|
Spinel |
 |
Bosi F, Andreozzi G B, Ferrini V, Lucchesi S |
 |
American Mineralogist 89 (2004) 1367-1373 |
|
Behavior of cation vacany in kenotetrahedral Cr-spinels from Albanian eastern belt ophiolites |
|
Sample: Tro6f, Provenance is Tropoja massif, Sequence is cumulate |
|
_database_code_amcsd 0003621 |
|
8.2743 8.2743 8.2743 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
AlT .125 .125 .125 .001 .0073 |
|
Fe2+T .125 .125 .125 .162 .0073 |
|
Fe3+T .125 .125 .125 .176 .0073 |
|
MgT .125 .125 .125 .590 .0073 |
|
MnT .125 .125 .125 .003 .0073 |
|
SiT .125 .125 .125 .002 .0073 |
|
AlM .5 .5 .5 .196 .0062 |
|
Fe3+M .5 .5 .5 .001 .0062 |
|
CrM .5 .5 .5 .791 .0062 |
|
VM .5 .5 .5 .002 .0062 |
|
NiM .5 .5 .5 .002 .0062 |
|
TiM .5 .5 .5 .002 .0062 |
|
O .26156 .26156 .26156 .0084 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spinel |
|
Bosi F, Andreozzi G B, Ferrini V, Lucchesi S |
|
American Mineralogist 89 (2004) 1367-1373 |
|
Behavior of cation vacany in kenotetrahedral Cr-spinels from Albanian eastern belt ophiolites |
|
Sample: Shb4b, Provenance is Shebenik massif, Sequence is cumulate |
|
_database_code_amcsd 0003622 |
|
8.2991 8.2991 8.2991 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
AlT .125 .125 .125 .006 .0061 |
|
Fe2+T .125 .125 .125 .278 .0061 |
|
Fe3+T .125 .125 .125 .058 .0061 |
|
MgT .125 .125 .125 .631 .0061 |
|
MnT .125 .125 .125 .006 .0061 |
|
AlM .5 .5 .5 .200 .0042 |
|
Fe2+M .5 .5 .5 .005 .0042 |
|
Fe3+M .5 .5 .5 .025 .0042 |
|
MgM .5 .5 .5 .006 .0042 |
|
CrM .5 .5 .5 .762 .0042 |
|
NiM .5 .5 .5 .001 .0042 |
|
TiM .5 .5 .5 .003 .0042 |
|
O .26212 .26212 .26212 .0065 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spinel |
|
Bosi F, Andreozzi G B, Ferrini V, Lucchesi S |
|
American Mineralogist 89 (2004) 1367-1373 |
|
Behavior of cation vacany in kenotetrahedral Cr-spinels from Albanian eastern belt ophiolites |
|
Sample: Tro4f, Provenance is Tropoja massif, Sequence is tectonite |
|
_database_code_amcsd 0003623 |
|
8.2915 8.2915 8.2915 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
AlT .125 .125 .125 .010 .0062 |
|
Fe2+T .125 .125 .125 .395 .0062 |
|
Fe3+T .125 .125 .125 .022 .0062 |
|
MgT .125 .125 .125 .562 .0062 |
|
MnT .125 .125 .125 .007 .0062 |
|
AlM .5 .5 .5 .271 .0041 |
|
Fe3+M .5 .5 .5 .032 .0041 |
|
MgM .5 .5 .5 .012 .0041 |
|
CrM .5 .5 .5 .681 .0041 |
|
NiM .5 .5 .5 .002 .0041 |
|
TiM .5 .5 .5 .003 .0041 |
|
O .26267 .26267 .26267 .0063 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spinel |
|
Bosi F, Andreozzi G B, Ferrini V, Lucchesi S |
|
American Mineralogist 89 (2004) 1367-1373 |
|
Behavior of cation vacany in kenotetrahedral Cr-spinels from Albanian eastern belt ophiolites |
|
Sample: Tro4j, Provenance is Tropoja massif, Sequence is tectonite |
|
_database_code_amcsd 0003624 |
|
8.2864 8.2864 8.2864 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
AlT .125 .125 .125 .007 .0062 |
|
Fe2+T .125 .125 .125 .329 .0062 |
|
Fe3+T .125 .125 .125 .034 .0062 |
|
MgT .125 .125 .125 .619 .0062 |
|
MnT .125 .125 .125 .006 .0062 |
|
AlM .5 .5 .5 .284 .0042 |
|
Fe2+M .5 .5 .5 .011 .0042 |
|
Fe3+M .5 .5 .5 .022 .0042 |
|
MgM .5 .5 .5 .006 .0042 |
|
CrM .5 .5 .5 .673 .0042 |
|
VM .5 .5 .5 .002 .0042 |
|
NiM .5 .5 .5 .001 .0042 |
|
TiM .5 .5 .5 .003 .0042 |
|
O .26253 .26253 .26253 .0061 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spinel |
|
Bosi F, Andreozzi G B, Ferrini V, Lucchesi S |
|
American Mineralogist 89 (2004) 1367-1373 |
|
Behavior of cation vacany in kenotetrahedral Cr-spinels from Albanian eastern belt ophiolites |
|
Sample: N10a, Provenance is Bulqize, Bulqiza massif, Sequence is tectonite |
|
_database_code_amcsd 0003625 |
|
8.3133 8.3133 8.3133 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
AlT .125 .125 .125 .002 .0064 |
|
Fe2+T .125 .125 .125 .376 .0064 |
|
Fe3+T .125 .125 .125 .021 .0064 |
|
MgT .125 .125 .125 .587 .0064 |
|
MnT .125 .125 .125 .008 .0064 |
|
AlM .5 .5 .5 .181 .0044 |
|
Fe2+M .5 .5 .5 .001 .0044 |
|
Fe3+M .5 .5 .5 .034 .0044 |
|
MgM .5 .5 .5 .005 .0044 |
|
CrM .5 .5 .5 .776 .0044 |
|
VM .5 .5 .5 .002 .0044 |
|
TiM .5 .5 .5 .002 .0044 |
|
O .26236 .26236 .26236 .0061 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spinel |
|
Bosi F, Andreozzi G B, Ferrini V, Lucchesi S |
|
American Mineralogist 89 (2004) 1367-1373 |
|
Behavior of cation vacany in kenotetrahedral Cr-spinels from Albanian eastern belt ophiolites |
|
Sample: N7g, Provenance is Bulqize, Bulqiza massif, Sequence is tectonite |
|
_database_code_amcsd 0003626 |
|
8.3091 8.3091 8.3091 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
AlT .125 .125 .125 .001 .0060 |
|
Fe2+T .125 .125 .125 .343 .0060 |
|
Fe3+T .125 .125 .125 .026 .0060 |
|
MgT .125 .125 .125 .608 .0060 |
|
MnT .125 .125 .125 .009 .0060 |
|
AlM .5 .5 .5 .196 .0039 |
|
Fe3+M .5 .5 .5 .050 .0039 |
|
CrM .5 .5 .5 .750 .0039 |
|
NiM .5 .5 .5 .001 .0039 |
|
TiM .5 .5 .5 .003 .0039 |
|
O .26239 .26239 .26239 .0060 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spinel |
|
Bosi F, Andreozzi G B, Ferrini V, Lucchesi S |
|
American Mineralogist 89 (2004) 1367-1373 |
|
Behavior of cation vacany in kenotetrahedral Cr-spinels from Albanian eastern belt ophiolites |
|
Sample: Thkv1a, Provenance is Thekna, Bulqiza massif, Sequence is tectonite |
|
_database_code_amcsd 0003627 |
|
8.3081 8.3081 8.3081 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
Fe2+T .125 .125 .125 .323 .0058 |
|
Fe3+T .125 .125 .125 .037 .0058 |
|
MgT .125 .125 .125 .622 .0058 |
|
MnT .125 .125 .125 .007 .0058 |
|
AlM .5 .5 .5 .184 .0039 |
|
Fe2+M .5 .5 .5 .004 .0039 |
|
Fe3+M .5 .5 .5 .028 .0039 |
|
MgM .5 .5 .5 .001 .0039 |
|
CrM .5 .5 .5 .782 .0039 |
|
TiM .5 .5 .5 .001 .0039 |
|
O .26227 .26227 .26227 .0059 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spinel |
|
Bosi F, Andreozzi G B, Ferrini V, Lucchesi S |
|
American Mineralogist 89 (2004) 1367-1373 |
|
Behavior of cation vacany in kenotetrahedral Cr-spinels from Albanian eastern belt ophiolites |
|
Sample: Thkv1w, Provenance is Thekna, Bulqiza massif, Sequence is tectonite |
|
_database_code_amcsd 0003628 |
|
8.3033 8.3033 8.3033 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
AlT .125 .125 .125 .017 .0066 |
|
Fe2+T .125 .125 .125 .311 .0066 |
|
Fe3+T .125 .125 .125 .039 .0066 |
|
MgT .125 .125 .125 .612 .0066 |
|
MnT .125 .125 .125 .006 .0066 |
|
AlM .5 .5 .5 .185 .0048 |
|
Fe2+M .5 .5 .5 .001 .0048 |
|
Fe3+M .5 .5 .5 .025 .0048 |
|
MgM .5 .5 .5 .010 .0048 |
|
CrM .5 .5 .5 .776 .0048 |
|
VM .5 .5 .5 .002 .0048 |
|
TiM .5 .5 .5 .001 .0048 |
|
O .26207 .26207 .26207 .0070 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spinel |
|
Bosi F, Andreozzi G B, Ferrini V, Lucchesi S |
|
American Mineralogist 89 (2004) 1367-1373 |
|
Behavior of cation vacany in kenotetrahedral Cr-spinels from Albanian eastern belt ophiolites |
|
Sample: Shb2m, Provenance is Shebenik massif, Sequence is tectonite |
|
_database_code_amcsd 0003629 |
|
8.2793 8.2793 8.2793 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
Fe2+T .125 .125 .125 .200 .0062 |
|
Fe3+T .125 .125 .125 .133 .0062 |
|
MgT .125 .125 .125 .623 .0062 |
|
MnT .125 .125 .125 .004 .0062 |
|
AlM .5 .5 .5 .211 .0046 |
|
Fe3+M .5 .5 .5 .017 .0046 |
|
MgM .5 .5 .5 .010 .0046 |
|
CrM .5 .5 .5 .753 .0046 |
|
VM .5 .5 .5 .001 .0046 |
|
NiM .5 .5 .5 .002 .0046 |
|
TiM .5 .5 .5 .002 .0046 |
|
O .26187 .26187 .26187 .0067 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spinel |
|
Bosi F, Andreozzi G B, Ferrini V, Lucchesi S |
|
American Mineralogist 89 (2004) 1367-1373 |
|
Behavior of cation vacany in kenotetrahedral Cr-spinels from Albanian eastern belt ophiolites |
|
Sample: Shb4f, Provenance is Shebenik massif, Sequence is cumulate |
|
_database_code_amcsd 0003630 |
|
8.2902 8.2902 8.2902 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
Fe2+T .125 .125 .125 .275 .0057 |
|
Fe3+T .125 .125 .125 .071 .0057 |
|
MgT .125 .125 .125 .625 .0057 |
|
MnT .125 .125 .125 .006 .0057 |
|
SiT .125 .125 .125 .001 .0057 |
|
AlM .5 .5 .5 .222 .0035 |
|
Fe3+M .5 .5 .5 .016 .0035 |
|
MgM .5 .5 .5 .006 .0035 |
|
CrM .5 .5 .5 .750 .0035 |
|
VM .5 .5 .5 .002 .0035 |
|
NiM .5 .5 .5 .002 .0035 |
|
TiM .5 .5 .5 .001 .0035 |
|
O .26220 .26220 .26220 .0054 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spinel |
|
Bosi F, Andreozzi G B, Ferrini V, Lucchesi S |
|
American Mineralogist 89 (2004) 1367-1373 |
|
Behavior of cation vacany in kenotetrahedral Cr-spinels from Albanian eastern belt ophiolites |
|
Sample: Thkv2w, Provenance is Thekna, Bulqiza massif, Sequence is tectonite |
|
_database_code_amcsd 0003631 |
|
8.3057 8.3057 8.3057 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
Fe2+T .125 .125 .125 .295 .0057 |
|
Fe3+T .125 .125 .125 .033 .0057 |
|
MgT .125 .125 .125 .655 .0057 |
|
MnT .125 .125 .125 .007 .0057 |
|
SiT .125 .125 .125 .001 .0057 |
|
ZnT .125 .125 .125 .002 .0057 |
|
AlM .5 .5 .5 .189 .0036 |
|
Fe3+M .5 .5 .5 .033 .0036 |
|
MgM .5 .5 .5 .006 .0036 |
|
CrM .5 .5 .5 .768 .0036 |
|
VM .5 .5 .5 .001 .0036 |
|
NiM .5 .5 .5 .002 .0036 |
|
TiM .5 .5 .5 .001 .0036 |
|
O .26225 .26225 .26225 .0057 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spinel |
|
Bosi F, Andreozzi G B, Ferrini V, Lucchesi S |
|
American Mineralogist 89 (2004) 1367-1373 |
|
Behavior of cation vacany in kenotetrahedral Cr-spinels from Albanian eastern belt ophiolites |
|
Sample: N2h, Provenance is Bulqize, Bulqiza massif, Sequence is tectonite |
|
_database_code_amcsd 0003632 |
|
8.3071 8.3071 8.3071 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
AlT .125 .125 .125 .010 .0064 |
|
Fe2+T .125 .125 .125 .334 .0064 |
|
Fe3+T .125 .125 .125 .018 .0064 |
|
MgT .125 .125 .125 .626 .0064 |
|
MnT .125 .125 .125 .006 .0064 |
|
SiT .125 .125 .125 .001 .0064 |
|
AlM .5 .5 .5 .189 .0043 |
|
Fe2+M .5 .5 .5 .001 .0043 |
|
Fe3+M .5 .5 .5 .023 .0043 |
|
MgM .5 .5 .5 .011 .0043 |
|
CrM .5 .5 .5 .774 .0043 |
|
VM .5 .5 .5 .001 .0043 |
|
TiM .5 .5 .5 .001 .0043 |
|
O .26223 .26223 .26223 .0064 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spinel |
|
Bosi F, Andreozzi G B, Ferrini V, Lucchesi S |
|
American Mineralogist 89 (2004) 1367-1373 |
|
Behavior of cation vacany in kenotetrahedral Cr-spinels from Albanian eastern belt ophiolites |
|
Sample: Shkm1i, Provenance is Shkalla, Bulqiza massif, Sequence is tectonite |
|
_database_code_amcsd 0003633 |
|
8.3006 8.3006 8.3006 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
AlT .125 .125 .125 .016 .0065 |
|
Fe2+T .125 .125 .125 .288 .0065 |
|
Fe3+T .125 .125 .125 .006 .0065 |
|
MgT .125 .125 .125 .678 .0065 |
|
MnT .125 .125 .125 .006 .0065 |
|
SiT .125 .125 .125 .002 .0065 |
|
AlM .5 .5 .5 .211 .0046 |
|
Fe2+M .5 .5 .5 .003 .0046 |
|
Fe3+M .5 .5 .5 .042 .0046 |
|
MgM .5 .5 .5 .002 .0046 |
|
CrM .5 .5 .5 .737 .0046 |
|
VM .5 .5 .5 .001 .0046 |
|
NiM .5 .5 .5 .002 .0046 |
|
TiM .5 .5 .5 .002 .0046 |
|
O .26224 .26224 .26224 .0066 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spinel |
|
Bosi F, Andreozzi G B, Ferrini V, Lucchesi S |
|
American Mineralogist 89 (2004) 1367-1373 |
|
Behavior of cation vacany in kenotetrahedral Cr-spinels from Albanian eastern belt ophiolites |
|
Sample: Shkm3g, Provenance is Shkalla, Bulqiza massif, Sequence is tectonite |
|
_database_code_amcsd 0003634 |
|
8.2982 8.2982 8.2982 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
AlT .125 .125 .125 .001 .0060 |
|
Fe2+T .125 .125 .125 .311 .0060 |
|
Fe3+T .125 .125 .125 .039 .0060 |
|
MgT .125 .125 .125 .634 .0060 |
|
MnT .125 .125 .125 .007 .0060 |
|
AlM .5 .5 .5 .225 .0041 |
|
Fe2+M .5 .5 .5 .004 .0041 |
|
Fe3+M .5 .5 .5 .028 .0041 |
|
MgM .5 .5 .5 .006 .0041 |
|
CrM .5 .5 .5 .733 .0041 |
|
NiM .5 .5 .5 .002 .0041 |
|
TiM .5 .5 .5 .002 .0041 |
|
O .26238 .26238 .26238 .0062 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spinel |
|
Bosi F, Andreozzi G B, Ferrini V, Lucchesi S |
|
American Mineralogist 89 (2004) 1367-1373 |
|
Behavior of cation vacany in kenotetrahedral Cr-spinels from Albanian eastern belt ophiolites |
|
Sample: Ba4c, Provenance is Bater, Bulqiza massif, Sequence is cumulate |
|
_database_code_amcsd 0003635 |
|
8.3101 8.3101 8.3101 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
AlT .125 .125 .125 .005 .0065 |
|
Fe2+T .125 .125 .125 .268 .0065 |
|
Fe3+T .125 .125 .125 .017 .0065 |
|
MgT .125 .125 .125 .700 .0065 |
|
MnT .125 .125 .125 .006 .0065 |
|
SiT .125 .125 .125 .001 .0065 |
|
AlM .5 .5 .5 .175 .0046 |
|
Fe2+M .5 .5 .5 .001 .0046 |
|
Fe3+M .5 .5 .5 .041 .0046 |
|
MgM .5 .5 .5 .002 .0046 |
|
CrM .5 .5 .5 .775 .0046 |
|
VM .5 .5 .5 .001 .0046 |
|
NiM .5 .5 .5 .002 .0046 |
|
TiM .5 .5 .5 .002 .0046 |
|
O .26213 .26213 .26213 .0066 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spinel |
|
Bosi F, Andreozzi G B, Ferrini V, Lucchesi S |
|
American Mineralogist 89 (2004) 1367-1373 |
|
Behavior of cation vacany in kenotetrahedral Cr-spinels from Albanian eastern belt ophiolites |
|
Sample: N4x, Provenance is Bulqize, Bulqiza massif, Sequence is tectonite |
|
_database_code_amcsd 0003636 |
|
8.1992 8.1992 8.1992 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
AlT .125 .125 .125 .064 .0064 |
|
Fe2+T .125 .125 .125 .246 .0064 |
|
Fe3+T .125 .125 .125 .012 .0064 |
|
MgT .125 .125 .125 .670 .0064 |
|
MnT .125 .125 .125 .004 .0064 |
|
AlM .5 .5 .5 .587 .0049 |
|
Fe2+M .5 .5 .5 .002 .0049 |
|
Fe3+M .5 .5 .5 .021 .0049 |
|
MgM .5 .5 .5 .032 .0049 |
|
CrM .5 .5 .5 .352 .0049 |
|
NiM .5 .5 .5 .003 .0049 |
|
TiM .5 .5 .5 .003 .0049 |
|
O .26315 .26315 .26315 .0070 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spinel |
|
Bosi F, Andreozzi G B, Ferrini V, Lucchesi S |
|
American Mineralogist 89 (2004) 1367-1373 |
|
Behavior of cation vacany in kenotetrahedral Cr-spinels from Albanian eastern belt ophiolites |
|
Sample: Ba2y, Provenance is Bater, Bulqiza massif, Sequence is cumulate |
|
_database_code_amcsd 0003637 |
|
8.3043 8.3043 8.3043 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
AlT .125 .125 .125 .013 .0061 |
|
Fe2+T .125 .125 .125 .222 .0061 |
|
Fe3+T .125 .125 .125 .046 .0061 |
|
MgT .125 .125 .125 .692 .0061 |
|
MnT .125 .125 .125 .006 .0061 |
|
AlM .5 .5 .5 .162 .0045 |
|
Fe2+M .5 .5 .5 .001 .0045 |
|
Fe3+M .5 .5 .5 .028 .0045 |
|
MgM .5 .5 .5 .001 .0045 |
|
CrM .5 .5 .5 .803 .0045 |
|
VM .5 .5 .5 .001 .0045 |
|
NiM .5 .5 .5 .002 .0045 |
|
TiM .5 .5 .5 .001 .0045 |
|
O .26187 .26187 .26187 .0065 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Fluor-elbaite |
| |
Bosi F, Agrosi G, Lucchesi S, Melchiorre G, Scandale E |
|
American Mineralogist 90 (2005) 1661-1668 |
|
Mn-tourmaline from island of Elba (Italy): Crystal chemistry. |
|
Sample: Elb2rim |
|
Locality: Elba, Italy |
|
_database_code_amcsd 0003941 |
|
15.8232 15.8232 7.0960 90 90 120 R3m |
|
atom x y z occ Uiso |
|
NaX 0 0 .23197 .558 .0151 |
|
CaX 0 0 .23197 .125 .0151 |
|
AlY .12281 .06141 .63493 .555 .0065 |
|
LiY .12281 .06141 .63493 .416 .0065 |
|
FeY .12281 .06141 .63493 .014 .0065 |
|
MnY .12281 .06141 .63493 .015 .0065 |
|
AlZ .29677 .26010 .60947 .00504 |
|
SiT .19173 .18971 0 .985 .00431 |
|
BT .19173 .18971 0 .015 .00431 |
|
B .10901 .21802 .45411 .0046 |
|
F1W 0 0 .77928 .510 .0315 |
|
OH1W 0 0 .77928 .490 .0315 |
|
O2 .06031 .12062 .48895 .951 .0134 |
|
OH2 .06031 .12062 .48895 .049 .0134 |
|
O3V .26463 .13232 .50717 .0121 |
|
O4 .09352 .18704 .07346 .0082 |
|
O5 .18686 .09343 .09576 .0086 |
|
O6 .19507 .18476 .77465 .0064 |
|
O7 .28623 .28591 .07804 .0056 |
|
O8 .20954 .26996 .43888 .0064 |
|
H3 .2565 .1283 .3690 .05 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Fluor-elbaite |
| |
Bosi F, Agrosi G, Lucchesi S, Melchiorre G, Scandale E |
|
American Mineralogist 90 (2005) 1661-1668 |
|
Mn-tourmaline from island of Elba (Italy): Crystal chemistry. |
|
Sample: Tsl2y |
|
Locality: Elba, Italy |
|
_database_code_amcsd 0003942 |
|
15.9055 15.9055 7.1270 90 90 120 R3m |
|
atom x y z occ Uiso |
|
NaX 0 0 .23267 .786 .0225 |
|
CaX 0 0 .23267 .021 .0225 |
|
KX 0 0 .23267 .008 .0225 |
|
AlY .12318 .06159 .62744 .422 .0083 |
|
LiY .12318 .06159 .62744 .283 .0083 |
|
MnY .12318 .06159 .62744 .281 .0083 |
|
TiY .12318 .06159 .62744 .011 .0083 |
|
ZnY .12318 .06159 .62744 .003 .0083 |
|
AlZ .29758 .26086 .61151 .991 .0051 |
|
MnZ .29758 .26086 .61151 .009 .0051 |
|
SiT .19192 .18996 0 .996 .00401 |
|
AlT .19192 .18996 0 .003 .00401 |
|
BT .19192 .18996 0 .001 .00401 |
|
B .10969 .21938 .45457 .0050 |
|
F1W 0 0 .78262 .648 .060 |
|
OH1W 0 0 .78262 .352 .060 |
|
O2 .06091 .12182 .48293 .0192 |
|
O3V .26857 .13429 .50990 .0103 |
|
O4 .09335 .18670 .07149 .0075 |
|
O5 .18670 .09335 .09304 .0079 |
|
O6 .19695 .18684 .77565 .0068 |
|
O7 .28554 .28578 .08043 .0056 |
|
O8 .20989 .27071 .44137 .0072 |
|
H3 .2664 .1332 .3818 .09 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Fluor-elbaite |
| |
Bosi F, Agrosi G, Lucchesi S, Melchiorre G, Scandale E |
|
American Mineralogist 90 (2005) 1661-1668 |
|
Mn-tourmaline from island of Elba (Italy): Crystal chemistry. |
|
Sample: Tsl2z |
|
Locality: Elba, Italy |
|
_database_code_amcsd 0003943 |
|
15.9137 15.9137 7.1302 90 90 120 R3m |
|
atom x y z occ Uiso |
|
NaX 0 0 .23166 .776 .0233 |
|
CaX 0 0 .23166 .025 .0233 |
|
KX 0 0 .23166 .004 .0233 |
|
AlY .12330 .06165 .62683 .421 .0089 |
|
MnY .12330 .06165 .62683 .304 .0089 |
|
LiY .12330 .06165 .62683 .260 .0089 |
|
TiY .12330 .06165 .62683 .011 .0089 |
|
ZnY .12330 .06165 .62683 .004 .0089 |
|
AlZ .29771 .26099 .61151 .989 .0056 |
|
MnZ .29771 .26099 .61151 .011 .0056 |
|
SiT .19195 .18999 0 .987 .00453 |
|
AlT .19195 .18999 0 .009 .00453 |
|
BT .19195 .18999 0 .004 .00453 |
|
B .10975 .21950 .45422 .0058 |
|
F1W 0 0 .78207 .525 .062 |
|
OH1W 0 0 .78207 .388 .062 |
|
O1W 0 0 .78207 .087 .062 |
|
O2 .06098 .12196 .48263 .0200 |
|
O3V .26871 .13436 .51005 .0106 |
|
O4 .09330 .18660 .07079 .0085 |
|
O5 .18656 .09328 .09286 .0084 |
|
O6 .19712 .18702 .77570 .0072 |
|
O7 .28555 .28583 .08029 .0060 |
|
O8 .20999 .27077 .44151 .0076 |
|
H3 .2689 .1345 .3779 .08 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Fluor-elbaite |
| |
Bosi F, Agrosi G, Lucchesi S, Melchiorre G, Scandale E |
|
American Mineralogist 90 (2005) 1661-1668 |
|
Mn-tourmaline from island of Elba (Italy): Crystal chemistry. |
|
Sample: Tsl2w |
|
Locality: Elba, Italy |
|
_database_code_amcsd 0003944 |
|
15.9243 15.9243 7.1323 90 90 120 R3m |
|
atom x y z occ Uiso |
|
NaX 0 0 .23014 .758 .0227 |
|
CaX 0 0 .23014 .029 .0227 |
|
KX 0 0 .23014 .009 .0227 |
|
AlY .12349 .06175 .62602 .413 .0083 |
|
MnY .12349 .06175 .62602 .336 .0083 |
|
LiY .12349 .06175 .62602 .237 .0083 |
|
TiY .12349 .06175 .62602 .014 .0083 |
|
AlZ .29780 .26112 .61148 .989 .0048 |
|
MnZ .29780 .26112 .61148 .011 .0048 |
|
B .10982 .21964 .45407 .0046 |
|
SiT .19195 .19000 0 .984 .00377 |
|
AlT .19195 .19000 0 .016 .00377 |
|
F1W 0 0 .78168 .538 .062 |
|
OH1W 0 0 .78168 .393 .062 |
|
O1W 0 0 .78168 .069 .062 |
|
O2 .06105 .12210 .48194 .0194 |
|
O3V .26892 .13446 .50987 .0099 |
|
O4 .09335 .18670 .07076 .0074 |
|
O5 .18651 .09326 .09263 .0079 |
|
O6 .19724 .18712 .77553 .0066 |
|
O7 .28553 .28579 .08038 .0054 |
|
O8 .20995 .27074 .44136 .0069 |
|
H3 .2609 .1305 .3867 .03 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Fluor-elbaite |
| |
Bosi F, Agrosi G, Lucchesi S, Melchiorre G, Scandale E |
|
American Mineralogist 90 (2005) 1661-1668 |
|
Mn-tourmaline from island of Elba (Italy): Crystal chemistry. |
|
Sample: Tsl2x |
|
Locality: Elba, Italy |
|
_database_code_amcsd 0003945 |
|
15.9303 15.9303 7.1341 90 90 120 R3m |
|
atom x y z occ Uiso |
|
NaX 0 0 .22918 .737 .0233 |
|
CaX 0 0 .22918 .022 .0233 |
|
KX 0 0 .22918 .003 .0233 |
|
AlY .12357 .06179 .62546 .435 .0095 |
|
MnY .12357 .06179 .62546 .361 .0095 |
|
LiY .12357 .06179 .62546 .191 .0095 |
|
TiY .12357 .06179 .62546 .013 .0095 |
|
AlZ .29783 .26115 .61123 .987 .00522 |
|
MnZ .29783 .26115 .61123 .013 .00522 |
|
B .10984 .21968 .45416 .0058 |
|
SiT .19187 .18992 0 .987 .00411 |
|
AlT .19187 .18992 0 .013 .00411 |
|
F1W 0 0 .78032 .429 .056 |
|
OH1W 0 0 .78032 .382 .056 |
|
O1W 0 0 .78032 .189 .056 |
|
O2 .06116 .12232 .48259 .0204 |
|
O3V .26860 .13430 .50981 .0110 |
|
O4 .09346 .18692 .07035 .0082 |
|
O5 .18679 .09340 .09241 .0085 |
|
O6 .19719 .18703 .77546 .0072 |
|
O7 .28555 .28593 .07991 .0058 |
|
O8 .20995 .27081 .44136 .0076 |
|
H3 .2611 .1306 .3870 .09 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Fluor-elbaite |
| |
Bosi F, Agrosi G, Lucchesi S, Melchiorre G, Scandale E |
|
American Mineralogist 90 (2005) 1661-1668 |
|
Mn-tourmaline from island of Elba (Italy): Crystal chemistry. |
|
Sample: Tsl2m |
|
Locality: Elba, Italy |
|
_database_code_amcsd 0003946 |
|
15.9398 15.9398 7.1363 90 90 120 R3m |
|
atom x y z occ Uiso |
|
NaX 0 0 .22836 .686 .0236 |
|
CaX 0 0 .22836 .025 .0236 |
|
KX 0 0 .22836 .004 .0236 |
|
AlY .12374 .06187 .62473 .439 .0096 |
|
MnY .12374 .06187 .62473 .399 .0096 |
|
LiY .12374 .06187 .62473 .148 .0096 |
|
TiY .12374 .06187 .62473 .014 .0096 |
|
AlZ .29795 .26127 .61119 .983 .0048 |
|
MnZ .29795 .26127 .61119 .017 .0048 |
|
SiT .19189 .18993 0 .997 .00397 |
|
AlT .19189 .18993 0 .003 .00397 |
|
B .10992 .21984 .45388 .0050 |
|
F1W 0 0 .77963 .388 .056 |
|
O1W 0 0 .77963 .360 .056 |
|
OH1W 0 0 .77963 .252 .056 |
|
O2 .06126 .12252 .48260 .0201 |
|
O3V .26871 .13436 .50975 .0109 |
|
O4 .09348 .18696 .06993 .0077 |
|
O5 .18684 .09342 .09184 .0083 |
|
O6 .19730 .18708 .77557 .0069 |
|
O7 .28545 .28586 .08000 .0055 |
|
O8 .21004 .27095 .44127 .0073 |
|
H3 .2471 .1236 .393 .16 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Fluor-elbaite |
| |
Bosi F, Agrosi G, Lucchesi S, Melchiorre G, Scandale E |
|
American Mineralogist 90 (2005) 1661-1668 |
|
Mn-tourmaline from island of Elba (Italy): Crystal chemistry. |
|
Sample: Tsl2g |
|
Locality: Elba, Italy |
|
_database_code_amcsd 0003947 |
|
15.9461 15.9461 7.1380 90 90 120 R3m |
|
atom x y z occ Uiso |
|
NaX 0 0 .22773 .673 .0247 |
|
CaX 0 0 .22773 .016 .0247 |
|
KX 0 0 .22773 .007 .0247 |
|
AlY .12394 .06197 .62407 .434 .0102 |
|
MnY .12394 .06197 .62407 .403 .0102 |
|
LiY .12394 .06197 .62407 .149 .0102 |
|
TiY .12394 .06197 .62407 .014 .0102 |
|
AlZ .29801 .26130 .61129 .983 .00558 |
|
MnZ .29801 .26130 .61129 .017 .00558 |
|
SiT .19192 .18993 0 .987 .00456 |
|
AlT .19192 .18993 0 .013 .00456 |
|
B .11008 .22016 .45402 .0062 |
|
F1W 0 0 .77933 .409 .060 |
|
OH1W 0 0 .77933 .392 .060 |
|
O1W 0 0 .77933 .199 .060 |
|
O2 .06136 .12272 .48263 .0212 |
|
O3V .26864 .13432 .51008 .0117 |
|
O4 .09350 .18700 .06984 .0086 |
|
O5 .18703 .09352 .09168 .0090 |
|
O6 .19736 .18720 .77556 .0079 |
|
O7 .28538 .28584 .08001 .0064 |
|
O8 .21007 .27096 .44143 .0081 |
|
H3 .2636 .1318 .3865 .13 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Elbaite |
|
Bosi F, Andreozzi G B, Federico M, Graziani G, Lucchesi S |
|
American Mineralogist 90 (2005) 1784-1792 |
|
Crystal chemistry of the elbaite-schorl series |
|
Locality: Cruziero pegmatite, Minas Gerais, Brazil |
|
Sample: 66c |
|
_database_code_amcsd 0003949 |
|
15.8318 15.8318 7.0998 90 90 120 R3m |
|
atom x y z occ Uiso |
|
NaX 0 0 .23136 .549 .0213 |
|
CaX 0 0 .23136 .018 .0213 |
|
AlY .12312 .06156 .63440 .5353 .0067 |
|
MnY .12312 .06156 .63440 .0103 .0067 |
|
LiY .12312 .06156 .63440 .4543 .0067 |
|
AlZ .29670 .25987 .60996 .00524 |
|
SiT .19197 .18988 0 .00416 |
|
B .10903 .21806 .45468 .0051 |
|
OH1W 0 0 .78239 .681 .0409 |
|
F1W 0 0 .78239 .319 .0409 |
|
O2 .06015 .12030 .48966 .973 .0141 |
|
OH2 .06015 .12030 .48966 .027 .0141 |
|
OH3V .26544 .13272 .50744 .0115 |
|
O4 .09365 .18730 .07309 .0078 |
|
O5 .18746 .09373 .09545 .0079 |
|
O6 .19541 .18490 .77503 .0066 |
|
O7 .28626 .28609 .07879 .0057 |
|
O8 .20937 .26983 .43938 .0070 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Elbaite |
|
Bosi F, Andreozzi G B, Federico M, Graziani G, Lucchesi S |
|
American Mineralogist 90 (2005) 1784-1792 |
|
Crystal chemistry of the elbaite-schorl series |
|
Locality: Cruziero pegmatite, Minas Gerais, Brazil |
|
Sample: 61Rda |
|
_database_code_amcsd 0003950 |
|
15.8343 15.8343 7.1007 90 90 120 R3m |
|
atom x y z occ Uiso |
|
NaX 0 0 .23271 .515 .0184 |
|
CaX 0 0 .23271 .040 .0184 |
|
KX 0 0 .23271 .009 .0184 |
|
AlY .12327 .061635 .63436 .529 .0065 |
|
MnY .12327 .061635 .63436 .0097 .0065 |
|
LiY .12327 .061635 .63436 .4617 .0065 |
|
AlZ .29672 .25987 .61011 .00498 |
|
SiT .19196 .18989 0 .00391 |
|
B .10906 .21812 .45484 .0055 |
|
OH1W 0 0 .78265 .619 .0386 |
|
F1W 0 0 .78265 .381 .0386 |
|
O2 .06017 .12034 .48937 .9957 .0143 |
|
OH2 .06017 .12034 .48937 .0043 .0143 |
|
O3V .26567 .132835 .50772 .0112 |
|
O4 .09354 .18708 .07289 .0075 |
|
O5 .18713 .093565 .09540 .0078 |
|
O6 .19543 .18500 .77522 .0064 |
|
O7 .28621 .28605 .07882 .0054 |
|
O8 .20944 .26987 .43952 .0067 |
|
H3 .259 .1295 .357 .18 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Fluor-elbaite |
| |
Bosi F, Andreozzi G B, Federico M, Graziani G, Lucchesi S |
|
American Mineralogist 90 (2005) 1784-1792 |
|
Crystal chemistry of the elbaite-schorl series |
|
Locality: Cruziero pegmatite, Minas Gerais, Brazil |
|
Sample: 60fc |
|
_database_code_amcsd 0003951 |
|
15.8468 15.8468 7.1058 90 90 120 R3m |
|
atom x y z occ Uiso |
|
NaX 0 0 .23498 .674 .0211 |
|
AlY .12331 .061655 .63199 .5047 .0060 |
|
FeY .12331 .061655 .63199 .0647 .0060 |
|
MnY .12331 .061655 .63199 .0143 .0060 |
|
LiY .12331 .061655 .63199 .4167 .0060 |
|
AlZ .29690 .26012 .61026 .00460 |
|
SiT .19191 .18985 0 .9927 .00358 |
|
BT .19191 .18985 0 .0073 .00358 |
|
B .10914 .21828 .45492 .0048 |
|
F1W 0 0 .78146 .626 .0450 |
|
OH1W 0 0 .78146 .374 .0450 |
|
O2 .06032 .12064 .48814 .9337 .0139 |
|
OH2 .06032 .12064 .48814 .0663 .0139 |
|
O3V .26605 .133025 .50807 .0111 |
|
O4 .09350 .18700 .07286 .0072 |
|
O5 .18711 .093555 .09511 .0074 |
|
O6 .19578 .18530 .77522 .0061 |
|
O7 .28610 .28603 .07908 .0050 |
|
O8 .20954 .27012 .43987 .0063 |
|
H3 .254 .127 .355 .08 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Fluor-elbaite |
| |
Bosi F, Andreozzi G B, Federico M, Graziani G, Lucchesi S |
|
American Mineralogist 90 (2005) 1784-1792 |
|
Crystal chemistry of the elbaite-schorl series |
|
Locality: Cruziero pegmatite, Minas Gerais, Brazil |
|
Sample: 62ha |
|
_database_code_amcsd 0003952 |
|
15.8528 15.8528 7.1083 90 90 120 R3m |
|
atom x y z occ Uiso |
|
NaX 0 0 .23367 .625 .0196 |
|
AlY .12318 .06159 .63221 .4863 .0065 |
|
FeY .12318 .06159 .63221 .0393 .0065 |
|
MnY .12318 .06159 .63221 .032 .0065 |
|
MgY .12318 .06159 .63221 .0417 .0065 |
|
LiY .12318 .06159 .63221 .4273 .0065 |
|
AlZ .29691 .26007 .61051 .9995 .00496 |
|
FeZ .29691 .26007 .61051 .0005 .00496 |
|
SiT .19197 .18992 0 .9943 .00389 |
|
BT .19197 .18992 0 .0057 .00389 |
|
B .10919 .21838 .45486 .0056 |
|
F1W 0 0 .78347 .503 .0460 |
|
OH1W 0 0 .78347 .497 .0460 |
|
O2 .06033 .12066 .48778 .928 .0151 |
|
OH2 .06033 .12066 .48778 .072 .0151 |
|
O3V .26666 .13333 .50809 .0111 |
|
O4 .09343 .18686 .07244 .0075 |
|
O5 .18702 .09351 .09466 .0076 |
|
O6 .19586 .18550 .77525 .0066 |
|
O7 .28603 .28599 .07939 .0055 |
|
O8 .20958 .27010 .44007 .0068 |
|
H3 .258 .129 .373 .08 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Fluor-elbaite |
| |
Bosi F, Andreozzi G B, Federico M, Graziani G, Lucchesi S |
|
American Mineralogist 90 (2005) 1784-1792 |
|
Crystal chemistry of the elbaite-schorl series |
|
Locality: Cruziero pegmatite, Minas Gerais, Brazil |
|
Sample: 64gh |
|
_database_code_amcsd 0003953 |
|
15.8801 15.8801 7.1169 90 90 120 R3m |
|
atom x y z occ Uiso |
|
NaX 0 0 .23458 .661 .0193 |
|
CaX 0 0 .23458 .032 .0193 |
|
KX 0 0 .23458 .005 .0193 |
|
AlY .12328 .06164 .62898 .4563 .0070 |
|
FeY .12328 .06164 .62898 .0353 .0070 |
|
MnY .12328 .06164 .62898 .139 .0070 |
|
LiY .12328 .06164 .62898 .369 .0070 |
|
AlZ .29727 .26053 .61095 .9978 .00537 |
|
MnZ .29727 .26053 .61095 .0022 .00537 |
|
SiT .19195 .18993 0 .9993 .00428 |
|
BT .19195 .18993 0 .0007 .00428 |
|
B .10940 .21880 .45466 .0059 |
|
F1W 0 0 .78274 .516 .055 |
|
OH1W 0 0 .78274 .484 .055 |
|
O2 .06057 .12114 .48512 .0177 |
|
OH2 .06057 .12114 .48512 .0177 |
|
O3V .26771 .133855 .50884 .0110 |
|
O4 .09334 .18668 .07194 .0078 |
|
O5 .18687 .093435 .09427 .0080 |
|
O6 .19647 .18611 .77540 .0067 |
|
O7 .28589 .28598 .07977 .0057 |
|
O8 .20980 .27043 .44074 .0071 |
|
H3 .266 .133 .385 .04 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Fluor-elbaite |
| |
Bosi F, Andreozzi G B, Federico M, Graziani G, Lucchesi S |
|
American Mineralogist 90 (2005) 1784-1792 |
|
Crystal chemistry of the elbaite-schorl series |
|
Locality: Cruziero pegmatite, Minas Gerais, Brazil |
|
Sample: L4e |
|
_database_code_amcsd 0003954 |
|
15.9010 15.9010 7.1238 90 90 120 R3m |
|
atom x y z occ Uiso |
|
NaX 0 0 .23646 .841 .0209 |
|
KX 0 0 .23646 .005 .0209 |
|
AlY .12393 .061965 .62863 .390 .0066 |
|
TiY .12393 .061965 .62863 .0117 .0066 |
|
FeY .12393 .061965 .62863 .265 .0066 |
|
MnY .12393 .061965 .62863 .024 .0066 |
|
MgY .12393 .061965 .62863 .0003 .0066 |
|
LiY .12393 .061965 .62863 .309 .0066 |
|
AlZ .29760 .26078 .61160 .9825 .0048 |
|
MgZ .29760 .26078 .61160 .0175 .0048 |
|
SiT .19196 .18993 0 .9948 .00379 |
|
AlT .19196 .18993 0 .0028 .00379 |
|
BT .19196 .18993 0 .0023 .00379 |
|
B .10953 .21906 .45520 .0049 |
|
F1W 0 0 .78432 .754 .059 |
|
OH1W 0 0 .78432 .246 .059 |
|
O2 .06071 .12142 .48468 .9713 .0158 |
|
OH2 .06071 .12142 .48468 .0287 .0158 |
|
OH3V .26879 .134395 .50970 .0088 |
|
O4 .09314 .18628 .07146 .0075 |
|
O5 .18650 .09325 .09367 .0079 |
|
O6 .19699 .18687 .77585 .0065 |
|
O7 .28563 .28584 .08045 .0054 |
|
O8 .20995 .27049 .44164 .0067 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Fluor-elbaite |
| |
Bosi F, Andreozzi G B, Federico M, Graziani G, Lucchesi S |
|
American Mineralogist 90 (2005) 1784-1792 |
|
Crystal chemistry of the elbaite-schorl series |
|
Locality: Cruziero pegmatite, Minas Gerais, Brazil |
|
Sample: 61Vbh |
|
_database_code_amcsd 0003955 |
|
15.9285 15.9285 7.1286 90 90 120 R3m |
|
atom x y z occ Uiso |
|
NaX 0 0 .23439 .823 .0230 |
|
CaX 0 0 .23439 .049 .0230 |
|
KX 0 0 .23439 .008 .0230 |
|
AlY .12429 .062145 .62729 .392 .0069 |
|
TiY .12429 .062145 .62729 .005 .0069 |
|
Fe3+Y .12429 .062145 .62729 .010 .0069 |
|
Fe2+Y .12429 .062145 .62729 .287 .0069 |
|
MnY .12429 .062145 .62729 .0497 .0069 |
|
ZnY .12429 .062145 .62729 .050 .0069 |
|
LiY .12429 .062145 .62729 .2163 .0069 |
|
AlZ .29790 .26104 .61145 .9882 .0049 |
|
FeZ .29790 .26104 .61145 .0118 .0049 |
|
SiT .19201 .18998 0 .9785 .00378 |
|
AlT .19201 .18998 0 .0172 .00378 |
|
BT .19201 .18998 0 .0043 .00378 |
|
B .10980 .21960 .45534 .0053 |
|
F1W 0 0 .78365 .542 .061 |
|
OH1W 0 0 .78365 .355 .061 |
|
O1 0 0 .78365 .103 .061 |
|
O2 .06107 .12214 .48478 .0167 |
|
OH3V .26901 .134505 .50937 .0093 |
|
O4 .09325 .18650 .07042 .0077 |
|
O5 .18689 .093445 .09308 .0081 |
|
O6 .19751 .18714 .77552 .0064 |
|
O7 .28561 .28584 .08028 .0056 |
|
O8 .20992 .27047 .44139 .0069 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Fluor-elbaite |
| |
Bosi F, Andreozzi G B, Federico M, Graziani G, Lucchesi S |
|
American Mineralogist 90 (2005) 1784-1792 |
|
Crystal chemistry of the elbaite-schorl series |
|
Locality: Cruziero pegmatite, Minas Gerais, Brazil |
|
Sample: L4c |
|
_database_code_amcsd 0003956 |
|
15.9569 15.9569 7.1369 90 90 120 R3m |
|
atom x y z occ Uiso |
|
NaX 0 0 .23011 .649 .0241 |
|
KX 0 0 .23011 .007 .0241 |
|
AlY .12462 .06231 .62638 .3593 .00763 |
|
TiY .12462 .06231 .62638 .003 .00763 |
|
Fe3+Y .12462 .06231 .62638 .1097 .00763 |
|
Fe2+Y .12462 .06231 .62638 .3233 .00763 |
|
MnY .12462 .06231 .62638 .0637 .00763 |
|
MgY .12462 .06231 .62638 .0053 .00763 |
|
ZnY .12462 .06231 .62638 .036 .00763 |
|
LiY .12462 .06231 .62638 .0997 .00763 |
|
AlZ .29823 .26135 .61087 .9767 .00470 |
|
Fe3Z .29823 .26135 .61087 .0222 .00470 |
|
FeZ .29823 .26135 .61087 .001 .00470 |
|
MgZ .29823 .26135 .61087 .0002 .00470 |
|
SiT .19199 .18995 0 .9822 .00393 |
|
AlT .19199 .18995 0 .0178 .00393 |
|
B .11008 .22016 .45477 .0052 |
|
F1W 0 0 .78192 .433 .054 |
|
OH1W 0 0 .78192 .346 .054 |
|
O1 0 0 .78192 .221 .054 |
|
O2 .06141 .12282 .48586 .0165 |
|
O3V .26884 .13442 .50927 .0101 |
|
O4 .09339 .18678 .06920 .0081 |
|
O5 .18728 .09364 .09203 .0084 |
|
O6 .19781 .18730 .77537 .0067 |
|
O7 .28539 .28591 .07964 .0058 |
|
O8 .20986 .27064 .44098 .0073 |
|
H3 .260 .130 .393 .07 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Schorl |
|
Bosi F, Andreozzi G B, Federico M, Graziani G, Lucchesi S |
|
American Mineralogist 90 (2005) 1784-1792 |
|
Crystal chemistry of the elbaite-schorl series |
|
Locality: Cruziero pegmatite, Minas Gerais, Brazil |
|
Sample: L3h |
|
_database_code_amcsd 0003957 |
|
15.9784 15.9784 7.1495 90 90 120 R3m |
|
atom x y z occ Uiso |
|
CaX 0 0 .22524 .036 .024 |
|
NaX 0 0 .22524 .602 .024 |
|
KX 0 0 .22524 .008 .024 |
|
TiY .12441 .062205 .62765 .009 .0085 |
|
AlY .12441 .062205 .62765 .3337 .0085 |
|
Fe3+Y .12441 .062205 .62765 .180 .0085 |
|
Fe2+Y .12441 .062205 .62765 .3883 .0085 |
|
MnY .12441 .062205 .62765 .0327 .0085 |
|
ZnY .12441 .062205 .62765 .0157 .0085 |
|
LiY .12441 .062205 .62765 .0403 .0085 |
|
AlZ .29841 .26156 .61074 .961 .0054 |
|
FeZ .29841 .26156 .61074 .0338 .0054 |
|
MgZ .29841 .26156 .61074 .010 .0054 |
|
B .11023 .22046 .45497 .0062 |
|
SiT .19199 .18992 0 .9723 .0048 |
|
AlT .19199 .18992 0 .0277 .0048 |
|
F1W 0 0 .78194 .235 .051 |
|
OH1W 0 0 .78194 .303 .051 |
|
O1 0 0 .78194 .462 .051 |
|
O2 .06164 .12328 .48594 .0159 |
|
O3V .26832 .13416 .50951 .0112 |
|
O4 .09332 .18664 .06841 .0094 |
|
O5 .18760 .09380 .09145 .0098 |
|
O6 .19796 .18744 .77538 .0079 |
|
O7 .28530 .28592 .07952 .0072 |
|
O8 .20982 .27070 .44079 .0085 |
|
H3 .249 .1245 .36 .06 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Schorl |
|
Bosi F, Andreozzi G B, Federico M, Graziani G, Lucchesi S |
|
American Mineralogist 90 (2005) 1784-1792 |
|
Crystal chemistry of the elbaite-schorl series |
|
Locality: Cruziero pegmatite, Minas Gerais, Brazil |
|
Sample: L4b |
|
_database_code_amcsd 0003958 |
|
15.9658 15.9658 7.1487 90 90 120 R3m |
|
atom x y z occ Uiso |
|
CaX 0 0 .22748 .009 .0234 |
|
NaX 0 0 .22748 .632 .0234 |
|
KX 0 0 .22748 .009 .0234 |
|
TiY .12424 .06212 .62749 .0077 .00755 |
|
AlY .12424 .06212 .62749 .3523 .00755 |
|
Fe3+Y .12424 .06212 .62749 .1393 .00755 |
|
Fe2+Y .12424 .06212 .62749 .3797 .00755 |
|
MnY .12424 .06212 .62749 .0413 .00755 |
|
ZnY .12424 .06212 .62749 .0223 .00755 |
|
LiY .12424 .06212 .62749 .0573 .00755 |
|
AlZ .29832 .26140 .61065 .9618 .0048 |
|
Fe3Z .29832 .26140 .61065 .0275 .0048 |
|
FeZ .29832 .26140 .61065 .0087 .0048 |
|
MgZ .29832 .26140 .61065 .002 .0048 |
|
B .11013 .22026 .45520 .0054 |
|
SiT .19190 .18991 0 .9882 .0040 |
|
AlT .19190 .18991 0 .0118 .0040 |
|
F1W 0 0 .78097 .295 .045 |
|
OH1W 0 0 .78097 .363 .045 |
|
O1 0 0 .78097 .342 .045 |
|
O2 .06147 .12294 .48621 .0152 |
|
O3V .26860 .13430 .50962 .0104 |
|
O4 .09339 .18678 .06905 .0086 |
|
O5 .18714 .09357 .09126 .0085 |
|
O6 .19779 .18738 .77572 .0069 |
|
O7 .28519 .28571 .07954 .0062 |
|
O8 .20980 .27072 .44095 .0077 |
|
H3 .261 .1305 .390 .06 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Schorl |
|
Bosi F, Andreozzi G B, Federico M, Graziani G, Lucchesi S |
|
American Mineralogist 90 (2005) 1784-1792 |
|
Crystal chemistry of the elbaite-schorl series |
|
Locality: Cruziero pegmatite, Minas Gerais, Brazil |
|
Sample: L4d |
|
_database_code_amcsd 0003959 |
|
15.9768 15.9768 7.1534 90 90 120 R3m |
|
atom x y z occ Uiso |
|
CaX 0 0 .22648 .022 .0228 |
|
NaX 0 0 .22648 .556 .0228 |
|
KX 0 0 .22648 .007 .0228 |
|
TiY .12429 .062145 .62778 .0063 .00759 |
|
AlY .12429 .062145 .62778 .3557 .00759 |
|
Fe3+Y .12429 .062145 .62778 .1347 .00759 |
|
Fe2+Y .12429 .062145 .62778 .442 .00759 |
|
MnY .12429 .062145 .62778 .0143 .00759 |
|
MgY .12429 .062145 .62778 .0357 .00759 |
|
ZnY .12429 .062145 .62778 .011 .00759 |
|
AlZ .29840 .26155 .61057 .9533 .00447 |
|
Fe3Z .29840 .26155 .61057 .0417 .00447 |
|
FeZ .29840 .26155 .61057 .0002 .00447 |
|
MgZ .29840 .26155 .61057 .005 .00447 |
|
B .11032 .22064 .45469 .0052 |
|
SiT .19196 .18992 0 .9805 .00387 |
|
AlT .19196 .18992 0 .0195 .00387 |
|
F1W 0 0 .78056 .201 .039 |
|
OH1W 0 0 .78056 .347 .039 |
|
O1 0 0 .78056 .452 .039 |
|
O2 .06170 .12340 .48699 .0146 |
|
O3V .26807 .134035 .50941 .0111 |
|
O4 .09342 .18684 .06841 .0084 |
|
O5 .18750 .09375 .09164 .0086 |
|
O6 .19789 .18741 .77562 .0070 |
|
O7 .28522 .28575 .07907 .0064 |
|
O8 .20983 .27073 .44069 .0079 |
|
H3 .254 .127 .386 .09 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Oxy-schorl |
| |
Bosi F, Andreozzi G B, Federico M, Graziani G, Lucchesi S |
|
American Mineralogist 90 (2005) 1784-1792 |
|
Crystal chemistry of the elbaite-schorl series |
|
Locality: Cruziero pegmatite, Minas Gerais, Brazil |
|
Sample: L1v |
|
_database_code_amcsd 0003960 |
|
15.9825 15.9825 7.1596 90 90 120 R3m |
|
atom x y z occ Uiso |
|
CaX 0 0 .22594 .048 .0209 |
|
NaX 0 0 .22594 .647 .0209 |
|
KX 0 0 .22594 .010 .0209 |
|
TiY .12452 .06226 .62843 .0107 .00786 |
|
AlY .12452 .06226 .62843 .2883 .00786 |
|
Fe3+Y .12452 .06226 .62843 .2427 .00786 |
|
Fe2+Y .12452 .06226 .62843 .3623 .00786 |
|
MnY .12452 .06226 .62843 .0107 .00786 |
|
MgY .12452 .06226 .62843 .063 .00786 |
|
ZnY .12452 .06226 .62843 .0087 .00786 |
|
LiY .12452 .06226 .62843 .0133 .00786 |
|
AlZ .29850 .26164 .61093 .9538 .0048 |
|
Fe3Z .29850 .26164 .61093 .032 .0048 |
|
FeZ .29850 .26164 .61093 .0038 .0048 |
|
MgZ .29850 .26164 .61093 .0103 .0048 |
|
B .11030 .22060 .45479 .0049 |
|
SiT .19200 .18999 0 .9718 .00399 |
|
AlT .19200 .18999 0 .0282 .00399 |
|
F1W 0 0 .78131 .201 .042 |
|
OH1W 0 0 .78131 .367 .042 |
|
O1 0 0 .78131 .432 .042 |
|
O2 .06154 .12308 .48544 .0145 |
|
O3V .26866 .13433 .50964 .0109 |
|
O4 .09317 .18634 .06864 .0088 |
|
O5 .18676 .09338 .09128 .0089 |
|
O6 .19794 .18748 .77573 .0070 |
|
O7 .28533 .28579 .07946 .0064 |
|
O8 .20979 .27061 .44096 .0078 |
|
H3 .261 .1305 .394 .03 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Oxy-schorl |
| |
Bosi F, Andreozzi G B, Federico M, Graziani G, Lucchesi S |
|
American Mineralogist 90 (2005) 1784-1792 |
|
Crystal chemistry of the elbaite-schorl series |
|
Locality: Cruziero pegmatite, Minas Gerais, Brazil |
|
Sample: L1z |
|
_database_code_amcsd 0003961 |
|
15.9842 15.9842 7.1581 90 90 120 R3m |
|
atom x y z occ Uiso |
|
CaX 0 0 .22528 .071 .0203 |
|
NaX 0 0 .22528 .629 .0203 |
|
KX 0 0 .22528 .007 .0203 |
|
TiY .12454 .06227 .62850 .0113 .00805 |
|
AlY .12454 .06227 .62850 .3087 .00805 |
|
Fe3+Y .12454 .06227 .62850 .188 .00805 |
|
Fe2+Y .12454 .06227 .62850 .4093 .00805 |
|
MnY .12454 .06227 .62850 .012 .00805 |
|
MgY .12454 .06227 .62850 .0433 .00805 |
|
ZnY .12454 .06227 .62850 .0103 .00805 |
|
LiY .12454 .06227 .62850 .0167 .00805 |
|
AlZ .29848 .26167 .61089 .9352 .0049 |
|
Fe3Z .29848 .26167 .61089 .0158 .0049 |
|
FeZ .29848 .26167 .61089 .0213 .0049 |
|
MgZ .29848 .26167 .61089 .0277 .0049 |
|
B .11022 .22044 .45450 .0054 |
|
SiT .19198 .18997 0 .972 .00428 |
|
AlT .19198 .18997 0 .028 .00428 |
|
F1W 0 0 .78150 .249 .040 |
|
OH1W 0 0 .78150 .321 .040 |
|
O1 0 0 .78150 .430 .040 |
|
O2 .06159 .12318 .48544 .0139 |
|
O3V .26860 .13430 .50965 .0108 |
|
O4 .09318 .18636 .06852 .0088 |
|
O5 .18686 .09343 .09141 .0093 |
|
O6 .19789 .18751 .77579 .0070 |
|
O7 .28532 .28577 .07937 .0067 |
|
O8 .20975 .27057 .44099 .0080 |
|
H3 .259 .1295 .396 .07 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Spinel |
|
Bosi F, Halenius U, Andreozzi G B, Skogby H, Lucchesi S |
|
American Mineralogist 92 (2007) 27-33 |
|
Structural refinement and crystal chemistry of Mn-doped spinel: A case for |
|
tetrahedrally coordinated Mn3+ in an oxygen-based structure |
|
Sample: MgMn01 |
|
_database_code_amcsd 0004260 |
|
8.0883 8.0883 8.0883 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
MgT .125 .125 .125 .760 .0039 .0039 .0039 0 0 0 |
|
AlT .125 .125 .125 .234 .0039 .0039 .0039 0 0 0 |
|
Mn2+T .125 .125 .125 .003 .0039 .0039 .0039 0 0 0 |
|
Mn3+T .125 .125 .125 .003 .0039 .0039 .0039 0 0 0 |
|
AlM .5 .5 .5 .879 .0041 .0041 .0041 0 0 0 |
|
MgM .5 .5 .5 .117 .0041 .0041 .0041 0 0 0 |
|
Mn2+M .5 .5 .5 .0015 .0041 .0041 .0041 0 0 0 |
|
Mn3+M .5 .5 .5 .003 .0041 .0041 .0041 0 0 0 |
|
O .26213 .26213 .26213 .0072 .0072 .0072 0 0 0 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Spinel |
|
Bosi F, Halenius U, Andreozzi G B, Skogby H, Lucchesi S |
|
American Mineralogist 92 (2007) 27-33 |
|
Structural refinement and crystal chemistry of Mn-doped spinel: A case for |
|
tetrahedrally coordinated Mn3+ in an oxygen-based structure |
|
Sample: MgMn05 |
|
_database_code_amcsd 0004261 |
|
8.0965 8.0965 8.0965 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
MgT .125 .125 .125 .757 .0042 .0042 .0042 0 0 0 |
|
AlT .125 .125 .125 .228 .0042 .0042 .0042 0 0 0 |
|
Mn2+T .125 .125 .125 .013 .0042 .0042 .0042 0 0 0 |
|
Mn3+T .125 .125 .125 .003 .0042 .0042 .0042 0 0 0 |
|
AlM .5 .5 .5 .872 .0040 .0040 .0040 0 0 0 |
|
MgM .5 .5 .5 .1045 .0040 .0040 .0040 0 0 0 |
|
Mn2+M .5 .5 .5 .011 .0040 .0040 .0040 0 0 0 |
|
Mn3+M .5 .5 .5 .0125 .0040 .0040 .0040 0 0 0 |
|
O .26212 .26212 .26212 .0081 .0081 .0081 0 0 0 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Spinel |
|
Bosi F, Halenius U, Andreozzi G B, Skogby H, Lucchesi S |
|
American Mineralogist 92 (2007) 27-33 |
|
Structural refinement and crystal chemistry of Mn-doped spinel: A case for |
|
tetrahedrally coordinated Mn3+ in an oxygen-based structure |
|
Sample: MgMn10 |
|
_database_code_amcsd 0004262 |
|
8.1321 8.1321 8.1321 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
MgT .125 .125 .125 .749 .0055 .0055 .0055 0 0 0 |
|
AlT .125 .125 .125 .134 .0055 .0055 .0055 0 0 0 |
|
Mn2+T .125 .125 .125 .027 .0055 .0055 .0055 0 0 0 |
|
Mn3+T .125 .125 .125 .089 .0055 .0055 .0055 0 0 0 |
|
AlM .5 .5 .5 .837 .0053 .0053 .0053 0 0 0 |
|
MgM .5 .5 .5 .069 .0053 .0053 .0053 0 0 0 |
|
Mn2+M .5 .5 .5 .0425 .0053 .0053 .0053 0 0 0 |
|
Mn3+M .5 .5 .5 .0515 .0053 .0053 .0053 0 0 0 |
|
O .26232 .26232 .26232 .0108 .0108 .0108 0 0 0 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Spinel |
|
Bosi F, Halenius U, Andreozzi G B, Skogby H, Lucchesi S |
|
American Mineralogist 92 (2007) 27-33 |
|
Structural refinement and crystal chemistry of Mn-doped spinel: A case for |
|
tetrahedrally coordinated Mn3+ in an oxygen-based structure |
|
Sample: MgMn20 |
|
_database_code_amcsd 0004263 |
|
8.1413 8.1413 8.1413 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
MgT .125 .125 .125 .758 .0059 .0059 .0059 0 0 0 |
|
AlT .125 .125 .125 .104 .0059 .0059 .0059 0 0 0 |
|
Mn2+T .125 .125 .125 .013 .0059 .0059 .0059 0 0 0 |
|
Mn3+T .125 .125 .125 .126 .0059 .0059 .0059 0 0 0 |
|
AlM .5 .5 .5 .823 .0053 .0053 .0053 0 0 0 |
|
MgM .5 .5 .5 .0705 .0053 .0053 .0053 0 0 0 |
|
Mn2+M .5 .5 .5 .044 .0053 .0053 .0053 0 0 0 |
|
Mn3+M .5 .5 .5 .062 .0053 .0053 .0053 0 0 0 |
|
O .26231 .26231 .26231 .0107 .0107 .0107 0 0 0 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Dravite |
|
Bosi F |
| |
American Mineralogist 93 (2008) 1647-1653 |
|
Disordering of Fe2+ over octahedrally coordinated sites of tourmaline |
|
Locality: Uto Island, south of Stockholm, Sweden |
|
_database_code_amcsd 0004680 |
|
15.9875 15.9875 7.2372 90 90 120 R3m |
|
atom x y z occ Uiso |
|
NaX 0 0 .22803 .64 .0121 |
|
CaX 0 0 .22803 .29 .0121 |
|
KX 0 0 .22803 .01 .0121 |
|
MgY .12314 .06157 .63654 .427 .0072 |
|
FeY .12314 .06157 .63654 .383 .0072 |
|
AlY .12314 .06157 .63654 .18 .0072 |
|
MnY .12314 .06157 .63654 .007 .0072 |
|
TiY .12314 .06157 .63654 .003 .0072 |
|
AlZ .29818 .26182 .61179 .79 .0054 |
|
MgZ .29818 .26182 .61179 .16 .0054 |
|
FeZ .29818 .26182 .61179 .05 .0054 |
|
B .11004 .22008 .45391 .0067 |
|
SiT .19155 .18979 0 .0050 |
|
O1W 0 0 .77405 .38 .0118 |
|
OH1W 0 0 .77405 .54 .0118 |
|
FO1W 0 0 .77405 .08 .0118 |
|
O2 .06076 .12152 .48109 .0099 |
|
O3V .26447 .132235 .51197 .0115 |
|
O4 .09254 .18508 .07090 .0098 |
|
O5 .18277 .091385 .09062 .0099 |
|
O6 .19543 .18604 .77857 .0084 |
|
O7 .28443 .28420 .07916 .0087 |
|
O8 .20917 .26991 .44095 .0102 |
|
H .2510 .1255 .3888 .04 |
|
|
| Download AMC data (View Text File)
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|
| |
|
Picromerite |
|
Bosi F, Belardi G, Ballirano P |
| |
American Mineralogist 94 (2009) 74-82 |
|
Structural features in Tutton's salts K2[M2+(H2O)6](SO4)2, |
|
with M2+= Mg, Fe, Co, Ni, Cu, and Zn |
|
Locality: synthetic |
|
_database_code_amcsd 0004776 |
|
9.0954 12.2484 6.1335 90 104.880 90 P2_1/a |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
K .13134 .34617 .34067 .03040 .03259 .03123 .02921 -.00269 .01124 -.00037 |
|
MgM 0 0 0 .01600 .0154 .0168 .0157 -.0011 .0037 .0002 |
|
S .41077 .13607 .72574 .01749 .01540 .01931 .01754 -.00266 .00382 -.00196 |
|
O1 .40448 .23014 .57271 .0333 .0511 .0242 .0240 -.0128 .0083 .0023 |
|
O2 .55583 .07906 .7543 .0410 .0185 .0552 .0456 .0099 .0016 -.0102 |
|
O3 .28666 .06067 .62018 .02365 .0214 .0240 .0257 -.0080 .0064 -.0059 |
|
O4 .39265 .17398 .94652 .0272 .0377 .0261 .0193 -.0045 .0103 -.0048 |
|
OW1 .16878 .10875 .16561 .02416 .0219 .0284 .0208 -.0074 .0029 -.0005 |
|
OW2 -.16687 .11337 .03085 .02245 .0192 .0208 .0272 .0013 .0058 .0010 |
|
OW3 -.00576 -.06931 .29752 .02324 .0280 .0219 .0225 .0028 .0114 .0037 |
|
H11 .208 .090 .284 .045 |
|
H12 .232 .124 .104 .032 |
|
H21 -.245 .104 -.054 .049 |
|
H22 -.145 .177 -.003 .040 |
|
H31 -.073 -.066 .340 .075 |
|
H32 .027 -.131 .334 .051 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
K2Fe(SO4)2(H2O)6 |
| |
Bosi F, Belardi G, Ballirano P |
| |
American Mineralogist 94 (2009) 74-82 |
|
Structural features in Tutton's salts K2[M2+(H2O)6](SO4)2, |
|
with M2+= Mg, Fe, Co, Ni, Cu, and Zn |
|
Locality: synthetic |
|
_database_code_amcsd 0004777 |
|
9.0822 12.2786 6.1765 90 104.568 90 P2_1/a |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
K .13292 .34612 .34165 .03318 .0335 .0321 .0281 -.0024 .0088 -.0002 |
|
FeM 0 0 0 .01664 .0152 .0171 .0157 -.00117 .00047 .00022 |
|
S .41170 .13502 .72661 .02074 .0166 .0206 .0174 -.00235 .0016 -.00192 |
|
O1 .4065 .22972 .5758 .0370 .0515 .0258 .0242 -.0121 .0038 .0041 |
|
O2 .5553 .0764 .7503 .0441 .0202 .0598 .0410 .0109 -.0016 -.0133 |
|
O3 .28558 .06087 .6222 .0276 .0230 .0261 .0263 -.0083 .0051 -.0056 |
|
O4 .3960 .17192 .9476 .0303 .0377 .0280 .0199 -.0031 .0081 -.0040 |
|
OW1 .1725 .11375 .1714 .0284 .0228 .0309 .0214 -.0072 -.0013 .0004 |
|
OW2 -.17268 .11702 .0311 .0265 .0210 .0237 .0284 .0028 .0043 .0011 |
|
OW3 -.0045 -.07101 .3023 .0274 .0307 .0253 .0214 .0032 .0084 .0037 |
|
H11 .215 .088 .298 .029 |
|
H12 .247 .121 .108 .061 |
|
H21 -.262 .102 -.070 .035 |
|
H22 -.128 .185 .034 .070 |
|
H31 -.093 -.070 .341 .055 |
|
H32 .040 -.141 .354 .061 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
K2Co(SO4)2(H2O)6 |
| |
Bosi F, Belardi G, Ballirano P |
| |
American Mineralogist 94 (2009) 74-82 |
|
Structural features in Tutton's salts K2[M2+(H2O)6](SO4)2, |
|
with M2+= Mg, Fe, Co, Ni, Cu, and Zn |
|
Locality: synthetic |
|
_database_code_amcsd 0004778 |
|
9.0609 12.2156 6.1586 90 104.839 90 P2_1/a |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
K .13269 .34534 .34159 .02916 .0301 .0304 .02903 -.00223 .01121 -.00041 |
|
CoM 0 0 0 .01471 .01264 .01578 .01555 -.00105 .00331 .00029 |
|
S .41148 .13499 .72532 .01711 .01455 .01910 .01763 -.00239 .00404 -.00191 |
|
O1 .40752 .23005 .5751 .0319 .0462 .0242 .0244 -.0119 .0074 .0023 |
|
O2 .55540 .07588 .7517 .0387 .0176 .0523 .0427 .0096 .0013 -.0103 |
|
O3 .28472 .06080 .6189 .0232 .0189 .0246 .0265 -.0076 .0068 -.0051 |
|
O4 .39463 .17267 .9464 .0260 .0355 .0250 .0189 -.0039 .0096 -.0034 |
|
OW1 .17019 .11228 .1665 .0233 .0201 .0277 .0207 -.0068 .0028 -.0004 |
|
OW2 -.17045 .11495 .0340 .0222 .0177 .0214 .0274 .0011 .0058 .0004 |
|
OW3 -.00388 -.06892 .3000 .0226 .0270 .0217 .0215 .0034 .0107 .0036 |
|
H11 .205 .091 .290 .035 |
|
H12 .238 .121 .102 .048 |
|
H21 -.254 .104 -.050 .058 |
|
H22 -.147 .176 -.001 .048 |
|
H31 -.072 -.060 .346 .061 |
|
H32 .024 -.130 .333 .057 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
K2Ni(SO4)2(H2O)6 |
| |
Bosi F, Belardi G, Ballirano P |
| |
American Mineralogist 94 (2009) 74-82 |
|
Structural features in Tutton's salts K2[M2+(H2O)6](SO4)2, |
|
with M2+= Mg, Fe, Co, Ni, Cu, and Zn |
|
Locality: synthetic |
|
_database_code_amcsd 0004779 |
|
9.0049 12.1904 6.1368 90 105.047 90 P2_1/a |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
K .13415 .34561 .34287 .02864 .03046 .0295 .02847 -.00189 .01221 -.00026 |
|
NiM 0 0 0 .01387 .01271 .01479 .01434 -.00095 .00391 .00014 |
|
S .41182 .13508 .72625 .01642 .01451 .01763 .01711 -.00207 .00410 -.00185 |
|
O1 .40933 .22977 .5747 .0305 .0466 .0221 .0236 -.0101 .0103 .0021 |
|
O2 .55685 .07498 .7563 .0374 .0172 .0486 .0429 .0090 .0017 -.0096 |
|
O3 .28357 .06140 .6186 .0223 .0192 .0238 .0248 -.0080 .0073 -.0049 |
|
O4 .39398 .17389 .9472 .0257 .0355 .0257 .0177 -.0035 .0100 -.0035 |
|
OW1 .16694 .11095 .1630 .0214 .0200 .0245 .0191 -.0061 .0043 -.0013 |
|
OW2 -.16659 .11244 .0356 .0204 .0177 .0191 .0246 .0007 .0061 -.0005 |
|
OW3 .00028 -.06662 .3016 .0207 .0252 .0197 .0195 .0013 .0100 .0028 |
|
H11 .204 .087 .292 .032 |
|
H12 .223 .122 .095 .044 |
|
H21 -.249 .102 -.051 .048 |
|
H22 -.149 .174 -.005 .042 |
|
H31 -.065 -.064 .328 .075 |
|
H32 .028 -.135 .328 .064 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Cyanochroite |
|
Bosi F, Belardi G, Ballirano P |
| |
American Mineralogist 94 (2009) 74-82 |
|
Structural features in Tutton's salts K2[M2+(H2O)6](SO4)2, |
|
with M2+= Mg, Fe, Co, Ni, Cu, and Zn |
|
Locality: synthetic |
|
_database_code_amcsd 0004780 |
|
9.0851 12.1302 6.1674 90 104.450 90 P2_1/a |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
K .12305 .34736 .34202 .02853 .02998 .03057 .02703 -.00119 .01086 -.00043 |
|
CuM 0 0 0 .01548 .01541 .01697 .01406 -.00243 .00367 .00068 |
|
S .40127 .13607 .72269 .01757 .01673 .01915 .01706 -.00278 .00465 -.00135 |
|
O1 .39830 .23523 .5827 .0316 .0466 .0233 .0245 -.0109 .0079 .0035 |
|
O2 .54389 .07577 .7409 .0359 .0193 .0482 .0381 .0076 .0033 -.0076 |
|
O3 .27318 .06377 .61100 .0230 .0201 .0258 .0236 -.0076 .0062 -.0052 |
|
O4 .38523 .16801 .94724 .0273 .0357 .0295 .0188 -.0031 .0100 -.0044 |
|
OW1 .16072 .11203 .1636 .0261 .0238 .0346 .0192 -.0058 .0043 .0026 |
|
OW2 -.18654 .11833 .0369 .0270 .0235 .0282 .0282 -.0021 .0045 .0031 |
|
OW3 -.00266 -.06475 .28730 .0204 .0222 .0220 .0188 .0014 .0081 .0033 |
|
H11 .194 .093 .295 .055 |
|
H12 .228 .122 .098 .044 |
|
H21 -.265 .108 -.052 .047 |
|
H22 -.161 .184 .005 .055 |
|
H31 -.074 -.061 .325 .059 |
|
H32 .033 -.131 .316 .064 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
K2Zn(SO4)2(H2O)6 |
| |
Bosi F, Belardi G, Ballirano P |
| |
American Mineralogist 94 (2009) 74-82 |
|
Structural features in Tutton's salts K2[M2+(H2O)6](SO4)2, |
|
with M2+= Mg, Fe, Co, Ni, Cu, and Zn |
|
Locality: synthetic |
|
_database_code_amcsd 0004781 |
|
9.0449 12.2213 6.1592 90 104.775 90 P2_1/a |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
K .13362 .34570 .34310 .02896 .0311 .0299 .0281 -.0025 .0115 -.0003 |
|
ZnM 0 0 0 .01671 .0164 .01722 .01629 -.00150 .00369 .00033 |
|
S .41199 .13524 .72669 .01703 .0154 .0183 .0174 -.0026 .0042 -.0014 |
|
O1 .4079 .23002 .5770 .0327 .0506 .0238 .0228 -.0123 .0076 .0030 |
|
O2 .5562 .0760 .7528 .0388 .0187 .0518 .0430 .0100 .0023 -.0104 |
|
O3 .2841 .06149 .6206 .0232 .0189 .0260 .0255 -.0078 .0070 -.0068 |
|
O4 .3954 .17307 .9477 .0255 .0339 .0257 .0190 -.0033 .0103 -.0046 |
|
OW1 .1699 .11285 .1667 .0232 .0209 .0271 .0210 -.0065 .0042 -.0004 |
|
OW2 -.1702 .11474 .0352 .0222 .0199 .0219 .0248 .0005 .0056 .0001 |
|
OW3 -.0023 -.06799 .3000 .0225 .0272 .0220 .0206 .0025 .0104 .0019 |
|
H11 .199 .095 .292 .039 |
|
H12 .230 .121 .105 .038 |
|
H21 -.245 .100 -.053 .047 |
|
H22 -.149 .173 .003 .057 |
|
H31 -.084 -.063 .337 .067 |
|
H32 .031 -.127 .329 .050 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Magnetite |
|
Bosi F, Halenius U, Skogby H |
| |
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: Mgt100 |
|
_database_code_amcsd 0004815 |
|
8.3967 8.3967 8.3967 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
FeT .125 .125 .125 .0056 .0056 .0056 0 0 0 |
|
FeM .5 .5 .5 .0071 .0071 .0071 .00072 .00072 .00072 |
|
O .25476 .25476 .25476 .0072 .0072 .0072 -.0005 -.0005 -.0005 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Magnetite |
|
Bosi F, Halenius U, Skogby H |
| |
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: FeTi10C |
|
_database_code_amcsd 0004816 |
|
8.4067 8.4067 8.4067 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
FeT .125 .125 .125 .00506 .00506 .00506 0 0 0 |
|
FeM .5 .5 .5 .952 .00663 .00663 .00663 .00100 .00100 .00100 |
|
TiM .5 .5 .5 .048 .00663 .00663 .00663 .00100 .00100 .00100 |
|
O .25496 .25496 .25496 .0069 .0069 .0069 -.0008 -.0008 -.0008 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Magnetite |
|
Bosi F, Halenius U, Skogby H |
| |
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: FeTi50B |
|
_database_code_amcsd 0004817 |
|
8.4095 8.4095 8.4095 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
FeT .125 .125 .125 .0059 .0059 .0059 0 0 0 |
|
FeM .5 .5 .5 .951 .00735 .00735 .00735 .00092 .00092 .00092 |
|
TiM .5 .5 .5 .049 .00735 .00735 .00735 .00092 .00092 .00092 |
|
O .25502 .25502 .25502 .0078 .0078 .0078 -.0007 -.0007 -.0007 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Magnetite |
|
Bosi F, Halenius U, Skogby H |
| |
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: FeTi10Ai |
|
_database_code_amcsd 0004818 |
|
8.4145 8.4145 8.4145 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
FeT .125 .125 .125 .0038 .0038 .0038 0 0 0 |
|
FeM .5 .5 .5 .907 .00534 .00534 .00534 .00103 .00103 .00103 |
|
TiM .5 .5 .5 .093 .00534 .00534 .00534 .00103 .00103 .00103 |
|
O .25502 .25502 .25502 .0057 .0057 .0057 -.0006 -.0006 -.0006 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Magnetite |
|
Bosi F, Halenius U, Skogby H |
| |
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: FeTi10Ao |
|
_database_code_amcsd 0004819 |
|
8.4250 8.4250 8.4250 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
FeT .125 .125 .125 .0092 .0092 .0092 0 0 0 |
|
FeM .5 .5 .5 .879 .0107 .0107 .0107 .00092 .00092 .00092 |
|
TiM .5 .5 .5 .121 .0107 .0107 .0107 .00092 .00092 .00092 |
|
O .25535 .25535 .25535 .0115 .0115 .0115 -.0007 -.0007 -.0007 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Magnetite |
|
Bosi F, Halenius U, Skogby H |
| |
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: FeTi20A |
|
_database_code_amcsd 0004820 |
|
8.4348 8.4348 8.4348 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
FeT .125 .125 .125 .0045 .0045 .0045 0 0 0 |
|
FeM .5 .5 .5 .823 .0050 .0050 .0050 .00068 .00068 .00068 |
|
TiM .5 .5 .5 .177 .0050 .0050 .0050 .00068 .00068 .00068 |
|
O .25596 .25596 .25596 .0073 .0073 .0073 -.0006 -.0006 -.0006 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Magnetite |
|
Bosi F, Halenius U, Skogby H |
| |
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: FeTi30A |
|
_database_code_amcsd 0004821 |
|
8.4569 8.4569 8.4569 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
FeT .125 .125 .125 .0059 .0059 .0059 0 0 0 |
|
FeM .5 .5 .5 .769 .00591 .00591 .00591 .00043 .00043 .00043 |
|
TiM .5 .5 .5 .231 .00591 .00591 .00591 .00043 .00043 .00043 |
|
O .25660 .25660 .25660 .0087 .0087 .0087 -.0004 -.0004 -.0004 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Ulvospinel |
|
Bosi F, Halenius U, Skogby H |
| |
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: FeTi50Bd |
|
_database_code_amcsd 0004822 |
|
8.4716 8.4716 8.4716 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
FeT .125 .125 .125 .0076 .0076 .0076 0 0 0 |
|
FeM .5 .5 .5 .6935 .0067 .0067 .0067 -.00003 -.00003 -.00003 |
|
TiM .5 .5 .5 .2925 .0067 .0067 .0067 -.00003 -.00003 -.00003 |
|
AlM .5 .5 .5 .014 .0067 .0067 .0067 -.00003 -.00003 -.00003 |
|
O .25797 .25797 .25797 .0109 .0109 .0109 -.0007 -.0007 -.0007 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Ulvospinel |
|
Bosi F, Halenius U, Skogby H |
| |
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: FeTi50C |
|
_database_code_amcsd 0004823 |
|
8.4875 8.4875 8.4875 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
FeT .125 .125 .125 .0098 .0098 .0098 0 0 0 |
|
FeM .5 .5 .5 .678 .0088 .0088 .0088 -.00011 -.00011 -.00011 |
|
TiM .5 .5 .5 .322 .0088 .0088 .0088 -.00011 -.00011 -.00011 |
|
O .25827 .25827 .25827 .0128 .0128 .0128 -.0006 -.0006 -.0006 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Ulvospinel |
|
Bosi F, Halenius U, Skogby H |
| |
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: FeTi40A |
|
_database_code_amcsd 0004824 |
|
8.4972 8.4972 8.4972 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
FeT .125 .125 .125 .0093 .0093 .0093 0 0 0 |
|
FeM .5 .5 .5 .6435 .0077 .0077 .0077 -.00020 -.00020 -.00020 |
|
TiM .5 .5 .5 .3565 .0077 .0077 .0077 -.00020 -.00020 -.00020 |
|
O .25855 .25855 .25855 .0128 .0128 .0128 -.0011 -.0011 -.0011 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Ulvospinel |
|
Bosi F, Halenius U, Skogby H |
| |
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: FeTi60A |
|
_database_code_amcsd 0004825 |
|
8.4975 8.4975 8.4975 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
FeT .125 .125 .125 .0073 .0073 .0073 0 0 0 |
|
FeM .5 .5 .5 .655 .0058 .0058 .0058 -.00027 -.00027 -.00027 |
|
TiM .5 .5 .5 .345 .0058 .0058 .0058 -.00027 -.00027 -.00027 |
|
O .25917 .25917 .25917 .0108 .0108 .0108 -.0019 -.0019 -.0019 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Ulvospinel |
|
Bosi F, Halenius U, Skogby H |
| |
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: FeTi70A |
|
_database_code_amcsd 0004826 |
|
8.5052 8.5052 8.5052 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
FeT .125 .125 .125 .0130 .0130 .0130 0 0 0 |
|
FeM .5 .5 .5 .624 .0115 .0115 .0115 -.00049 -.00049 -.00049 |
|
TiM .5 .5 .5 .376 .0115 .0115 .0115 -.00049 -.00049 -.00049 |
|
O .25947 .25947 .25947 .0165 .0165 .0165 -.0011 -.0011 -.0011 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Ulvospinel |
|
Bosi F, Halenius U, Skogby H |
| |
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: FeTi80Ac |
|
_database_code_amcsd 0004827 |
|
8.5059 8.5059 8.5059 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
FeT .125 .125 .125 .0075 .0075 .0075 0 0 0 |
|
FeM .5 .5 .5 .6235 .0057 .0057 .0057 -.00025 -.00025 -.00025 |
|
TiM .5 .5 .5 .3755 .0057 .0057 .0057 -.00025 -.00025 -.00025 |
|
O .25924 .25924 .25924 .0111 .0111 .0111 -.0016 -.0016 -.0016 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Ulvospinel |
|
Bosi F, Halenius U, Skogby H |
| |
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: FeTi80Af |
|
_database_code_amcsd 0004828 |
|
8.5079 8.5079 8.5079 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
FeT .125 .125 .125 .0075 .0075 .0075 0 0 0 |
|
FeM .5 .5 .5 .622 .0057 .0057 .0057 -.00022 -.00022 -.00022 |
|
TiM .5 .5 .5 .378 .0057 .0057 .0057 -.00022 -.00022 -.00022 |
|
O .25912 .25912 .25912 .0113 .0113 .0113 -.0019 -.0019 -.0019 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Ulvospinel |
|
Bosi F, Halenius U, Skogby H |
| |
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: FeTib3 |
|
_database_code_amcsd 0004829 |
|
8.5139 8.5139 8.5139 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
FeT .125 .125 .125 .0075 .0075 .0075 0 0 0 |
|
FeM .5 .5 .5 .6 .0054 .0054 .0054 -.00051 -.00051 -.00051 |
|
TiM .5 .5 .5 .4 .0054 .0054 .0054 -.00051 -.00051 -.00051 |
|
O .25980 .25980 .25980 .0113 .0113 .0113 -.0024 -.0024 -.0024 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Ulvospinel |
|
Bosi F, Halenius U, Skogby H |
| |
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: FeTib2 |
|
_database_code_amcsd 0004830 |
|
8.5220 8.5220 8.5220 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
FeT .125 .125 .125 .0073 .0073 .0073 0 0 0 |
|
FeM .5 .5 .5 .5775 .0049 .0049 .0049 -.00058 -.00058 -.00058 |
|
TiM .5 .5 .5 .4225 .0049 .0049 .0049 -.00058 -.00058 -.00058 |
|
O .26025 .26025 .26025 .0110 .0110 .0110 -.0029 -.0029 -.0029 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Ulvospinel |
|
Bosi F, Halenius U, Skogby H |
| |
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: FeTib4 |
|
_database_code_amcsd 0004831 |
|
8.5274 8.5274 8.5274 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
FeT .125 .125 .125 .0117 .0117 .0117 0 0 0 |
|
FeM .5 .5 .5 .546 .0092 .0092 .0092 -.00068 -.00068 -.00068 |
|
TiM .5 .5 .5 .454 .0092 .0092 .0092 -.00068 -.00068 -.00068 |
|
O .26065 .26065 .26065 .0156 .0156 .0156 -.0034 -.0034 -.0034 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Ulvospinel |
|
Bosi F, Halenius U, Skogby H |
| |
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: FeTib1c |
|
_database_code_amcsd 0004832 |
|
8.5307 8.5307 8.5307 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
FeT .125 .125 .125 .0077 .0077 .0077 0 0 0 |
|
FeM .5 .5 .5 .535 .0051 .0051 .0051 -.00068 -.00068 -.00068 |
|
TiM .5 .5 .5 .465 .0051 .0051 .0051 -.00068 -.00068 -.00068 |
|
O .26077 .26077 .26077 .0119 .0119 .0119 -.0038 -.0038 -.0038 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Ulvospinel |
|
Bosi F, Halenius U, Skogby H |
| |
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: FeTib1b |
|
_database_code_amcsd 0004833 |
|
8.5322 8.5322 8.5322 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
FeT .125 .125 .125 .0104 .0104 .0104 0 0 0 |
|
FeM .5 .5 .5 .5275 .0076 .0076 .0076 -.00071 -.00071 -.00071 |
|
TiM .5 .5 .5 .4725 .0076 .0076 .0076 -.00071 -.00071 -.00071 |
|
O .26074 .26074 .26074 .0143 .0143 .0143 -.0035 -.0035 -.0035 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Dravite |
|
Bosi F, Lucchesi S |
| |
European Journal of Mineralogy 16 (2004) 335-344 |
|
Crystal chemistry of the schorl-dravite series |
|
Note: Tourmaline sample TM507c |
|
Locality: Olkhon (Lake Baikal), Siberia |
|
_database_code_amcsd 0007038 |
|
15.9610 15.9610 7.2214 90 90 120 R3m |
|
atom x y z occ |
|
NaX 0 0 .22653 .457 |
|
CaX 0 0 .22653 .246 |
|
KX 0 0 .22653 .012 |
|
MgY .12375 .061875 .63506 .486 |
|
AlY .12375 .061875 .63506 .254 |
|
V3+Y .12375 .061875 .63506 .238 |
|
Cr3+Y .12375 .061875 .63506 .014 |
|
Ti4+Y .12375 .061875 .63506 .008 |
|
AlZ .29797 .26169 .61137 .760 |
|
MgZ .29797 .26169 .61137 .182 |
|
Cr3+Z .29797 .26169 .61137 .043 |
|
V3+Z .29797 .26169 .61137 .015 |
|
SiT .19154 .18973 0 .992 |
|
AlT .19154 .18973 0 .008 |
|
B .10981 .21962 .45339 |
|
OH1W 0 0 .77136 .536 |
|
O1W 0 0 .77136 .383 |
|
F1W 0 0 .77136 .081 |
|
O2 .06071 .12142 .48327 |
|
OH3V .26281 .131405 .51100 |
|
O4 .09277 .18554 .07158 |
|
O5 .18295 .091475 .09182 |
|
O6 .19479 .18510 .77827 |
|
O7 .28476 .28435 .07872 |
|
O8 .20909 .26984 .44037 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Dravite |
|
Bosi F, Lucchesi S |
| |
European Journal of Mineralogy 16 (2004) 335-344 |
|
Crystal chemistry of the schorl-dravite series |
|
Note: Tourmaline TM507e |
|
Locality: Olkhon (Lake Baikal), Siberia |
|
_database_code_amcsd 0007039 |
|
15.9521 15.9521 7.2167 90 90 120 R3m |
|
atom x y z occ |
|
NaX 0 0 .22631 .479 |
|
CaX 0 0 .22631 .335 |
|
KX 0 0 .22631 .010 |
|
MgY .12365 .061825 .63529 .527 |
|
AlY .12365 .061825 .63529 .286 |
|
V3+Y .12365 .061825 .63529 .152 |
|
Cr3+Y .12365 .061825 .63529 .021 |
|
Ti4+Y .12365 .061825 .63529 .013 |
|
Fe2+Y .12365 .061825 .63529 .001 |
|
AlZ .29790 .26163 .61160 .787 |
|
MgZ .29790 .26163 .61160 .189 |
|
Cr3+Z .29790 .26163 .61160 .016 |
|
V3+Z .29790 .26163 .61160 .008 |
|
SiT .1916 .18980 0 .992 |
|
AlT .1916 .18980 0 .008 |
|
B .10971 .21942 .45363 |
|
OH1W 0 0 .77109 .507 |
|
O1W 0 0 .77109 .439 |
|
F1W 0 0 .77109 .054 |
|
O2 .06051 .12102 .48275 |
|
OH3V .26302 .13151 .51130 |
|
O4 .09276 .18552 .07190 |
|
O5 .18264 .09132 .09212 |
|
O6 .19470 .18511 .77832 |
|
O7 .28484 .28432 .07900 |
|
O8 .20901 .26981 .44055 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Dravite |
|
Bosi F, Lucchesi S |
| |
European Journal of Mineralogy 16 (2004) 335-344 |
|
Crystal chemistry of the schorl-dravite series |
|
Note: Tourmaline TM235a |
|
Locality: Beresov Mine, Siberia |
|
_database_code_amcsd 0007040 |
|
15.9433 15.9433 7.2095 90 90 120 R3m |
|
atom x y z occ |
|
NaX 0 0 .23599 .751 |
|
CaX 0 0 .23599 .077 |
|
KX 0 0 .23599 .004 |
|
AlY .12464 .06232 .63334 .410 |
|
MgY .12464 .06232 .63334 .393 |
|
Fe2+Y .12464 .06232 .63334 .163 |
|
Ti4+Y .12464 .06232 .63334 .028 |
|
ZnY .12464 .06232 .63334 .003 |
|
V3+Y .12464 .06232 .63334 .001 |
|
Mn2+Y .12464 .06232 .63334 .001 |
|
Fe3+Y .12464 .06232 .63334 .001 |
|
AlZ .29814 .26164 .61171 .831 |
|
MgZ .29814 .26164 .61171 .151 |
|
Fe3+Z .29814 .26164 .61171 .012 |
|
Fe2+Z .29814 .26164 .61171 .006 |
|
SiT .19180 .18989 0 .998 |
|
AlT .19180 .18989 0 .002 |
|
B .10984 .21968 .45545 |
|
OH1W 0 0 .77311 .632 |
|
O1W 0 0 .77311 .364 |
|
F1W 0 0 .77311 .004 |
|
O2 .06087 .12174 .48727 |
|
OH3V .26410 .13205 .51171 |
|
O4 .09295 .18590 .07048 |
|
O5 .18410 .09205 .09170 |
|
O6 .19557 .18533 .77795 |
|
O7 .28494 .28481 .07922 |
|
O8 .20919 .26992 .44110 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Dravite |
|
Bosi F, Lucchesi S |
| |
European Journal of Mineralogy 16 (2004) 335-344 |
|
Crystal chemistry of the schorl-dravite series |
|
Note: Tourmaline TM235b |
|
Locality: Beresov Mine, Siberia |
|
_database_code_amcsd 0007041 |
|
15.9388 15.9388 7.2050 90 90 120 R3m |
|
atom x y z occ |
|
NaX 0 0 .23498 .724 |
|
CaX 0 0 .23498 .094 |
|
KX 0 0 .23498 .003 |
|
AlY .12457 .062285 .63361 .429 |
|
MgY .12457 .062285 .63361 .384 |
|
Fe2+Y .12457 .062285 .63361 .162 |
|
Ti4+Y .12457 .062285 .63361 .021 |
|
ZnY .12457 .062285 .63361 .004 |
|
V3+Y .12457 .062285 .63361 .001 |
|
Cr3+Y .12457 .062285 .63361 .001 |
|
AlZ .29805 .26158 .61157 .833 |
|
MgZ .29805 .26158 .61157 .152 |
|
Fe3+Z .29805 .26158 .61157 .012 |
|
Fe2+Z .29805 .26158 .61157 .003 |
|
SiT .19177 .18985 0 .997 |
|
AlT .19177 .18985 0 .003 |
|
B .10976 .21952 .45507 |
|
OH1W 0 0 .77293 .572 |
|
O1W 0 0 .77293 .382 |
|
F1W 0 0 .77293 .046 |
|
O2 .06081 .12162 .48753 |
|
OH3V .26373 .131865 .51141 |
|
O4 .09306 .18612 .07048 |
|
O5 .18431 .092155 .09189 |
|
O6 .19546 .18516 .77772 |
|
O7 .28506 .28497 .07892 |
|
O8 .20920 .26991 .44101 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Dravite |
|
Bosi F, Lucchesi S |
| |
European Journal of Mineralogy 16 (2004) 335-344 |
|
Crystal chemistry of the schorl-dravite series |
|
Note: Tourmaline TM112a |
|
Locality: Haddam, Connecticut, U.S.A. |
|
_database_code_amcsd 0007042 |
|
15.9633 15.9633 7.1942 90 90 120 R3m |
|
atom x y z occ |
|
NaX 0 0 .22916 .558 |
|
CaX 0 0 .22916 .257 |
|
KX 0 0 .22916 .002 |
|
MgY .12444 .06222 .63271 .433 |
|
AlY .12444 .06222 .63271 .292 |
|
Fe2+Y .12444 .06222 .63271 .150 |
|
Fe3+Y .12444 .06222 .63271 .094 |
|
Ti4+Y .12444 .06222 .63271 .018 |
|
ZnY .12444 .06222 .63271 .003 |
|
V3+Y .12444 .06222 .63271 .003 |
|
Cr3+Y .12444 .06222 .63271 .003 |
|
Mn2+Y .12444 .06222 .63271 .001 |
|
AlZ .29813 .26169 .61180 .863 |
|
MgZ .29813 .26169 .61180 .119 |
|
Fe3+Z .29813 .26169 .61180 .017 |
|
SiT .19192 .19005 0 .976 |
|
AlT .19192 .19005 0 .024 |
|
B .10987 .21974 .45418 |
|
OH1W 0 0 .77627 .470 |
|
O1W 0 0 .77627 .404 |
|
F1W 0 0 .77627 .126 |
|
O2 .06094 .12188 .48253 |
|
OH3V .26636 .13318 .51132 |
|
O4 .09273 .18546 .07058 |
|
O5 .18376 .09188 .09213 |
|
O6 .19629 .18643 .77720 |
|
O7 .28517 .28494 .08007 |
|
O8 .20950 .27022 .44133 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Dravite |
|
Bosi F, Lucchesi S |
| |
European Journal of Mineralogy 16 (2004) 335-344 |
|
Crystal chemistry of the schorl-dravite series |
|
Note: Tourmaline TM112c |
|
Locality: Haddam, Connecticut, U.S.A. |
|
_database_code_amcsd 0007043 |
|
15.9636 15.9636 7.1911 90 90 120 R3m |
|
atom x y z occ |
|
NaX 0 0 .22873 .559 |
|
CaX 0 0 .22873 .263 |
|
KX 0 0 .22873 .003 |
|
MgY .12446 .06223 .63246 .422 |
|
AlY .12446 .06223 .63246 .310 |
|
Fe2+Y .12446 .06223 .63246 .175 |
|
Fe3+Y .12446 .06223 .63246 .062 |
|
Ti4+Y .12446 .06223 .63246 .020 |
|
Cr3+Y .12446 .06223 .63246 .005 |
|
Mn2+Y .12446 .06223 .63246 .003 |
|
V3+Y .12446 .06223 .63246 .003 |
|
AlZ .29812 .26166 .61182 .858 |
|
MgZ .29812 .26166 .61182 .128 |
|
Fe3+Z .29812 .26166 .61182 .014 |
|
Fe2+Z .29812 .26166 .61182 .001 |
|
SiT .19192 .19007 0 .980 |
|
AlT .19192 .19007 0 .020 |
|
B .10997 .21994 .45436 |
|
O1W 0 0 .77608 .471 |
|
OH1W 0 0 .77608 .469 |
|
F1W 0 0 .77608 .060 |
|
O2 .06085 .12170 .48238 |
|
OH3V .26640 .13320 .51091 |
|
O4 .09281 .18562 .07047 |
|
O5 .18380 .09190 .09190 |
|
O6 .19628 .18640 .77711 |
|
O7 .28513 .28494 .08001 |
|
O8 .20952 .27023 .44110 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Dravite |
|
Bosi F, Lucchesi S |
| |
European Journal of Mineralogy 16 (2004) 335-344 |
|
Crystal chemistry of the schorl-dravite series |
|
Note: Tourmaline TM233g |
|
Locality: Zillerthal, Tyrol, Austria |
|
_database_code_amcsd 0007044 |
|
15.9355 15.9355 7.2002 90 90 120 R3m |
|
atom x y z occ |
|
NaX 0 0 .23279 .714 |
|
CaX 0 0 .23279 .099 |
|
KX 0 0 .23279 .004 |
|
AlY .12397 .061985 .63449 .433 |
|
MgY .12397 .061985 .63449 .409 |
|
Fe2+Y .12397 .061985 .63449 .110 |
|
Fe3+Y .12397 .061985 .63449 .030 |
|
Ti4+Y .12397 .061985 .63449 .013 |
|
ZnY .12397 .061985 .63449 .004 |
|
V3+Y .12397 .061985 .63449 .001 |
|
AlZ .29790 .26155 .61123 .835 |
|
MgZ .29790 .26155 .61123 .154 |
|
Fe3+Z .29790 .26155 .61123 .011 |
|
SiT .19179 .18985 0 .987 |
|
AlT .19179 .18985 0 .013 |
|
B .10974 .21948 .45483 |
|
OH1W 0 0 .77236 .633 |
|
O1W 0 0 .77236 .362 |
|
F1W 0 0 .77236 .004 |
|
O2 .06076 .12152 .48718 |
|
OH3V .26322 .13161 .51086 |
|
O4 .09314 .18628 .07098 |
|
O5 .18401 .092005 .09226 |
|
O6 .19531 .18495 .77724 |
|
O7 .28517 .28492 .07881 |
|
O8 .20924 .26989 .44054 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Olenite |
|
Bosi F, Lucchesi S |
| |
European Journal of Mineralogy 16 (2004) 335-344 |
|
Crystal chemistry of the schorl-dravite series |
|
Note: Tourmaline TM501e |
|
Locality: Kwale, Mombasa, Kenya |
|
_database_code_amcsd 0007045 |
|
15.9267 15.9267 7.1991 90 90 120 R3m |
|
atom x y z occ |
|
NaX 0 0 .22976 .742 |
|
KX 0 0 .22976 .011 |
|
CaX 0 0 .22976 .007 |
|
AlY .12227 .061135 .63639 .435 |
|
MgY .12227 .061135 .63639 .424 |
|
Fe3+Y .12227 .061135 .63639 .126 |
|
Ti4+Y .12227 .061135 .63639 .007 |
|
Fe2+Y .12227 .061135 .63639 .002 |
|
Cr3+Y .12227 .061135 .63639 .002 |
|
ZnY .12227 .061135 .63639 .001 |
|
V3+Y .12227 .061135 .63639 .001 |
|
Mn2+Y .12227 .061135 .63639 .001 |
|
AlZ .29767 .26147 .61019 .818 |
|
MgZ .29767 .26147 .61019 .156 |
|
Fe3+Z .29767 .26147 .61019 .026 |
|
SiT .19155 .18965 0 |
|
B .10986 .21972 .45426 |
|
O1W 0 0 .76981 .573 |
|
OH1W 0 0 .76981 .405 |
|
F1W 0 0 .76981 .021 |
|
O2 .06084 .12168 .48728 |
|
OH3V .26123 .130615 .51004 |
|
O4 .09355 .18710 .07090 |
|
O5 .18439 .092195 .09244 |
|
O6 .19455 .18427 .77713 |
|
O7 .28512 .28478 .07745 |
|
O8 .20924 .27015 .43933 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Olenite |
|
Bosi F, Lucchesi S |
| |
European Journal of Mineralogy 16 (2004) 335-344 |
|
Crystal chemistry of the schorl-dravite series |
|
Note: Tourmaline TM84a |
|
Locality: Cooma, New South Wales, Australia |
|
_database_code_amcsd 0007046 |
|
15.9391 15.9391 7.1515 90 90 120 R3m |
|
atom x y z occ |
|
NaX 0 0 .22517 .451 |
|
CaX 0 0 .22517 .010 |
|
KX 0 0 .22517 .006 |
|
AlY .12367 .061835 .62959 .515 |
|
Fe2+Y .12367 .061835 .62959 .394 |
|
MgY .12367 .061835 .62959 .058 |
|
Mn2+Y .12367 .061835 .62959 .018 |
|
Ti4+Y .12367 .061835 .62959 .009 |
|
ZnY .12367 .061835 .62959 .004 |
|
Fe3+Y .12367 .061835 .62959 .001 |
|
V3+Y .12367 .061835 .62959 .001 |
|
AlZ .29792 .26129 .60957 .898 |
|
MgZ .29792 .26129 .60957 .073 |
|
Fe3+Z .29792 .26129 .60957 .024 |
|
Fe2+Z .29792 .26129 .60957 .006 |
|
SiT .19175 .18972 0 .992 |
|
AlT .19175 .18972 0 .008 |
|
B .11004 .22008 .45435 |
|
O1W 0 0 .77468 .568 |
|
OH1W 0 0 .77468 .395 |
|
F1W 0 0 .77468 .038 |
|
O2 .06154 .12308 .48978 |
|
OH3V .26455 .132275 .50891 |
|
O4 .09383 .18766 .06929 |
|
O5 .18736 .09368 .09217 |
|
O6 .19651 .18590 .77540 |
|
O7 .28545 .28571 .07782 |
|
O8 .20969 .27054 .43935 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Schorl |
|
Bosi F, Lucchesi S |
| |
European Journal of Mineralogy 16 (2004) 335-344 |
|
Crystal chemistry of the schorl-dravite series |
|
Note: TourmalineTM60e |
|
Locality: Bovey Tracy, Devonshire, England |
|
_database_code_amcsd 0007047 |
|
15.9856 15.9856 7.1840 90 90 120 R3m |
|
atom x y z occ |
|
NaX 0 0 .22615 .682 |
|
CaX 0 0 .22615 .093 |
|
KX 0 0 .22615 .009 |
|
Fe2+Y .12432 .06216 .63004 .408 |
|
AlY .12432 .06216 .63004 .310 |
|
MgY .12432 .06216 .63004 .153 |
|
Fe3+Y .12432 .06216 .63004 .090 |
|
Ti4+Y .12432 .06216 .63004 .027 |
|
ZnY .12432 .06216 .63004 .005 |
|
Mn2+Y .12432 .06216 .63004 .004 |
|
AlZ .29837 .26172 .61130 .874 |
|
MgZ .29837 .26172 .61130 .086 |
|
Fe2+Z .29837 .26172 .61130 .039 |
|
Fe3+Z .29837 .26172 .61130 .001 |
|
SiT .19179 .18989 0 .979 |
|
AlT .19179 .18989 0 .021 |
|
B .11016 .22032 .45485 |
|
OH1W 0 0 .77957 .443 |
|
O1W 0 0 .77957 .352 |
|
F1W 0 0 .77957 .205 |
|
O2 .06134 .12268 .48358 |
|
OH3V .26782 .13391 .51073 |
|
O4 .09302 .18604 .06911 |
|
O5 .18550 .09275 .09080 |
|
O6 .19708 .18716 .77670 |
|
O7 .28482 .28505 .07962 |
|
O8 .20962 .27036 .44127 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Dravite |
|
Bosi F, Lucchesi S |
| |
European Journal of Mineralogy 16 (2004) 335-344 |
|
Crystal chemistry of the schorl-dravite series |
|
Note: Tourmaline TM65e |
|
Locality: Arendal, Norway |
|
_database_code_amcsd 0007048 |
|
15.9541 15.9541 7.2035 90 90 120 R3m |
|
atom x y z occ |
|
NaX 0 0 .23291 .677 |
|
CaX 0 0 .23291 .110 |
|
KX 0 0 .23291 .010 |
|
MgY .12369 .061845 .63416 .372 |
|
AlY .12369 .061845 .63416 .367 |
|
Fe2+Y .12369 .061845 .63416 .144 |
|
Fe3+Y .12369 .061845 .63416 .097 |
|
Ti4+Y .12369 .061845 .63416 .014 |
|
ZnY .12369 .061845 .63416 .003 |
|
Mn2+Y .12369 .061845 .63416 .002 |
|
V3+Y .12369 .061845 .63416 .002 |
|
AlZ .29806 .26168 .61130 .828 |
|
MgZ .29806 .26168 .61130 .162 |
|
Fe3+Z .29806 .26168 .61130 .010 |
|
SiT .19179 .18987 0 .993 |
|
AlT .19179 .18987 0 .007 |
|
B .10991 .21982 .45476 |
|
OH1W 0 0 .77320 .618 |
|
O1W 0 0 .77320 .362 |
|
F1W 0 0 .77320 .020 |
|
O2 .06095 .12190 .48548 |
|
OH3V .26414 .13207 .51073 |
|
O4 .09306 .18612 .07029 |
|
O5 .18431 .092155 .09162 |
|
O6 .19575 .18552 .77751 |
|
O7 .28498 .28473 .07904 |
|
O8 .20938 .27009 .44071 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Fluor-dravite |
| |
Bosi F, Lucchesi S |
| |
European Journal of Mineralogy 16 (2004) 335-344 |
|
Crystal chemistry of the schorl-dravite series |
|
Note: Tourmaline TM504c |
|
Locality: Olkhon (Lake Baikal), Siberia |
|
_database_code_amcsd 0007049 |
|
15.9706 15.9706 7.2276 90 90 120 R3m |
|
atom x y z occ |
|
NaX 0 0 .22556 .477 |
|
CaX 0 0 .22556 .412 |
|
KX 0 0 .22556 .015 |
|
MgY .12391 .061955 .63460 .552 |
|
AlY .12391 .061955 .63460 .210 |
|
V3+Y .12391 .061955 .63460 .191 |
|
Cr3+Y .12391 .061955 .63460 .032 |
|
Ti4+Y .12391 .061955 .63460 .009 |
|
ZnY .12391 .061955 .63460 .005 |
|
Fe2+Y .12391 .061955 .63460 .002 |
|
Mn2+Y .12391 .061955 .63460 .001 |
|
AlZ .29797 .26170 .61193 .757 |
|
MgZ .29797 .26170 .61193 .188 |
|
V3+Z .29797 .26170 .61193 .043 |
|
Cr3+Z .29797 .26170 .61193 .012 |
|
SiT .19155 .18983 0 .985 |
|
AlT .19155 .18983 0 .015 |
|
B .10997 .21994 .45295 |
|
O1W 0 0 .77105 .437 |
|
F1W 0 0 .77105 .314 |
|
OH1W 0 0 .77105 .248 |
|
O2 .06065 .12130 .48040 |
|
OH3V .26391 .131955 .51134 |
|
O4 .09247 .18494 .07196 |
|
O5 .18241 .091205 .09172 |
|
O6 .19466 .18554 .77861 |
|
O7 .28469 .28413 .07913 |
|
O8 .20900 .26985 .44107 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Schorl |
|
Bosi F, Lucchesi S |
| |
European Journal of Mineralogy 16 (2004) 335-344 |
|
Crystal chemistry of the schorl-dravite series |
|
Note: Tourmaline TMl2ap |
|
Locality: Cruziero, Minas Gerais, Brazil |
|
_database_code_amcsd 0007050 |
|
15.9659 15.9659 7.1693 90 90 120 R3m |
|
atom x y z occ |
|
NaX 0 0 .2278 .633 |
|
KX 0 0 .2278 .013 |
|
Fe2+Y .12397 .061985 .63021 .500 |
|
AlY .12397 .061985 .63021 .427 |
|
MgY .12397 .061985 .63021 .047 |
|
Ti4+Y .12397 .061985 .63021 .017 |
|
LiY .12397 .061985 .63021 .004 |
|
ZnY .12397 .061985 .63021 .003 |
|
AlZ .29824 .26159 .61062 .884 |
|
MgZ .29824 .26159 .61062 .087 |
|
Fe2+Z .29824 .26159 .61062 .014 |
|
Fe3+Z .29824 .26159 .61062 .014 |
|
SiT .19183 .18984 0 .985 |
|
AlT .19183 .18984 0 .015 |
|
B .11011 .22022 .45451 |
|
OH1W 0 0 .77754 .512 |
|
O1W 0 0 .77754 .311 |
|
F1W 0 0 .77754 .177 |
|
O2 .06144 .12288 .48679 |
|
OH3V .26680 .13340 .50999 |
|
O4 .09336 .18672 .06897 |
|
O5 .18643 .093215 .09130 |
|
O6 .19705 .18667 .77613 |
|
O7 .28512 .28544 .07885 |
|
O8 .20971 .27044 .44066 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Schorl |
|
Bosi F, Lucchesi S |
| |
European Journal of Mineralogy 16 (2004) 335-344 |
|
Crystal chemistry of the schorl-dravite series |
|
Note: Tourmaline TMl2al |
|
Locality: Cruziero, Minas Gerais, Brazil |
|
_database_code_amcsd 0007051 |
|
15.9736 15.9736 7.1644 90 90 120 R3m |
|
atom x y z occ |
|
NaX 0 0 .22668 .678 |
|
KX 0 0 .22668 .013 |
|
Fe2+Y .12423 .062115 .62941 .507 |
|
AlY .12423 .062115 .62941 .418 |
|
MgY .12423 .062115 .62941 .028 |
|
Mn2+Y .12423 .062115 .62941 .016 |
|
ZnY .12423 .062115 .62941 .013 |
|
Ti4+Y .12423 .062115 .62941 .010 |
|
LiY .12423 .062115 .62941 .008 |
|
AlZ .29833 .26162 .61077 .897 |
|
MgZ .29833 .26162 .61077 .069 |
|
Fe2+Z .29833 .26162 .61077 .019 |
|
Fe3+Z .29833 .26162 .61077 .015 |
|
SiT .19193 .18995 0 .973 |
|
AlT .19193 .18995 0 .027 |
|
B .11017 .22034 .45467 |
|
OH1W 0 0 .77878 .538 |
|
O1W 0 0 .77878 .283 |
|
F1W 0 0 .77878 .178 |
|
O2 .06149 .12298 .48599 |
|
OH3V .26753 .133765 .50982 |
|
O4 .09333 .18666 .06922 |
|
O5 .18660 .09330 .09133 |
|
O6 .19735 .18704 .77584 |
|
O7 .28527 .28559 .07921 |
|
O8 .20979 .27061 .44070 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Olenite |
|
Bosi F, Lucchesi S |
| |
European Journal of Mineralogy 16 (2004) 335-344 |
|
Crystal chemistry of the schorl-dravite series |
|
Note: Tourmaline TMl3l |
|
Locality: Cruziero, Minas Gerais, Brazil |
|
_database_code_amcsd 0007052 |
|
15.9669 15.9669 7.1745 90 90 120 R3m |
|
atom x y z occ |
|
NaX 0 0 .22897 .727 |
|
KX 0 0 .22897 .006 |
|
AlY .12422 .06211 .63022 .316 |
|
Fe3+Y .12422 .06211 .63022 .247 |
|
Fe2+Y .12422 .06211 .63022 .242 |
|
MgY .12422 .06211 .63022 .162 |
|
Ti4+Y .12422 .06211 .63022 .016 |
|
Mn2+Y .12422 .06211 .63022 .008 |
|
ZnY .12422 .06211 .63022 .006 |
|
LiY .12422 .06211 .63022 .002 |
|
AlZ .29831 .26168 .61102 .897 |
|
MgZ .29831 .26168 .61102 .070 |
|
Fe2+Z .29831 .26168 .61102 .033 |
|
SiT .19182 .18987 0 .990 |
|
AlT .19182 .18987 0 .010 |
|
B .11007 .22014 .45534 |
|
O1W 0 0 .77774 .793 |
|
F1W 0 0 .77774 .207 |
|
O2 .06133 .12266 .48563 |
|
OH3V .26698 .13349 .51063 |
|
O4 .09320 .18640 .06915 |
|
O5 .18598 .09299 .09163 |
|
O6 .19714 .18675 .77649 |
|
O7 .28507 .28537 .07928 |
|
O8 .20970 .27053 .44096 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Dravite |
|
Bosi F, Lucchesi S |
| |
European Journal of Mineralogy 16 (2004) 335-344 |
|
Crystal chemistry of the schorl-dravite series |
|
Note: Tourmaline TMl4aa |
|
Locality: Cruziero, Minas Gerais, Brazil |
|
_database_code_amcsd 0007053 |
|
15.9664 15.9664 7.1758 90 90 120 R3m |
|
atom x y z occ |
|
NaX 0 0 .22844 .712 |
|
KX 0 0 .22844 .009 |
|
AlY .12399 .061995 .63070 .379 |
|
Fe2+Y .12399 .061995 .63070 .365 |
|
MgY .12399 .061995 .63070 .115 |
|
Fe3+Y .12399 .061995 .63070 .104 |
|
Ti4+Y .12399 .061995 .63070 .017 |
|
Mn2+Y .12399 .061995 .63070 .009 |
|
ZnY .12399 .061995 .63070 .008 |
|
LiY .12399 .061995 .63070 .004 |
|
AlZ .29828 .26164 .61100 .876 |
|
MgZ .29828 .26164 .61100 .089 |
|
Fe3+Z .29828 .26164 .61100 .035 |
|
SiT .19182 .18989 0 .994 |
|
AlT .19182 .18989 0 .006 |
|
B .11022 .22044 .45478 |
|
O1W 0 0 .77812 .703 |
|
F1W 0 0 .77812 .157 |
|
OH1W 0 0 .77812 .140 |
|
O2 .06138 .12276 .48610 |
|
OH3V .26658 .13329 .51046 |
|
O4 .09323 .18646 .06933 |
|
O5 .18610 .09305 .09110 |
|
O6 .19691 .18673 .77645 |
|
O7 .28504 .28535 .07914 |
|
O8 .20966 .27054 .44110 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Dravite |
|
Bosi F, Lucchesi S |
| |
European Journal of Mineralogy 16 (2004) 335-344 |
|
Crystal chemistry of the schorl-dravite series |
|
Note: Tourmaline TM9840c |
|
Locality: Lake Baikal, Siberia |
|
_database_code_amcsd 0007054 |
|
15.9341 15.9341 7.1890 90 90 120 R3m |
|
atom x y z occ |
|
NaX 0 0 .22767 .605 |
|
CaX 0 0 .22767 .151 |
|
KX 0 0 .22767 .010 |
|
MgY .12347 .061735 .63424 .418 |
|
AlY .12347 .061735 .63424 .407 |
|
Fe2+Y .12347 .061735 .63424 .112 |
|
Ti4+Y .12347 .061735 .63424 .043 |
|
V3+Y .12347 .061735 .63424 .008 |
|
ZnY .12347 .061735 .63424 .007 |
|
Mn2+Y .12347 .061735 .63424 .004 |
|
Cr3+Y .12347 .061735 .63424 .001 |
|
AlZ .29782 .26148 .61075 .843 |
|
MgZ .29782 .26148 .61075 .155 |
|
Fe2+Z .29782 .26148 .61075 .002 |
|
SiT .19174 .18985 0 .990 |
|
AlT .19174 .18985 0 .010 |
|
B .10983 .21966 .45398 |
|
OH1W 0 0 .77326 .510 |
|
O1W 0 0 .77326 .420 |
|
F1W 0 0 .77326 .070 |
|
O2 .06082 .12164 .48612 |
|
OH3V .26311 .131555 .51025 |
|
O4 .09327 .18654 .07121 |
|
O5 .18405 .092025 .09253 |
|
O6 .19517 .18510 .77699 |
|
O7 .28522 .28490 .07853 |
|
O8 .20931 .27006 .44004 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Dravite |
|
Bosi F, Lucchesi S |
| |
European Journal of Mineralogy 16 (2004) 335-344 |
|
Crystal chemistry of the schorl-dravite series |
|
Note: Tourmaline TM9840f |
|
Locality: Lake Baikal, Siberia |
|
_database_code_amcsd 0007055 |
|
15.9303 15.9303 7.1951 90 90 120 R3m |
|
atom x y z occ |
|
NaX 0 0 .22666 .594 |
|
CaX 0 0 .22666 .187 |
|
KX 0 0 .22666 .013 |
|
AlY .12321 .061605 .63495 .417 |
|
MgY .12321 .061605 .63495 .408 |
|
Fe2+Y .12321 .061605 .63495 .114 |
|
Ti4+Y .12321 .061605 .63495 .048 |
|
V3+Y .12321 .061605 .63495 .005 |
|
Mn2+Y .12321 .061605 .63495 .004 |
|
ZnY .12321 .061605 .63495 .002 |
|
Cr3+Y .12321 .061605 .63495 .002 |
|
AlZ .29780 .26144 .61059 .832 |
|
MgZ .29780 .26144 .61059 .165 |
|
V3+Z .29780 .26144 .61059 .004 |
|
SiT .19170 .18983 0 .992 |
|
AlT .19170 .18983 0 .008 |
|
B .10982 .21964 .45361 |
|
O1W 0 0 .77225 .504 |
|
OH1W 0 0 .77225 .442 |
|
F1W 0 0 .77225 .054 |
|
O2 .06073 .12146 .48591 |
|
OH3V .26260 .13130 .51039 |
|
O4 .09314 .18628 .07129 |
|
O5 .18396 .09198 .09306 |
|
O6 .19489 .18477 .77720 |
|
O7 .28522 .28486 .07817 |
|
O8 .20929 .27004 .43956 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Schorl |
|
Bosi F, Lucchesi S |
| |
European Journal of Mineralogy 16 (2004) 335-344 |
|
Crystal chemistry of the schorl-dravite series |
|
Note: Tourmaline TM9914b |
|
Locality: Lake Baikal, Siberia |
|
_database_code_amcsd 0007056 |
|
15.9821 15.9821 7.2215 90 90 120 R3m |
|
atom x y z occ |
|
NaX 0 0 .23234 .731 |
|
CaX 0 0 .23234 .163 |
|
KX 0 0 .23234 .005 |
|
Fe2+Y .12401 .062005 .63406 .286 |
|
AlY .12401 .062005 .63406 .277 |
|
MgY .12401 .062005 .63406 .240 |
|
Fe3+Y .12401 .062005 .63406 .146 |
|
Ti4+Y .12401 .062005 .63406 .030 |
|
V3+Y .12401 .062005 .63406 .015 |
|
ZnY .12401 .062005 .63406 .003 |
|
Cr3+Y .12401 .062005 .63406 .001 |
|
Mn2+Y .12401 .062005 .63406 .001 |
|
AlZ .29844 .26187 .61212 .814 |
|
MgZ .29844 .26187 .61212 .168 |
|
Fe3+Z .29844 .26187 .61212 .018 |
|
SiT .19178 .18992 0 .985 |
|
AlT .19178 .18992 0 .015 |
|
B .11016 .22032 .45471 |
|
OH1W 0 0 .77623 .509 |
|
O1W 0 0 .77623 .449 |
|
F1W 0 0 .77623 .042 |
|
O2 .06099 .12198 .48286 |
|
OH3V .26648 .13324 .51198 |
|
O4 .09266 .18532 .06979 |
|
O5 .18376 .09188 .09075 |
|
O6 .19641 .18664 .77815 |
|
O7 .28456 .28446 .08000 |
|
O8 .20933 .27003 .44199 |
|
|
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|
| |
|
Chromium-dravite |
| |
Bosi F, Lucchesi S, Reznitskii L |
| |
European Journal of Mineralogy 16 (2004) 345-352 |
|
Crystal chemistry of the dravite-chromdravite series |
|
Note: Tourmaline TMt3b |
|
Locality: Sludyanka crystalline complex, Lake Baikal, Russia |
|
_database_code_amcsd 0007057 |
|
16.0539 16.0539 7.3247 90 90 120 R3m |
|
atom x y z occ Uiso |
|
NaX 0 0 .2255 .880 .0171 |
|
CaX 0 0 .2255 .073 .0171 |
|
KX 0 0 .2255 .017 .0171 |
|
CrY .12335 .061675 .63774 .711 .00408 |
|
MgY .12335 .061675 .63774 .146 .00408 |
|
V3+Y .12335 .061675 .63774 .118 .00408 |
|
Fe2+Y .12335 .061675 .63774 .017 .00408 |
|
ZnY .12335 .061675 .63774 .007 .00408 |
|
Ti4+Y .12335 .061675 .63774 .001 .00408 |
|
CrZ .29779 .26179 .60896 .369 .0045 |
|
AlZ .29779 .26179 .60896 .331 .0045 |
|
MgZ .29779 .26179 .60896 .301 .0045 |
|
SiT .19001 .18832 0 .981 .0041 |
|
AlT .19001 .18832 0 .019 .0041 |
|
B .10977 .21954 .4543 .0045 |
|
O1W 0 0 .7652 .609 .0054 |
|
F1W 0 0 .7652 .381 .0054 |
|
OH1W 0 0 .7652 .009 .0054 |
|
O2 .06021 .12042 .4891 .0059 |
|
O3V .2564 .1282 .5098 .0088 |
|
O4 .09250 .18500 .0717 .0090 |
|
O5 .1824 .0912 .0913 .0086 |
|
O6 .19138 .18214 .7802 .0063 |
|
O7 .28320 .28263 .0737 .0081 |
|
O8 .20739 .26778 .4377 .0093 |
|
H3V .259 .1295 .39 .14 |
|
|
| Download AMC data (View Text File)
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|
| |
|
Chromium-dravite |
| |
Bosi F, Lucchesi S, Reznitskii L |
| |
European Journal of Mineralogy 16 (2004) 345-352 |
|
Crystal chemistry of the dravite-chromdravite series |
|
Note: Tourmaline TMt6b |
|
Locality: Sludyanka crystalline complex, Lake Baikal, Russia |
|
_database_code_amcsd 0007058 |
|
16.0377 16.0377 7.3157 90 90 120 R3m |
|
atom x y z occ Uiso |
|
NaX 0 0 .2254 .892 .0183 |
|
CaX 0 0 .2254 .068 .0183 |
|
KX 0 0 .2254 .017 .0183 |
|
CrY .12339 .061695 .63757 .743 .0045 |
|
MgY .12339 .061695 .63757 .154 .0045 |
|
V3+Y .12339 .061695 .63757 .081 .0045 |
|
Fe2+Y .12339 .061695 .63757 .012 .0045 |
|
Ti4+Y .12339 .061695 .63757 .010 .0045 |
|
AlZ .29781 .26188 .60891 .390 .0052 |
|
MgZ .29781 .26188 .60891 .310 .0052 |
|
CrZ .29781 .26188 .60891 .300 .0052 |
|
SiT .19013 .18840 0 .996 .0046 |
|
AlT .19013 .18840 0 .004 .0046 |
|
B .10992 .21984 .4541 .0048 |
|
O1W 0 0 .7651 .668 .0067 |
|
F1W 0 0 .7651 .332 .0067 |
|
O2 .06024 .12048 .4893 .0064 |
|
O3V .2565 .12825 .5102 .0097 |
|
O4 .09262 .18524 .0720 .0100 |
|
O5 .1826 .0913 .0913 .0089 |
|
O6 .19144 .18221 .7803 .0074 |
|
O7 .28310 .28278 .0734 .0091 |
|
O8 .20752 .26819 .4382 .0104 |
|
H3V .237 .1185 .36 .994 .14 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Chromium-dravite |
| |
Bosi F, Lucchesi S, Reznitskii L |
| |
European Journal of Mineralogy 16 (2004) 345-352 |
|
Crystal chemistry of the dravite-chromdravite series |
|
Note: Tourmaline TMt3c |
|
Locality: Sludyanka crystalline complex, Lake Baikal, Russia |
|
_database_code_amcsd 0007059 |
|
16.0299 16.0299 7.3056 90 90 120 R3m |
|
atom x y z occ Uiso |
|
NaX 0 0 .2237 .842 .0186 |
|
CaX 0 0 .2237 .043 .0186 |
|
KX 0 0 .2237 .027 .0186 |
|
CrY .12337 .061675 .63710 .580 .0045 |
|
V3+Y .12337 .061675 .63710 .261 .0045 |
|
MgY .12337 .061675 .63710 .121 .0045 |
|
AlY .12337 .061675 .63710 .028 .0045 |
|
Fe2+Y .12337 .061675 .63710 .007 .0045 |
|
ZnY .12337 .061675 .63710 .003 .0045 |
|
Ti4+Y .12337 .061675 .63710 .001 .0045 |
|
AlZ .29791 .26194 .60892 .440 .0055 |
|
MgZ .29791 .26194 .60892 .287 .0055 |
|
CrZ .29791 .26194 .60892 .272 .0055 |
|
Fe2+Z .29791 .26194 .60892 .001 .0055 |
|
SiT .19027 .18858 0 .978 .0040 |
|
AlT .19027 .18858 0 .022 .0040 |
|
B .1100 .2200 .4543 .0054 |
|
O1W 0 0 .7654 .639 .0062 |
|
F1W 0 0 .7654 .361 .0062 |
|
O2 .06041 .12082 .4887 .0068 |
|
OH3V .2570 .1285 .5097 .979 .0100 |
|
O3V .2570 .1285 .5097 .021 .0100 |
|
O4 .09276 .18552 .0718 .0098 |
|
O5 .1829 .09145 .0918 .0088 |
|
O6 .19186 .18238 .7793 .0073 |
|
O7 .28339 .28328 .0737 .0087 |
|
O8 .20787 .26860 .4380 .0103 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Chromium-dravite |
| |
Bosi F, Lucchesi S, Reznitskii L |
| |
European Journal of Mineralogy 16 (2004) 345-352 |
|
Crystal chemistry of the dravite-chromdravite series |
|
Note: Tourmaline TMpr79f |
|
Locality: Sludyanka crystalline complex, Lake Baikal, Russia |
|
_database_code_amcsd 0007060 |
|
16.0204 16.0204 7.2985 90 90 120 R3m |
|
atom x y z occ Uiso |
|
NaX 0 0 .2251 .829 .0179 |
|
CaX 0 0 .2251 .097 .0179 |
|
KX 0 0 .2251 .014 .0179 |
|
CrY .12337 .061675 .63729 .766 .0044 |
|
MgY .12337 .061675 .63729 .158 .0044 |
|
V3+Y .12337 .061675 .63729 .049 .0044 |
|
Fe2+Y .12337 .061675 .63729 .014 .0044 |
|
Ti4+Y .12337 .061675 .63729 .010 .0044 |
|
ZnY .12337 .061675 .63729 .004 .0044 |
|
AlZ .29783 .26189 .60889 .444 .0053 |
|
MgZ .29783 .26189 .60889 .289 .0053 |
|
CrZ .29783 .26189 .60889 .267 .0053 |
|
SiT .19032 .18856 0 .997 .0043 |
|
AlT .19032 .18856 0 .003 .0043 |
|
B .10995 .21990 .4542 .0049 |
|
O1W 0 0 .7653 .607 .0060 |
|
F1W 0 0 .7653 .393 .0060 |
|
O2 .06030 .12060 .4882 .0064 |
|
O3V .2569 .12845 .5098 .0092 |
|
O4 .09258 .18516 .0717 .0092 |
|
O5 .1827 .09135 .0916 .0086 |
|
O6 .19182 .18237 .7796 .0068 |
|
O7 .28347 .28306 .0737 .0086 |
|
O8 .20776 .26828 .4383 .0098 |
|
H3V .248 .124 .382 .940 .07 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Chromium-dravite |
| |
Bosi F, Lucchesi S, Reznitskii L |
| |
European Journal of Mineralogy 16 (2004) 345-352 |
|
Crystal chemistry of the dravite-chromdravite series |
|
Note: Tourmaline TM1p43e |
|
Locality: Sludyanka crystalline complex, Lake Baikal, Russia |
|
_database_code_amcsd 0007061 |
|
15.9911 15.9911 7.2764 90 90 120 R3m |
|
atom x y z occ Uiso |
|
NaX 0 0 .2245 .888 .0180 |
|
CaX 0 0 .2245 .028 .0180 |
|
KX 0 0 .2245 .022 .0180 |
|
CrY .12349 .061745 .63680 .726 .0045 |
|
MgY .12349 .061745 .63680 .217 .0045 |
|
AlY .12349 .061745 .63680 .032 .0045 |
|
V3+Y .12349 .061745 .63680 .019 .0045 |
|
ZnY .12349 .061745 .63680 .005 .0045 |
|
Ti4+Y .12349 .061745 .63680 .001 .0045 |
|
AlZ .29794 .26194 .60929 .541 .0054 |
|
MgZ .29794 .26194 .60929 .253 .0054 |
|
CrZ .29794 .26194 .60929 .162 .0054 |
|
V3+Z .29794 .26194 .60929 .037 .0054 |
|
Fe2+Z .29794 .26194 .60929 .006 .0054 |
|
SiT .19050 .18872 0 .998 .0044 |
|
AlT .19050 .18872 0 .002 .0044 |
|
B .11011 .22022 .4541 .0047 |
|
O1W 0 0 .7653 .707 .0064 |
|
F1W 0 0 .7653 .259 .0064 |
|
OH1W 0 0 .7653 .034 .0064 |
|
O2 .06044 .12088 .4883 .0067 |
|
O3V .2577 .12885 .5099 .0100 |
|
O4 .09270 .18540 .0716 .0098 |
|
O5 .1832 .0916 .0916 .0087 |
|
O6 .19234 .18293 .7791 .0070 |
|
O7 .28368 .28345 .0744 .0089 |
|
O8 .20809 .26881 .4384 .0101 |
|
H3V .252 .126 .38 .15 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Magnesiochromite |
|
Lavina B, Reznitskii L Z, Bosi F |
| |
Physics and Chemistry of Minerals 30 (2003) 599-605 |
|
Crystal chemistry of some Mg, Cr, V normal spinels from Sludyanka (Lake Baikal, Russia): |
|
the influence of V3+ on structural stability |
|
Sample: VRL2a |
|
Locality: Sludyanka, Lake Baikal, Russia |
|
_database_code_amcsd 0008848 |
|
8.3367 8.3367 8.3367 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
Mg .125 .125 .125 .990 .0048 |
|
Fe2+ .125 .125 .125 .005 .0048 |
|
Zn .125 .125 .125 .007 .0048 |
|
Al .5 .5 .5 .027 .0036 |
|
V .5 .5 .5 .071 .0036 |
|
Cr .5 .5 .5 .902 .0036 |
|
O .2611 .2611 .2611 .0049 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Magnesiochromite |
|
Lavina B, Reznitskii L Z, Bosi F |
| |
Physics and Chemistry of Minerals 30 (2003) 599-605 |
|
Crystal chemistry of some Mg, Cr, V normal spinels from Sludyanka (Lake Baikal, Russia): |
|
the influence of V3+ on structural stability |
|
Sample: VRL2d |
|
Locality: Sludyanka, Lake Baikal, Russia |
|
_database_code_amcsd 0008849 |
|
8.3431 8.3431 8.3431 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
Mg .125 .125 .125 .0059 |
|
Fe2+ .125 .125 .125 .003 .0059 |
|
Mn2+ .125 .125 .125 .002 .0059 |
|
Zn .125 .125 .125 .008 .0059 |
|
Al .5 .5 .5 .039 .0047 |
|
V .5 .5 .5 .075 .0047 |
|
Cr .5 .5 .5 .854 .0047 |
|
O .26123 .26123 .26123 .0054 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Magnesiochromite |
|
Lavina B, Reznitskii L Z, Bosi F |
| |
Physics and Chemistry of Minerals 30 (2003) 599-605 |
|
Crystal chemistry of some Mg, Cr, V normal spinels from Sludyanka (Lake Baikal, Russia): |
|
the influence of V3+ on structural stability |
|
Sample: VRL2c |
|
Locality: Sludyanka, Lake Baikal, Russia |
|
_database_code_amcsd 0008850 |
|
8.3334 8.3334 8.3334 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
Mg .125 .125 .125 .99 .0051 |
|
Fe2+ .125 .125 .125 .002 .0051 |
|
Zn .125 .125 .125 .006 .0051 |
|
Al .5 .5 .5 .032 .0051 |
|
V .5 .5 .5 .095 .0051 |
|
Cr .5 .5 .5 .875 .0051 |
|
O .2614 .2614 .2614 .0052 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Magnesiochromite |
|
Lavina B, Reznitskii L Z, Bosi F |
| |
Physics and Chemistry of Minerals 30 (2003) 599-605 |
|
Crystal chemistry of some Mg, Cr, V normal spinels from Sludyanka (Lake Baikal, Russia): |
|
the influence of V3+ on structural stability |
|
Sample: VRL2b |
|
Locality: Sludyanka, Lake Baikal, Russia |
|
_database_code_amcsd 0008851 |
|
8.3369 8.3369 8.3369 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
Mg .125 .125 .125 .97 .0081 |
|
Fe2+ .125 .125 .125 .003 .0081 |
|
Mn2+ .125 .125 .125 .002 .0081 |
|
Zn .125 .125 .125 .005 .0081 |
|
Al .5 .5 .5 .039 .0074 |
|
V .5 .5 .5 .13 .0074 |
|
Cr .5 .5 .5 .835 .0074 |
|
O .2613 .2613 .2613 .0086 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Magnesiochromite |
|
Lavina B, Reznitskii L Z, Bosi F |
| |
Physics and Chemistry of Minerals 30 (2003) 599-605 |
|
Crystal chemistry of some Mg, Cr, V normal spinels from Sludyanka (Lake Baikal, Russia): |
|
the influence of V3+ on structural stability |
|
Sample: VRL1r |
|
Locality: Sludyanka, Lake Baikal, Russia |
|
_database_code_amcsd 0008852 |
|
8.3584 8.3584 8.3584 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
Mg .125 .125 .125 .99 .0058 |
|
Fe2+ .125 .125 .125 .009 .0058 |
|
Mn2+ .125 .125 .125 .003 .0058 |
|
Zn .125 .125 .125 .005 .0058 |
|
Al .5 .5 .5 .014 .0046 |
|
V .5 .5 .5 .256 .0046 |
|
Cr .5 .5 .5 .73 .0046 |
|
O .26091 .26091 .26091 .0060 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Magnesiochromite |
|
Lavina B, Reznitskii L Z, Bosi F |
| |
Physics and Chemistry of Minerals 30 (2003) 599-605 |
|
Crystal chemistry of some Mg, Cr, V normal spinels from Sludyanka (Lake Baikal, Russia): |
|
the influence of V3+ on structural stability |
|
Sample: VRL1p |
|
Locality: Sludyanka, Lake Baikal, Russia |
|
_database_code_amcsd 0008853 |
|
8.3479 8.3479 8.3479 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
Mg .125 .125 .125 .979 .0060 |
|
Fe2+ .125 .125 .125 .018 .0060 |
|
Mn2+ .125 .125 .125 .004 .0060 |
|
Zn .125 .125 .125 .005 .0060 |
|
Al .5 .5 .5 .045 .0047 |
|
V .5 .5 .5 .262 .0047 |
|
Cr .5 .5 .5 .69 .0047 |
|
O .26117 .26117 .26117 .00618 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Magnesiochromite |
|
Lavina B, Reznitskii L Z, Bosi F |
| |
Physics and Chemistry of Minerals 30 (2003) 599-605 |
|
Crystal chemistry of some Mg, Cr, V normal spinels from Sludyanka (Lake Baikal, Russia): |
|
the influence of V3+ on structural stability |
|
Sample: VRL1a |
|
Locality: Sludyanka, Lake Baikal, Russia |
|
_database_code_amcsd 0008854 |
|
8.3613 8.3613 8.3613 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
Mg .125 .125 .125 .99 .0048 |
|
Fe2+ .125 .125 .125 .010 .0048 |
|
Mn2+ .125 .125 .125 .003 .0048 |
|
Zn .125 .125 .125 .005 .0048 |
|
Al .5 .5 .5 .043 .0038 |
|
V .5 .5 .5 .275 .0038 |
|
Cr .5 .5 .5 .68 .0038 |
|
O .26092 .26092 .26092 .0052 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Magnesiochromite |
|
Lavina B, Reznitskii L Z, Bosi F |
| |
Physics and Chemistry of Minerals 30 (2003) 599-605 |
|
Crystal chemistry of some Mg, Cr, V normal spinels from Sludyanka (Lake Baikal, Russia): |
|
the influence of V3+ on structural stability |
|
Sample: VRL1b |
|
Locality: Sludyanka, Lake Baikal, Russia |
|
_database_code_amcsd 0008855 |
|
8.3511 8.3511 8.3511 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
Mg .125 .125 .125 .987 .0042 |
|
Fe2+ .125 .125 .125 .010 .0042 |
|
Mn2+ .125 .125 .125 .003 .0042 |
|
Zn .125 .125 .125 .005 .0042 |
|
Al .5 .5 .5 .045 .0031 |
|
V .5 .5 .5 .276 .0031 |
|
Cr .5 .5 .5 .68 .0031 |
|
O .26105 .26105 .26105 .0044 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Magnesiochromite |
|
Lavina B, Reznitskii L Z, Bosi F |
| |
Physics and Chemistry of Minerals 30 (2003) 599-605 |
|
Crystal chemistry of some Mg, Cr, V normal spinels from Sludyanka (Lake Baikal, Russia): |
|
the influence of V3+ on structural stability |
|
Sample: VRL3a |
|
Locality: Sludyanka, Lake Baikal, Russia |
|
_database_code_amcsd 0008856 |
|
8.3664 8.3664 8.3664 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z occ Uiso |
|
Mg .125 .125 .125 .99 .0054 |
|
Fe2+ .125 .125 .125 .005 .0054 |
|
Mn2+ .125 .125 .125 .002 .0054 |
|
Zn .125 .125 .125 .008 .0054 |
|
Al .5 .5 .5 .010 .0043 |
|
V .5 .5 .5 .29 .0043 |
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Cr .5 .5 .5 .70 .0043 |
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O .26089 .26089 .26089 .0055 |
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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
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Multiple datasets can be concatenated into a single downloadable file by
selecting the datasets and then hitting the "Download Selected Data" button.
