American Mineralogist Crystal Structure Database

4 matching records for this search.

Vesuvianite
Download hom/vesuvianite.pdf
Ohkawa M, Yoshiasa A, Takeno S
Download am/vol77/AM77_945.pdf
American Mineralogist 77 (1992) 945-953
Crystal chemistry of vesuvianite: Site preferences of square-pyramidal
coordinated sites
sample #1 from Sauland
_database_code_amcsd 0001537
15.517 15.517 11.781 90 90 90 *P4/nnc
.25 .25 .25
atom      x      y     z occ
Ca1     .75    .25   .25
Ca2  -.1891  .0443 .3795
Ca3  -.1015 -.1802 .8882
CaC     .75    .75 .1428  .5
CuB     .75    .75 .0543 .26
MgB     .75    .75 .0543 .24
Mg   -.1124  .1211 .1265 .14
Al   -.1124  .1211 .1265 .86
AlA       0      0     0
Si1     .75    .25     0
Si2  -.1810  .0406 .8709
Si3  -.0831 -.1508 .3648
O1   -.2189  .1726 .0858
O2   -.1168  .1593 .2784
O3   -.0489  .2215 .0767
O4   -.0619  .1065 .4707
O5   -.1701  .0153 .1780
O6   -.1189 -.2716 .0586
O7    .0561  .1733 .3212
O8   -.0606 -.0908 .0663
O9   -.1447 -.1447   .25
OH10    .75    .75 .8676 .42
F10     .75    .75 .8676 .58
OH11 -.0046  .0625 .1362 .47
F11  -.0046  .0625 .1362 .53
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Vesuvianite
Download hom/vesuvianite.pdf
Ohkawa M, Yoshiasa A, Takeno S
Download am/vol77/AM77_945.pdf
American Mineralogist 77 (1992) 945-953
Crystal chemistry of vesuvianite: Site preferences of square-pyramidal
coordinated sites
sample #2 from Sanpo
_database_code_amcsd 0001538
15.606 15.606 11.825 90 90 90 *P4/nnc
.25 .25 .25
atom      x      y     z occ
Ca1    -.25    .25   .25
Ca2  -.1890  .0437 .3795
Ca3  -.0986 -.1785 .8855
CaC     .75    .75 .1355  .5
FeB     .75    .75 .0564  .5
Al   -.1118  .1205 .1270 .81
Fe   -.1118  .1205 .1270 .19
AlA       0      0     0
Si1     .75    .25     0
Si2  -.1808  .0402 .8715
Si3  -.0830 -.1507 .3643
O1   -.2207  .1727 .0854
O2   -.1169  .1602 .2801
O3   -.0487  .2224 .0755
O4   -.0614  .1060 .4699
O5   -.1705  .0145 .1794
O6   -.1180 -.2712 .0598
O7    .0561  .1745 .3221
O8   -.0609 -.0904 .0666
O9   -.1443 -.1443   .25
F10     .75    .75 .8515
OH11 -.0040  .0618 .1357
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Vesuvianite
Download hom/vesuvianite.pdf
Ohkawa M, Yoshiasa A, Takeno S
Download am/vol77/AM77_945.pdf
American Mineralogist 77 (1992) 945-953
Crystal chemistry of vesuvianite: Site preferences of square-pyramidal
coordinated sites
sample #3 from Jinmu
_database_code_amcsd 0001539
15.583 15.583 11.801 90 90 90 *P4/nnc
.25 .25 .25
atom      x      y     z occ
Ca1    -.25    .25   .25
Ca2  -.1893  .0441 .3795
Ca3  -.1003 -.1796 .8884
CaC     .75    .75 .1410  .5
FeB     .75    .75 .0555  .5
Al   -.1123  .1209 .1267 .87
Fe   -.1123  .1209 .1267 .13
AlA       0      0     0
Si1     .75    .25     0
Si2  -.1806  .0407 .8711
Si3  -.0827 -.1506 .3645
O1   -.2200  .1728 .0862
O2   -.1175  .1598 .2792
O3   -.0481  .2219 .0762
O4   -.0619  .1064 .4699
O5   -.1703  .0150 .1794
O6   -.1179 -.2720 .0583
O7    .0557  .1726 .3206
O8   -.0608 -.0906 .0664
O9   -.1447 -.1447   .25
OH10    .75    .75 .8625 .09
F10     .75    .75 .8625 .91
OH11 -.0035  .0616 .1360 .46
F11  -.0035  .0616 .1360 .54
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Vesuvianite
Download hom/vesuvianite.pdf
Ohkawa M, Yoshiasa A, Takeno S
Download am/vol77/AM77_945.pdf
American Mineralogist 77 (1992) 945-953
Crystal chemistry of vesuvianite: Site preferences of square-pyramidal
coordinated sites
sample #4 from Chichibu
_database_code_amcsd 0001540
15.546 15.546 11.828 90 90 90 *P4/nnc
.25 .25 .25
atom      x      y     z occ
Ca1    -.25    .25   .25
Ca2  -.1892  .0449 .3794
Ca3  -.1013 -.1821 .8907
CaC     .75    .75 .1494  .5
MgB     .75    .75 .0365 .26
FeB     .75    .75 .0365 .24
Al   -.1123  .1211 .1258 .97
Fe   -.1123  .1211 .1258 .03
AlA       0      0     0
Si1     .75    .25     0
Si2  -.1807  .0417 .8714
Si3  -.0839 -.1507 .3645
O1   -.2205  .1727 .0848
O2   -.1173  .1603 .2797
O3   -.0472  .2225 .0755
O4   -.0614  .1056 .4696
O5   -.1710  .0133 .1778
O6   -.1220 -.2734 .0573
O7    .0551  .1705 .3205
O8   -.0604 -.0909 .0671
O9   -.1447 -.1447   .25
OH10    .75    .75 .8657
OH11 -.0035  .0609 .1363
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
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Total number of retrieved datasets: 4
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