American Mineralogist Crystal Structure Database

2 matching records for this search.

Ferro-axinite
Download hom/ferroaxinite.pdf
Swinnea J S, Steinfink H, Rendon-DiazMiron L E, Enciso de la Vega S
Download am/vol66/AM66_428.pdf
American Mineralogist 66 (1981) 428-431
The crystal structure of a Mexican axinite
_database_code_amcsd 0000831
7.1437 9.1898 8.9529 91.857 98.188 77.359 P-1
atom      x      y      z  occ Biso B(1,1) B(2,2) B(3,3)  B(1,2)  B(1,3)  B(2,3)
Ca1  .74651 .34816 .39493           .00234 .00147 .00191 -.00040 -.00030  .00028
Ca2  .18294 .10044 .08371           .00364 .00185 .00182 -.00093 -.00073  .00047
Fe   .76770 .59145 .11264 .550      .00210 .00245 .00196 -.00068  .00007  .00059
Mn   .76770 .59145 .11264 .130      .00210 .00245 .00196 -.00068  .00007  .00059
Mg   .76770 .59145 .11264 .185      .00210 .00245 .00196 -.00068  .00007  .00059
Ti   .76770 .59145 .11264 .005      .00210 .00245 .00196 -.00068  .00007  .00059
K    .76770 .59145 .11264 .022      .00210 .00245 .00196 -.00068  .00007  .00059
Na   .76770 .59145 .11264 .065      .00210 .00245 .00196 -.00068  .00007  .00059
Al1  .05263 .80053 .25405           .00153 .00094 .00092 -.00041  .00001  .00002
Al2  .35181 .93599 .42106 .893      .00135 .00089 .00091 -.00047 -.00011 -.00008
Fe2  .35181 .93599 .42106 .107      .00135 .00089 .00091 -.00047 -.00011 -.00008
B     .4615  .6344  .2870           .00177 .00125 .00138 -.00013 -.00015  .00002
H     .9895  .9604  .6299      2.37
Si1  .21049 .44986 .23373           .00202 .00100 .00110 -.00043 -.00013  .00007
Si2  .21891 .27461 .52317           .00149 .00099 .00107 -.00041 -.00005  .00003
Si3  .69874 .25668 .01148           .00200 .00163 .00100 -.00020  .00005  .00016
Si4  .64154 .01907 .23042           .00163 .00113 .00103 -.00046  .00011  .00000
O1    .0533  .6031  .1900           .00294 .00122 .00206 -.00042 -.00016  .00002
O2    .2317  .3388  .0949           .00446 .00187 .00215 -.00074  .00023 -.00041
O3    .4188  .4869  .3119           .00250 .00145 .00210 -.00082 -.00035  .00030
O4    .1356  .3716  .3692           .00353 .00299 .00194 -.00106 -.00022  .00141
O5    .0213  .2425  .5639           .00255 .00203 .00150 -.00080  .00021  .00029
O6    .3265  .3803  .6448           .00171 .00160 .00202  .00039 -.00043 -.00037
O7    .3810  .1275  .4958           .00205 .00119 .00174 -.00036  .00016 -.00025
O8    .5347  .3437  .8769           .00281 .00199 .00135 -.00018  .00033  .00030
O9    .8762  .1554  .9337           .00255 .00172 .00151 -.00022  .00029  .00005
O10   .7683  .3680  .1386           .00401 .00213 .00182 -.00063  .00016 -.00021
O11   .6038  .1348  .0874           .00380 .00246 .00206 -.00102  .00012  .00093
O12   .4360  .9813  .2442           .00265 .00180 .00151 -.00084  .00020  .00017
O13   .7211  .0995  .3847           .00259 .00167 .00144 -.00086  .00014 -.00010
O14   .7937  .8740  .1775           .00223 .00192 .00178 -.00032  .00004  .00031
O15   .3251  .7461  .3546           .00198 .00134 .00148 -.00049  .00020 -.00033
O16   .0968  .9955  .3223           .00220 .00161 .00174 -.00041  .00053 -.00038
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Axinite-(Fe)
Download hom/axinitefe.pdf
Swinnea J S, Steinfink H, Rendon-DiazMiron L E, Enciso de la Vega S
Download am/vol66/AM66_428.pdf
American Mineralogist 66 (1981) 428-431
The crystal structure of a Mexican axinite
_database_code_amcsd 0000832
7.1437 9.1898 8.9529 91.857 98.188 77.359 P-1
atom      x      y      z  occ Biso B(1,1) B(2,2) B(3,3)  B(1,2)  B(1,3)  B(2,3)
Ca1  .74651 .34816 .39493           .00234 .00147 .00191 -.00040 -.00030  .00028
Ca2  .18294 .10044 .08371           .00364 .00185 .00182 -.00093 -.00073  .00047
Fe   .76770 .59145 .11264 .550      .00210 .00245 .00196 -.00068  .00007  .00059
Mn   .76770 .59145 .11264 .130      .00210 .00245 .00196 -.00068  .00007  .00059
Mg   .76770 .59145 .11264 .185      .00210 .00245 .00196 -.00068  .00007  .00059
Ti   .76770 .59145 .11264 .005      .00210 .00245 .00196 -.00068  .00007  .00059
K    .76770 .59145 .11264 .022      .00210 .00245 .00196 -.00068  .00007  .00059
Na   .76770 .59145 .11264 .065      .00210 .00245 .00196 -.00068  .00007  .00059
Al1  .05263 .80053 .25405           .00153 .00094 .00092 -.00041  .00001  .00002
Al2  .35181 .93599 .42106 .893      .00135 .00089 .00091 -.00047 -.00011 -.00008
Fe2  .35181 .93599 .42106 .107      .00135 .00089 .00091 -.00047 -.00011 -.00008
B     .4615  .6344  .2870           .00177 .00125 .00138 -.00013 -.00015  .00002
H     .9895  .9604  .6299      2.37
Si1  .21049 .44986 .23373           .00202 .00100 .00110 -.00043 -.00013  .00007
Si2  .21891 .27461 .52317           .00149 .00099 .00107 -.00041 -.00005  .00003
Si3  .69874 .25668 .01148           .00200 .00163 .00100 -.00020  .00005  .00016
Si4  .64154 .01907 .23042           .00163 .00113 .00103 -.00046  .00011  .00000
O1    .0533  .6031  .1900           .00294 .00122 .00206 -.00042 -.00016  .00002
O2    .2317  .3388  .0949           .00446 .00187 .00215 -.00074  .00023 -.00041
O3    .4188  .4869  .3119           .00250 .00145 .00210 -.00082 -.00035  .00030
O4    .1356  .3716  .3692           .00353 .00299 .00194 -.00106 -.00022  .00141
O5    .0213  .2425  .5639           .00255 .00203 .00150 -.00080  .00021  .00029
O6    .3265  .3803  .6448           .00171 .00160 .00202  .00039 -.00043 -.00037
O7    .3810  .1275  .4958           .00205 .00119 .00174 -.00036  .00016 -.00025
O8    .5347  .3437  .8769           .00281 .00199 .00135 -.00018  .00033  .00030
O9    .8762  .1554  .9337           .00255 .00172 .00151 -.00022  .00029  .00005
O10   .7683  .3680  .1386           .00401 .00213 .00182 -.00063  .00016 -.00021
O11   .6038  .1348  .0874           .00380 .00246 .00206 -.00102  .00012  .00093
O12   .4360  .9813  .2442           .00265 .00180 .00151 -.00084  .00020  .00017
O13   .7211  .0995  .3847           .00259 .00167 .00144 -.00086  .00014 -.00010
O14   .7937  .8740  .1775           .00223 .00192 .00178 -.00032  .00004  .00031
O15   .3251  .7461  .3546           .00198 .00134 .00148 -.00049  .00020 -.00033
O16   .0968  .9955  .3223           .00220 .00161 .00174 -.00041  .00053 -.00038
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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