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Grossular |
 |
Rodehorst U, Geiger C A, Armbruster T |
 |
American Mineralogist 87 (2002) 542-549 |
|
The crystal structures of grossular and spessartine between 100 and 600 K |
|
and the crystal chemistry of grossular-spessartine solid solutions |
|
Sample: T = 103 K |
|
_database_code_amcsd 0002766 |
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11.840 11.840 11.840 90 90 90 Ia-3d |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
O .03816 .04558 .65135 .0033 .0043 .0027 .0001 -.0005 -.0002 |
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Ca 0 .25 1/8 .0032 .0032 .0022 .0005 0 0 |
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Al 0 0 0 .0025 .0025 .0025 -.0002 -.0002 -.0002 |
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Si 3/8 0 .25 .0026 .0024 .0024 0 0 0 |
|
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Grossular |
|
Rodehorst U, Geiger C A, Armbruster T |
|
American Mineralogist 87 (2002) 542-549 |
|
The crystal structures of grossular and spessartine between 100 and 600 K |
|
and the crystal chemistry of grossular-spessartine solid solutions |
|
Sample: T = 156 K |
|
_database_code_amcsd 0002767 |
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11.842 11.842 11.842 90 90 90 Ia-3d |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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O .03835 .04525 .65131 .0036 .0038 .0033 -.0001 -.0002 -.0001 |
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Ca 0 .25 1/8 .0036 .0036 .0026 .0006 0 0 |
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Al 0 0 0 .0028 .0028 .0028 .0001 .0001 .0001 |
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Si 3/8 0 .25 .0026 .0024 .0024 0 0 0 |
|
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Grossular |
|
Rodehorst U, Geiger C A, Armbruster T |
|
American Mineralogist 87 (2002) 542-549 |
|
The crystal structures of grossular and spessartine between 100 and 600 K |
|
and the crystal chemistry of grossular-spessartine solid solutions |
|
Sample: T = 205 K |
|
_database_code_amcsd 0002768 |
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11.844 11.844 11.844 90 90 90 Ia-3d |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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O .03820 .04530 .65146 .0040 .0049 .0037 .0001 -.0003 .0004 |
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Ca 0 .25 1/8 .0043 .0043 .0029 .0005 0 0 |
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Al 0 0 0 .0032 .0032 .0032 -.0001 -.0001 -.0001 |
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Si 3/8 0 .25 .0031 .0027 .0027 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Grossular |
|
Rodehorst U, Geiger C A, Armbruster T |
|
American Mineralogist 87 (2002) 542-549 |
|
The crystal structures of grossular and spessartine between 100 and 600 K |
|
and the crystal chemistry of grossular-spessartine solid solutions |
|
Sample: T = 261 K |
|
_database_code_amcsd 0002769 |
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11.847 11.847 11.847 90 90 90 Ia-3d |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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O .0382 .0453 .65154 .0043 .0052 .0040 .0001 -.0001 .0005 |
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Ca 0 .25 1/8 .0051 .0051 .0031 .001 0 0 |
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Al 0 0 0 .0037 .0037 .0037 .0002 .0002 .0002 |
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Si 3/8 0 .25 .0034 .0030 .0030 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Grossular |
|
Rodehorst U, Geiger C A, Armbruster T |
|
American Mineralogist 87 (2002) 542-549 |
|
The crystal structures of grossular and spessartine between 100 and 600 K |
|
and the crystal chemistry of grossular-spessartine solid solutions |
|
Sample: T = 273 K |
|
_database_code_amcsd 0002770 |
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11.849 11.849 11.849 90 90 90 Ia-3d |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
O .0382 .0453 .65139 .0047 .0056 .0038 .0000 -.0005 .0003 |
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Ca 0 .25 1/8 .0055 .0055 .0034 .0007 0 0 |
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Al 0 0 0 .0039 .0039 .0039 -.0001 -.0001 -.0001 |
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Si 3/8 0 .25 .0036 .0031 .0031 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Grossular |
|
Rodehorst U, Geiger C A, Armbruster T |
|
American Mineralogist 87 (2002) 542-549 |
|
The crystal structures of grossular and spessartine between 100 and 600 K |
|
and the crystal chemistry of grossular-spessartine solid solutions |
|
Sample: T = 298 K |
|
_database_code_amcsd 0002771 |
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11.850 11.850 11.850 90 90 90 Ia-3d |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
O .0383 .0454 .65151 .0045 .0053 .0047 .0005 -.0003 .0001 |
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Ca 0 .25 1/8 .0058 .0058 .0036 .0007 0 0 |
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Al 0 0 0 .0040 .0040 .0040 -.0002 -.0002 -.0002 |
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Si 3/8 0 .25 .0044 .0043 .0043 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Grossular |
|
Rodehorst U, Geiger C A, Armbruster T |
|
American Mineralogist 87 (2002) 542-549 |
|
The crystal structures of grossular and spessartine between 100 and 600 K |
|
and the crystal chemistry of grossular-spessartine solid solutions |
|
Sample: T = 348 K |
|
_database_code_amcsd 0002772 |
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11.853 11.853 11.853 90 90 90 Ia-3d |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
O .0382 .0451 .65145 .0054 .0058 .0046 .0003 -.0006 .0003 |
|
Ca 0 .25 1/8 .0065 .0065 .0039 .0011 0 0 |
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Al 0 0 0 .0044 .0044 .0044 .0003 .0003 .0003 |
|
Si 3/8 0 .25 .0037 .0032 .0032 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Grossular |
|
Rodehorst U, Geiger C A, Armbruster T |
|
American Mineralogist 87 (2002) 542-549 |
|
The crystal structures of grossular and spessartine between 100 and 600 K |
|
and the crystal chemistry of grossular-spessartine solid solutions |
|
Sample: T = 398 K |
|
_database_code_amcsd 0002773 |
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11.855 11.855 11.855 90 90 90 Ia-3d |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
O .03827 .04512 .65158 .0068 .0070 .0057 .0006 -.0006 .0004 |
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Ca 0 .25 1/8 .0082 .0082 .0051 .0012 0 0 |
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Al 0 0 0 .0058 .0058 .0058 -.0002 -.0002 -.0002 |
|
Si 3/8 0 .25 .0049 .0048 .0048 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Grossular |
|
Rodehorst U, Geiger C A, Armbruster T |
|
American Mineralogist 87 (2002) 542-549 |
|
The crystal structures of grossular and spessartine between 100 and 600 K |
|
and the crystal chemistry of grossular-spessartine solid solutions |
|
Sample: T = 448 K |
|
_database_code_amcsd 0002774 |
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11.860 11.860 11.860 90 90 90 Ia-3d |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
O .0383 .0451 .65142 .0083 .0083 .0056 .0000 -.0006 .0003 |
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Ca 0 .25 1/8 .0093 .0093 .0057 .0016 0 0 |
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Al 0 0 0 .0061 .0061 .0061 -.0000 -.0000 -.0000 |
|
Si 3/8 0 .25 .0056 .0054 .0054 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Grossular |
|
Rodehorst U, Geiger C A, Armbruster T |
|
American Mineralogist 87 (2002) 542-549 |
|
The crystal structures of grossular and spessartine between 100 and 600 K |
|
and the crystal chemistry of grossular-spessartine solid solutions |
|
Sample: T = 498 K |
|
_database_code_amcsd 0002775 |
|
11.867 11.867 11.867 90 90 90 Ia-3d |
|
atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
O .03831 .0451 .65146 .0070 .0090 .0059 .0009 -.0006 .0007 |
|
Ca 0 .25 1/8 .0095 .0095 .0055 .0019 0 0 |
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Al 0 0 0 .0059 .0059 .0059 -.0004 -.0004 -.0004 |
|
Si 3/8 0 .25 .0051 .0048 .0048 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spessartine |
|
Rodehorst U, Geiger C A, Armbruster T |
|
American Mineralogist 87 (2002) 542-549 |
|
The crystal structures of grossular and spessartine between 100 and 600 K |
|
and the crystal chemistry of grossular-spessartine solid solutions |
|
Sample: T = 103 K |
|
_database_code_amcsd 0002776 |
|
11.604 11.604 11.604 90 90 90 Ia-3d |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
O .03492 .04798 .65236 .0037 .0037 .0028 .0002 -.0007 .0002 |
|
Mn 0 .25 1/8 .0039 .0039 .0023 .0006 0 0 |
|
Al 0 0 0 .0024 .0024 .0024 .0001 .0001 .0001 |
|
Si 3/8 0 .25 .0024 .0021 .0021 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spessartine |
|
Rodehorst U, Geiger C A, Armbruster T |
|
American Mineralogist 87 (2002) 542-549 |
|
The crystal structures of grossular and spessartine between 100 and 600 K |
|
and the crystal chemistry of grossular-spessartine solid solutions |
|
Sample: T = 156 K |
|
_database_code_amcsd 0002777 |
|
11.608 11.608 11.608 90 90 90 Ia-3d |
|
atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
O .03498 .04795 .65234 .0037 .0044 .0033 .0001 -.0004 .0003 |
|
Mn 0 .25 1/8 .0052 .0052 .0029 .0011 0 0 |
|
Al 0 0 0 .0029 .0029 .0029 .0001 .0001 .0001 |
|
Si 3/8 0 .25 .0026 .0024 .0024 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spessartine |
|
Rodehorst U, Geiger C A, Armbruster T |
|
American Mineralogist 87 (2002) 542-549 |
|
The crystal structures of grossular and spessartine between 100 and 600 K |
|
and the crystal chemistry of grossular-spessartine solid solutions |
|
Sample: T = 205 K |
|
_database_code_amcsd 0002778 |
|
11.610 11.610 11.610 90 90 90 Ia-3d |
|
atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
O .03492 .04783 .65236 .0038 .0050 .0036 .0002 -.0003 .0000 |
|
Mn 0 .25 1/8 .0064 .0064 .0034 .0013 0 0 |
|
Al 0 0 0 .0031 .0031 .0031 -.0000 -.0000 -.0000 |
|
Si 3/8 0 .25 .0029 .0026 .0026 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spessartine |
|
Rodehorst U, Geiger C A, Armbruster T |
|
American Mineralogist 87 (2002) 542-549 |
|
The crystal structures of grossular and spessartine between 100 and 600 K |
|
and the crystal chemistry of grossular-spessartine solid solutions |
|
Sample: T = 261 K |
|
_database_code_amcsd 0002779 |
|
11.615 11.615 11.615 90 90 90 Ia-3d |
|
atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
O .03489 .04775 .65226 .0051 .0061 .0037 .0005 -.0008 .0004 |
|
Mn 0 .25 1/8 .0077 .0077 .0038 .0014 0 0 |
|
Al 0 0 0 .0036 .0036 .0036 -.0000 -.0000 -.0000 |
|
Si 3/8 0 .25 .0036 .0032 .0032 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spessartine |
|
Rodehorst U, Geiger C A, Armbruster T |
|
American Mineralogist 87 (2002) 542-549 |
|
The crystal structures of grossular and spessartine between 100 and 600 K |
|
and the crystal chemistry of grossular-spessartine solid solutions |
|
Sample: T = 273 K |
|
_database_code_amcsd 0002780 |
|
11.615 11.615 11.615 90 90 90 Ia-3d |
|
atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
O .03511 .04774 .65228 .0052 .0061 .0039 .0006 -.0007 .0000 |
|
Mn 0 .25 1/8 .0080 .0080 .0041 .0016 0 0 |
|
Al 0 0 0 .0037 .0037 .0037 .0001 .0001 .0001 |
|
Si 3/8 0 .25 .0036 .0031 .0031 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spessartine |
|
Rodehorst U, Geiger C A, Armbruster T |
|
American Mineralogist 87 (2002) 542-549 |
|
The crystal structures of grossular and spessartine between 100 and 600 K |
|
and the crystal chemistry of grossular-spessartine solid solutions |
|
Sample: T = 298 K |
|
_database_code_amcsd 0002781 |
|
11.615 11.615 11.615 90 90 90 Ia-3d |
|
atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
O .0348 .0479 .6523 .0047 .0064 .0045 .0007 -.0010 .0001 |
|
Mn 0 .25 1/8 .0086 .0086 .0042 .0018 0 0 |
|
Al 0 0 0 .0036 .0036 .0036 -.0003 -.0003 -.0003 |
|
Si 3/8 0 .25 .0037 .0037 .0037 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spessartine |
|
Rodehorst U, Geiger C A, Armbruster T |
|
American Mineralogist 87 (2002) 542-549 |
|
The crystal structures of grossular and spessartine between 100 and 600 K |
|
and the crystal chemistry of grossular-spessartine solid solutions |
|
Sample: T = 348 K |
|
_database_code_amcsd 0002782 |
|
11.621 11.621 11.621 90 90 90 Ia-3d |
|
atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
O .0350 .0477 .6526 .0057 .0070 .0046 .0008 -.0006 .0005 |
|
Mn 0 .25 1/8 .0102 .0102 .0048 .0022 0 0 |
|
Al 0 0 0 .0045 .0045 .0045 .0003 .0003 .0003 |
|
Si 3/8 0 .25 .0038 .0040 .0040 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spessartine |
|
Rodehorst U, Geiger C A, Armbruster T |
|
American Mineralogist 87 (2002) 542-549 |
|
The crystal structures of grossular and spessartine between 100 and 600 K |
|
and the crystal chemistry of grossular-spessartine solid solutions |
|
Sample: T = 398 K |
|
_database_code_amcsd 0002783 |
|
11.622 11.622 11.622 90 90 90 Ia-3d |
|
atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
O .0350 .0478 .6524 .0053 .0077 .0053 .0002 -.0006 -.0011 |
|
Mn 0 .25 1/8 .0104 .0104 .0053 .0022 0 0 |
|
Al 0 0 0 .0046 .0046 .0046 .0000 .0000 .0000 |
|
Si 3/8 0 .25 .0045 .0038 .0038 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spessartine |
|
Rodehorst U, Geiger C A, Armbruster T |
|
American Mineralogist 87 (2002) 542-549 |
|
The crystal structures of grossular and spessartine between 100 and 600 K |
|
and the crystal chemistry of grossular-spessartine solid solutions |
|
Sample: T = 448 K |
|
_database_code_amcsd 0002784 |
|
11.624 11.624 11.624 90 90 90 Ia-3d |
|
atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
O .0350 .0478 .6525 .0051 .0077 .0050 .0008 -.0011 -.0003 |
|
Mn 0 .25 1/8 .0099 .0099 .0053 .0023 0 0 |
|
Al 0 0 0 .0044 .0044 .0044 .0008 .0008 .0008 |
|
Si 3/8 0 .25 .0048 .0036 .0036 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spessartine |
|
Rodehorst U, Geiger C A, Armbruster T |
|
American Mineralogist 87 (2002) 542-549 |
|
The crystal structures of grossular and spessartine between 100 and 600 K |
|
and the crystal chemistry of grossular-spessartine solid solutions |
|
Sample: T = 498 K |
|
_database_code_amcsd 0002785 |
|
11.627 11.627 11.627 90 90 90 Ia-3d |
|
atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
O .0349 .0478 .6525 .0061 .0076 .0051 .0005 -.0008 .0002 |
|
Mn 0 .25 1/8 .0108 .0108 .0052 .0026 0 0 |
|
Al 0 0 0 .0048 .0048 .0048 .0001 .0001 .0001 |
|
Si 3/8 0 .25 .0050 .0044 .0044 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spessartine |
|
Rodehorst U, Geiger C A, Armbruster T |
|
American Mineralogist 87 (2002) 542-549 |
|
The crystal structures of grossular and spessartine between 100 and 600 K |
|
and the crystal chemistry of grossular-spessartine solid solutions |
|
Sample: T = 548 K |
|
_database_code_amcsd 0002786 |
|
11.632 11.632 11.632 90 90 90 Ia-3d |
|
atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
O .0350 .0474 .6526 .0093 .0070 .0071 -.0009 -.0009 .0006 |
|
Mn 0 .25 1/8 .0139 .0139 .0067 .0029 0 0 |
|
Al 0 0 0 .0060 .0060 .0060 -.0003 -.0003 -.0003 |
|
Si 3/8 0 .25 .0053 .0056 .0056 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spessartine |
|
Rodehorst U, Geiger C A, Armbruster T |
|
American Mineralogist 87 (2002) 542-549 |
|
The crystal structures of grossular and spessartine between 100 and 600 K |
|
and the crystal chemistry of grossular-spessartine solid solutions |
|
Sample: T = 598 K |
|
_database_code_amcsd 0002787 |
|
11.641 11.641 11.641 90 90 90 Ia-3d |
|
atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
O .0350 .0474 .6526 .0073 .0107 .0070 .0005 -.0008 .0004 |
|
Mn 0 .25 1/8 .0149 .0149 .0069 .0029 0 0 |
|
Al 0 0 0 .0062 .0062 .0062 .0004 .0004 .0004 |
|
Si 3/8 0 .25 .0061 .0053 .0053 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spessartine |
|
Rodehorst U, Geiger C A, Armbruster T |
|
American Mineralogist 87 (2002) 542-549 |
|
The crystal structures of grossular and spessartine between 100 and 600 K |
|
and the crystal chemistry of grossular-spessartine solid solutions |
|
Sample: T = 648 K |
|
_database_code_amcsd 0002788 |
|
11.645 11.645 11.645 90 90 90 Ia-3d |
|
atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
O .0351 .0473 .6524 .0071 .0108 .0078 .0007 -.0015 -.0001 |
|
Mn 0 .25 1/8 .0159 .0159 .0078 .0032 0 0 |
|
Al 0 0 0 .0068 .0068 .0068 .0001 .0001 .0001 |
|
Si 3/8 0 .25 .0059 .0058 .0058 0 0 0 |
|
|
| 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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