|
Garnet |
| |
Ross C R, Keppler H, Canil D, O'Neill H St C |
 |
American Mineralogist 81 (1996) 61-66 |
|
Structure and crystal-field spectra of Co3Al2(SiO4)3 and (Mg,Ni)3Al2(SiO4)3 |
|
garnet |
|
Co3Al2(SiO4)3 |
|
_database_code_amcsd 0001771 |
|
11.4597 11.4597 11.4597 90 90 90 Ia-3d |
|
atom x y z B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
|
Si .375 0 .25 .00037 .00044 .00044 0 0 0 |
|
Al 0 0 0 .00045 .00045 .00045 .00001 .00001 .00001 |
|
Co .125 0 .25 .00056 .00145 .00145 0 0 .00077 |
|
O .0336 .0512 .6529 .00071 .00088 .00051 .00036 -.00031 -.00008 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Garnet |
| |
Ross C R, Keppler H, Canil D, O'Neill H St C |
|
American Mineralogist 81 (1996) 61-66 |
|
Structure and crystal-field spectra of Co3Al2(SiO4)3 and (Mg,Ni)3Al2(SiO4)3 |
|
garnet |
|
(Mg,Ni)3Al2(SiO4)3 |
|
_database_code_amcsd 0001772 |
|
11.4717 11.4717 11.4717 90 90 90 Ia-3d |
|
atom x y z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
|
Si .375 0 .25 .00060 .00068 .00068 0 0 0 |
|
Al 0 0 0 .00061 .00061 .00061 -.00001 -.00001 -.00001 |
|
Mg .125 -.0081 .2419 .425 .00113 .00309 .00309 .00070 .00070 .00371 |
|
Ni .125 -.0081 .2419 .075 .00113 .00309 .00309 .00070 .00070 .00371 |
|
O .0328 .0493 .6533 .00095 .00120 .00082 .00036 .00040 -.00011 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Enstatite |
 |
Smyth J R, Mierdel K, Keppler H, Langenhorst F, Dubrovinsky L, Nestola F |
| |
American Mineralogist 92 (2007) 973-976 |
|
Crystal chemistry of hydration in aluminous orthopyroxene |
|
Locality: synthetic |
|
_database_code_amcsd 0004362 |
|
18.1876 8.7352 5.1789 90 90 90 Pbca |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
MgM2 .37904 .48367 .35223 .958 .0086 .0104 .0101 .0054 -.0012 -.0020 .0000 |
|
MgM1 .37604 .65378 .86086 .79 .0061 .0062 .0080 .0042 -.0001 -.0009 -.0002 |
|
AlM1 .37604 .65378 .86086 .21 .0061 .0062 .0080 .0042 -.0001 -.0009 -.0002 |
|
Si1 .27135 .34230 .04527 .0058 .0056 .0080 .0039 -.0006 -.0001 .0002 |
|
Si2 .47307 .33717 .80610 .75 .0075 .0068 .0097 .0060 .0001 .0002 .0004 |
|
Al2 .47307 .33717 .80610 .25 .0075 .0068 .0097 .0060 .0001 .0002 .0004 |
|
O1a .18267 .3391 .0325 .0082 .0057 .0117 .0072 -.0012 -.0010 .0016 |
|
O2a .31066 .5049 .0380 .0082 .0084 .0102 .0061 -.0020 -.0005 .0002 |
|
O3a .30260 .2233 -.1737 .0083 .0079 .0121 .0051 -.0003 .0001 -.0017 |
|
O1b .56356 .3374 .8088 .0090 .0077 .0114 .0079 -.0008 .0016 .0020 |
|
O2b .43269 .4854 .6889 .0093 .0091 .0132 .0055 -.0017 -.0011 .0004 |
|
O3b .44653 .1910 .6142 .0093 .0079 .0108 .0092 .0002 .0010 -.0023 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
Multiple datasets can be concatenated into a single downloadable file by
selecting the datasets and then hitting the "Download Selected Data" button.
