1p  .1394 .2756 .3761 .76 .036
Al1p  .1394 .2756 .3761 .24 .036
Si1pd .1505 .3244 .4364 .76 .036
Al1pd .1505 .3244 .4364 .24 .036
Si3   .0540 .4125 .2866 .76 .036
Al3   .0540 .4125 .2866 .24 .036
Si4   .1370 .1756 .2234 .76 .036
Al4   .1370 .1756 .2234 .24 .036
Si5       0 .3044     0 .76 .036
Al5       0 .3044     0 .24 .036
Na1     .25 .2468 .0494 .11 .078
Ca1     .25 .2468 .0494 .18 .078
Na2    .191     0  .230 .04 .078
Ca2    .191     0  .230 .08 .078
Na4     .25    .5 .1917 .13 .078
Ca4     .25    .5 .1917 .22 .078
Na5     .25    .5  .479 .04 .078
Ca5     .25    .5  .479 .06 .078
O1    .0693 .3568 .0586     .052
O1p   .0777 .2514 .4542     .052
O3    .1339 .2473 .1595     .052
O3d   -.107     0  .412 .57 .052
O3p   .1266 .2081 .3123     .052
O4    .0996 .3971 .1992     .052
O4p   .1021 .3635 .3577     .052
O7      .25 .3698 .1007     .052
O7p     .25 .2749 .4150     .052
O8    .0668 .0996 .2182     .052
O9    .0856    .5 .3101     .052
O10     .25 .1389 .2234     .052
Wat1   .187     0  .390 .34 .090
Wat2   .186     0  .529 .13 .090
Wat3   .053     0  .029 .26 .090
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: 5
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