American Mineralogist Crystal Structure Database

6 matching records for this search.

Andradite
Download hom/andradite.pdf
Armbruster T, Birrer J, Libowitzky E, Beran A
 
European Journal of Mineralogy 10 (1998) 907-921
Crystal chemistry of Ti-bearing andradites
Note: sample KAIS
Locality: Baden-Wurtemburg, Germany
_database_code_amcsd 0006754
12.122 12.122 12.122 90 90 90 Ia-3d
atom     x      y      z   occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
CaX      0    1/4    1/8  .965  .0089  .0103  .0103  .0062  .0030      0      0
MnX      0    1/4    1/8  .008  .0089  .0103  .0103  .0062  .0030      0      0
NaX      0    1/4    1/8  .006  .0089  .0103  .0103  .0062  .0030      0      0
MgX      0    1/4    1/8  .021  .0089  .0103  .0103  .0062  .0030      0      0
MgY      0      0      0 .0205 .00687  .0069  .0069  .0069  .0003  .0003  .0003
AlY      0      0      0  .112 .00687  .0069  .0069  .0069  .0003  .0003  .0003
TiY      0      0      0  .297 .00687  .0069  .0069  .0069  .0003  .0003  .0003
FeY      0      0      0 .5705 .00687  .0069  .0069  .0069  .0003  .0003  .0003
SiZ    3/8      0    1/4  .819  .0068  .0063  .0070  .0070      0      0      0
TiZ    3/8      0    1/4  .066  .0068  .0063  .0070  .0070      0      0      0
FeZ    3/8      0    1/4  .115  .0068  .0063  .0070  .0070      0      0      0
O    .0379 .04811 .65379        .0104  .0130  .0094  .0088 -.0017  .0025 -.0007
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View JMOL 3-D Structure (permalink)
 
Andradite
Download hom/andradite.pdf
Armbruster T, Birrer J, Libowitzky E, Beran A
 
European Journal of Mineralogy 10 (1998) 907-921
Crystal chemistry of Ti-bearing andradites
Note: sample KB166
Locality: Baden-Wurtemburg, Germany
_database_code_amcsd 0006755
12.122 12.122 12.122 90 90 90 Ia-3d
atom      x      y      z   occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
CaX       0    1/4    1/8 .9547  .0101  .0116  .0116  .0071  .0031      0      0
MnX       0    1/4    1/8 .0083  .0101  .0116  .0116  .0071  .0031      0      0
NaX       0    1/4    1/8 .0063  .0101  .0116  .0116  .0071  .0031      0      0
NiX       0    1/4    1/8 .0007  .0101  .0116  .0116  .0071  .0031      0      0
KX        0    1/4    1/8 .0003  .0101  .0116  .0116  .0071  .0031      0      0
MgX       0    1/4    1/8 .0297  .0101  .0116  .0116  .0071  .0031      0      0
MgY       0      0      0 .0115 .00809  .0081  .0081  .0081  .0003  .0003  .0003
AlY       0      0      0  .111 .00809  .0081  .0081  .0081  .0003  .0003  .0003
VY        0      0      0  .072 .00809  .0081  .0081  .0081  .0003  .0003  .0003
TiY       0      0      0   .31 .00809  .0081  .0081  .0081  .0003  .0003  .0003
FeY       0      0      0 .4955 .00809  .0081  .0081  .0081  .0003  .0003  .0003
SiZ     3/8      0    1/4  .786  .0080  .0074  .0083  .0083      0      0      0
TiZ     3/8      0    1/4  .069  .0080  .0074  .0083  .0083      0      0      0
FeZ     3/8      0    1/4  .145  .0080  .0074  .0083  .0083      0      0      0
O    .03800 .04804 .65369        .0118  .0146  .0106  .0104 -.0018  .0026 -.0003
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View JMOL 3-D Structure (permalink)
 
Andradite
Download hom/andradite.pdf
Armbruster T, Birrer J, Libowitzky E, Beran A
 
European Journal of Mineralogy 10 (1998) 907-921
Crystal chemistry of Ti-bearing andradites
Note: sample NZALA
Locality: N'Zala, Atlas mountains, Morocco
_database_code_amcsd 0006756
12.105 12.105 12.105 90 90 90 Ia-3d
atom      x      y      z   occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
CaX       0    1/4    1/8  .965 .00765  .0088  .0088  .0054  .0023      0      0
MnX       0    1/4    1/8  .008 .00765  .0088  .0088  .0054  .0023      0      0
NaX       0    1/4    1/8  .006 .00765  .0088  .0088  .0054  .0023      0      0
MgX       0    1/4    1/8  .021 .00765  .0088  .0088  .0054  .0023      0      0
MgY       0      0      0 .0205 .00577 .00577 .00577 .00577 .00027 .00027 .00027
AlY       0      0      0  .112 .00577 .00577 .00577 .00577 .00027 .00027 .00027
TiY       0      0      0  .297 .00577 .00577 .00577 .00577 .00027 .00027 .00027
FeY       0      0      0 .5705 .00577 .00577 .00577 .00577 .00027 .00027 .00027
SiZ     3/8      0    1/4 .9147  .0058  .0053  .0061  .0061      0      0      0
TiZ     3/8      0    1/4 .0363  .0058  .0053  .0061  .0061      0      0      0
FeZ     3/8      0    1/4  .049  .0058  .0053  .0061  .0061      0      0      0
O    .03859 .04828 .65440        .0090  .0108  .0085  .0077 -.0007  .0015 -.0005
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Andradite
Download hom/andradite.pdf
Armbruster T, Birrer J, Libowitzky E, Beran A
 
European Journal of Mineralogy 10 (1998) 907-921
Crystal chemistry of Ti-bearing andradites
Note: sample ZER1
Locality: Zermatt, Valais, Switzerland
_database_code_amcsd 0006757
12.060 12.060 12.060 90 90 90 Ia-3d
atom      x      y      z  occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
CaX       0    1/4    1/8 .973 .00711  .0080  .0080  .0053  .0016      0      0
MnX       0    1/4    1/8 .004 .00711  .0080  .0080  .0053  .0016      0      0
NaX       0    1/4    1/8 .001 .00711  .0080  .0080  .0053  .0016      0      0
MgX       0    1/4    1/8 .016 .00711  .0080  .0080  .0053  .0016      0      0
FeX       0    1/4    1/8 .006 .00711  .0080  .0080  .0053  .0016      0      0
AlY       0      0      0 .139 .00502  .0050  .0050  .0050 .00003 .00003 .00003
TiY       0      0      0 .164 .00502  .0050  .0050  .0050 .00003 .00003 .00003
FeY       0      0      0 .697 .00502  .0050  .0050  .0050 .00003 .00003 .00003
SiZ     3/8      0    1/4       .0050  .0044  .0052  .0052      0      0      0
O    .03888 .04815 .65452       .0080  .0086  .0083  .0073 -.0003  .0006  .0000
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Andradite
Download hom/andradite.pdf
Armbruster T, Birrer J, Libowitzky E, Beran A
 
European Journal of Mineralogy 10 (1998) 907-921
Crystal chemistry of Ti-bearing andradites
Note: sample SCHAFF
Locality: Schaffhausen area, Switzerland
_database_code_amcsd 0006758
12.038 12.038 12.038 90 90 90 Ia-3d
atom     x     y     z  occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
CaX      0   1/4   1/8 .978  .0079  .0092  .0092  .0053  .0025      0      0
MnX      0   1/4   1/8 .016  .0079  .0092  .0092  .0053  .0025      0      0
NaX      0   1/4   1/8 .004  .0079  .0092  .0092  .0053  .0025      0      0
MgX      0   1/4   1/8 .002  .0079  .0092  .0092  .0053  .0025      0      0
MgY      0     0     0 .025 .00719  .0072  .0072  .0072  .0000  .0000  .0000
AlY      0     0     0 .248 .00719  .0072  .0072  .0072  .0000  .0000  .0000
VY       0     0     0 .028 .00719  .0072  .0072  .0072  .0000  .0000  .0000
TiY      0     0     0 .112 .00719  .0072  .0072  .0072  .0000  .0000  .0000
FeY      0     0     0 .587 .00719  .0072  .0072  .0072  .0000  .0000  .0000
SiZ    3/8     0   1/4 .931  .0055  .0051  .0057  .0057      0      0      0
TiZ    3/8     0   1/4 .025  .0055  .0051  .0057  .0057      0      0      0
FeZ    3/8     0   1/4 .044  .0055  .0051  .0057  .0057      0      0      0
O    .0386 .0478 .6540       .0087  .0092  .0091  .0078 -.0002  .0005  .0006
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Andradite
Download hom/andradite.pdf
Armbruster T, Birrer J, Libowitzky E, Beran A
 
European Journal of Mineralogy 10 (1998) 907-921
Crystal chemistry of Ti-bearing andradites
Note: sample NAMIB
Locality: Okahandja, Namibia
_database_code_amcsd 0006759
11.764 11.764 11.764 90 90 90 Ia-3d
atom      x      y      z   occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
CaX       0    1/4    1/8 .5294 .00796  .0096  .0096  .0048  .0019      0      0
FeX       0    1/4    1/8  .238 .00796  .0096  .0096  .0048  .0019      0      0
MnX       0    1/4    1/8 .2303 .00796  .0096  .0096  .0048  .0019      0      0
NaX       0    1/4    1/8 .0003 .00796  .0096  .0096  .0048  .0019      0      0
MgX       0    1/4    1/8  .002 .00796  .0096  .0096  .0048  .0019      0      0
AlY       0      0      0 .8489  .0051  .0051  .0051  .0051  .0017  .0017  .0017
TiY       0      0      0 .0075  .0051  .0051  .0051  .0051  .0017  .0017  .0017
FeY       0      0      0 .1436  .0051  .0051  .0051  .0051  .0017  .0017  .0017
SiZ     3/8      0    1/4        .0050  .0063  .0044  .0044      0      0      0
O    .03693 .04666 .65247        .0083  .0106  .0078  .0064  .0015 -.0006  .0005
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: 6
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