|
Topaz |
 |
Diego Gatta G, Nestola F, Bromiley G D, Loose A |
 |
American Mineralogist 91 (2006) 1839-1846 |
|
New insight into crystal chemistry of topaz: a multi-methodological study |
|
Locality: Ouro Preto, Minas Gerias, Brazil |
|
Sample: X-ray refinement at T = 298 K |
|
Note: x(F4) corrected |
|
_database_code_amcsd 0004243 |
|
4.6601 8.8260 8.3778 90 90 90 Pbnm |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Al .9053 .13131 .0816 .0039 .0034 .0040 .00436 .00008 -.00010 .00008 |
|
Si .39976 .94088 .25 .0033 .0027 .0036 .0038 .0001 0 0 |
|
O1 .7064 .0311 .25 .005 .0041 .0054 .0054 .0017 0 0 |
|
O2 .4516 .7564 .25 .0049 .0059 .0037 .0050 .0009 0 0 |
|
O3 .2114 .98979 .09284 .0047 .0046 .0047 .0047 .0007 -.0011 -.0003 |
|
F4 .5982 .25263 .05988 .0083 .0075 .0084 .0089 -.0023 .0005 .0013 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Topaz |
|
Diego Gatta G, Nestola F, Bromiley G D, Loose A |
|
American Mineralogist 91 (2006) 1839-1846 |
|
New insight into crystal chemistry of topaz: a multi-methodological study |
|
Locality: Ouro Preto, Minas Gerias, Brazil |
|
Sample: Neutron refinement at T = 298 K |
|
_database_code_amcsd 0004244 |
|
4.667 8.834 8.395 90 90 90 Pbnm |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Al .9051 .13123 .0817 .0037 .0037 .0026 .0048 .0002 -.00001 .0002 |
|
Si .3996 .94088 .25 .0030 .0026 .0020 .0045 .0003 0 0 |
|
O1 .7059 .03129 .25 .0045 .0038 .0041 .0054 -.0011 0 0 |
|
O2 .4529 .75627 .25 .0046 .0055 .0026 .0057 .0008 0 0 |
|
O3 .2114 .98961 .09270 .0045 .0043 .0037 .0054 .0008 -.0011 -.0002 |
|
F4 .5976 .25265 .05971 .78 .0067 .0060 .0056 .0084 .0022 -.0008 .0010 |
|
O4 .5976 .25265 .05971 .22 .0067 .0060 .0056 .0084 .0022 -.0008 .0010 |
|
H4 .495 .252 .1629 .22 .037 .041 .049 .019 .026 .015 .014 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Topaz |
|
Diego Gatta G, Nestola F, Bromiley G D, Loose A |
|
American Mineralogist 91 (2006) 1839-1846 |
|
New insight into crystal chemistry of topaz: a multi-methodological study |
|
Locality: Ouro Preto, Minas Gerias, Brazil |
|
Sample: Neutron refinement at T = 10 K |
|
_database_code_amcsd 0004245 |
|
4.657 8.838 8.426 90 90 90 Pbnm |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Al .9056 .1313 .0817 .0029 .0028 .0013 .00472 .0003 -.0005 .0006 |
|
Si .3996 .9409 .25 .0027 .0018 .0011 .0052 .0003 0 0 |
|
O1 .7069 .0312 .25 .0038 .0039 .0026 .0050 -.0004 0 0 |
|
O2 .4528 .7562 .25 .0039 .0042 .0014 .0062 .0012 0 0 |
|
O3 .2117 .9899 .0926 .0037 .0031 .0020 .0061 .0006 -.0006 .0001 |
|
F4 .5973 .2525 .05992 .79 .0047 .0040 .0028 .0072 .0008 -.0003 -.0001 |
|
O4 .5973 .2525 .05992 .21 .0047 .0040 .0028 .0072 .0008 -.0003 -.0001 |
|
H4 .492 .251 .1637 .21 .025 .027 .027 .022 .010 .015 .008 |
|
|
| 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.
