|
Staurolite |
 |
Comodi P, Montagnoli M, Zanazzi P F, Ballaran T B |
 |
American Mineralogist 87 (2002) 1164-1171 |
|
Isothermal compression of staurolite: A single-crystal study |
|
Sample: room pressure |
|
_database_code_amcsd 0002884 |
|
7.886 16.659 5.671 90 90 90 Ccmm |
|
atom x y z occ Uiso |
|
SiT1 .13406 .1660 .25 .94 .0072 |
|
AlT1 .13406 .1660 .25 .06 .0072 |
|
FeT2 .3925 0 .25 .84 .0173 |
|
LiT2 .3925 0 .25 .03 .0173 |
|
ZnT2 .3925 0 .25 .01 .0173 |
|
MnT2 .3925 0 .25 .01 .0173 |
|
AlM1 .5 .1752 0 .97 .0077 |
|
FeM1 .5 .1752 0 .01 .0077 |
|
MgM1 .5 .1752 0 .02 .0077 |
|
AlM2 .2633 .4105 .25 .97 .0086 |
|
FeM2 .2633 .4105 .25 .01 .0086 |
|
MgM2 .2633 .4105 .25 .02 .0086 |
|
AlM3 0 0 0 .87 .008 |
|
MgM3 0 0 0 .13 .008 |
|
FeM4 .5 0 0 .84 .02 |
|
ZnM4 .5 0 0 .01 .02 |
|
LiM4 .5 0 0 .03 .02 |
|
MnM4 .5 0 0 .01 .02 |
|
O1 .2349 0 .9658 .0105 |
|
O2 .2550 .1613 .0153 .0084 |
|
O3 .0016 .0891 .25 .0107 |
|
O4 .0213 .2492 .25 .0086 |
|
O5 .5268 .1001 .25 .0083 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Staurolite |
|
Comodi P, Montagnoli M, Zanazzi P F, Ballaran T B |
|
American Mineralogist 87 (2002) 1164-1171 |
|
Isothermal compression of staurolite: A single-crystal study |
|
Sample: P = 2.48 GPa |
|
_database_code_amcsd 0002885 |
|
7.848 16.580 5.641 90 90 90 Ccmm |
|
atom x y z occ Uiso |
|
SiT1 .1333 .1665 .25 .94 .0061 |
|
AlT1 .1333 .1665 .25 .06 .0061 |
|
FeT2 .3927 0 .25 .84 .021 |
|
LiT2 .3927 0 .25 .03 .021 |
|
ZnT2 .3927 0 .25 .01 .021 |
|
MnT2 .3927 0 .25 .01 .021 |
|
AlM1 .5 .1755 0 .97 .0047 |
|
FeM1 .5 .1755 0 .01 .0047 |
|
MgM1 .5 .1755 0 .02 .0047 |
|
AlM2 .2636 .4099 .25 .97 .007 |
|
FeM2 .2636 .4099 .25 .01 .007 |
|
MgM2 .2636 .4099 .25 .02 .007 |
|
AlM3 0 0 0 .87 .008 |
|
MgM3 0 0 0 .13 .008 |
|
FeM4 .5 0 0 .84 .001 |
|
ZnM4 .5 0 0 .01 .001 |
|
LiM4 .5 0 0 .03 .001 |
|
MnM4 .5 0 0 .01 .001 |
|
O1 .2342 0 .966 .009 |
|
O2 .2544 .1623 .015 .005 |
|
O3 .0021 .0892 .25 .005 |
|
O4 .0219 .2489 .25 .004 |
|
O5 .5263 .1010 .25 .006 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Staurolite |
|
Comodi P, Montagnoli M, Zanazzi P F, Ballaran T B |
|
American Mineralogist 87 (2002) 1164-1171 |
|
Isothermal compression of staurolite: A single-crystal study |
|
Sample: P = 4.15 GPa |
|
_database_code_amcsd 0002886 |
|
7.820 16.510 5.626 90 90 90 Ccmm |
|
atom x y z occ Uiso |
|
SiT1 .1339 .1661 .25 .94 .0071 |
|
AlT1 .1339 .1661 .25 .06 .0071 |
|
FeT2 .3925 0 .25 .84 .021 |
|
LiT2 .3925 0 .25 .03 .021 |
|
ZnT2 .3925 0 .25 .01 .021 |
|
MnT2 .3925 0 .25 .01 .021 |
|
AlM1 .5 .1757 0 .97 .006 |
|
FeM1 .5 .1757 0 .01 .006 |
|
MgM1 .5 .1757 0 .02 .006 |
|
AlM2 .2636 .4100 .25 .97 .010 |
|
FeM2 .2636 .4100 .25 .01 .010 |
|
MgM2 .2636 .4100 .25 .02 .010 |
|
AlM3 0 0 0 .87 .005 |
|
MgM3 0 0 0 .13 .005 |
|
FeM4 .5 0 0 .84 .005 |
|
ZnM4 .5 0 0 .01 .005 |
|
LiM4 .5 0 0 .03 .005 |
|
MnM4 .5 0 0 .01 .005 |
|
O1 .235 0 .968 .012 |
|
O2 .2540 .1603 .0147 .010 |
|
O3 .002 .0889 .25 .009 |
|
O4 .022 .2493 .25 .009 |
|
O5 .5276 .1006 .25 .008 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Staurolite |
|
Comodi P, Montagnoli M, Zanazzi P F, Ballaran T B |
|
American Mineralogist 87 (2002) 1164-1171 |
|
Isothermal compression of staurolite: A single-crystal study |
|
Sample: P = 5.43 GPa |
|
_database_code_amcsd 0002887 |
|
7.814 16.480 5.617 90 90 90 Ccmm |
|
atom x y z occ Uiso |
|
SiT1 .1342 .1667 .25 .94 .006 |
|
AlT1 .1342 .1667 .25 .06 .006 |
|
FeT2 .3926 0 .25 .84 .016 |
|
LiT2 .3926 0 .25 .03 .016 |
|
ZnT2 .3926 0 .25 .01 .016 |
|
MnT2 .3926 0 .25 .01 .016 |
|
AlM1 .5 .1757 0 .97 .008 |
|
FeM1 .5 .1757 0 .01 .008 |
|
MgM1 .5 .1757 0 .02 .008 |
|
AlM2 .2631 .4103 .25 .97 .009 |
|
FeM2 .2631 .4103 .25 .01 .009 |
|
MgM2 .2631 .4103 .25 .02 .009 |
|
AlM3 0 0 0 .87 .009 |
|
MgM3 0 0 0 .13 .009 |
|
FeM4 .5 0 0 .84 .06 |
|
ZnM4 .5 0 0 .01 .06 |
|
LiM4 .5 0 0 .03 .06 |
|
MnM4 .5 0 0 .01 .06 |
|
O1 .235 0 .968 .009 |
|
O2 .2558 .1630 .014 .003 |
|
O3 .001 .087 .25 .003 |
|
O4 .018 .247 .25 .007 |
|
O5 .527 .100 .25 .006 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Staurolite |
|
Comodi P, Montagnoli M, Zanazzi P F, Ballaran T B |
|
American Mineralogist 87 (2002) 1164-1171 |
|
Isothermal compression of staurolite: A single-crystal study |
|
Sample: P = 6.84 GPa |
|
_database_code_amcsd 0002888 |
|
7.792 16.465 5.599 90 90 90 Ccmm |
|
atom x y z occ Uiso |
|
SiT1 .1335 .1668 .25 .94 .0046 |
|
AlT1 .1335 .1668 .25 .06 .0046 |
|
FeT2 .3935 0 .25 .84 .016 |
|
LiT2 .3935 0 .25 .03 .016 |
|
ZnT2 .3935 0 .25 .01 .016 |
|
MnT2 .3935 0 .25 .01 .016 |
|
AlM1 .5 .1760 0 .97 .008 |
|
FeM1 .5 .1760 0 .01 .008 |
|
MgM1 .5 .1760 0 .02 .008 |
|
AlM2 .2638 .4105 .25 .97 .009 |
|
FeM2 .2638 .4105 .25 .01 .009 |
|
MgM2 .2638 .4105 .25 .02 .009 |
|
AlM3 0 0 0 .87 .009 |
|
MgM3 0 0 0 .13 .009 |
|
FeM4 .5 0 0 .84 .04 |
|
ZnM4 .5 0 0 .01 .04 |
|
LiM4 .5 0 0 .03 .04 |
|
MnM4 .5 0 0 .01 .04 |
|
O1 .236 0 .969 .011 |
|
O2 .2552 .1629 .014 .003 |
|
O3 .0018 .087 .25 .003 |
|
O4 .016 .246 .25 .005 |
|
O5 .526 .099 .25 .004 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Staurolite |
|
Comodi P, Montagnoli M, Zanazzi P F, Ballaran T B |
|
American Mineralogist 87 (2002) 1164-1171 |
|
Isothermal compression of staurolite: A single-crystal study |
|
Sample: P = 8.74 GPa |
|
_database_code_amcsd 0002889 |
|
7.779 16.416 5.586 90 90 90 Ccmm |
|
atom x y z occ Uiso |
|
SiT1 .1336 .1665 .25 .94 .0069 |
|
AlT1 .1336 .1665 .25 .06 .0069 |
|
FeT2 .3935 0 .25 .84 .018 |
|
LiT2 .3935 0 .25 .03 .018 |
|
ZnT2 .3935 0 .25 .01 .018 |
|
MnT2 .3935 0 .25 .01 .018 |
|
AlM1 .5 .1752 0 .97 .009 |
|
FeM1 .5 .1752 0 .01 .009 |
|
MgM1 .5 .1752 0 .02 .009 |
|
AlM2 .2637 .4098 .25 .97 .0089 |
|
FeM2 .2637 .4098 .25 .01 .0089 |
|
MgM2 .2637 .4098 .25 .02 .0089 |
|
AlM3 0 0 0 .87 .006 |
|
MgM3 0 0 0 .13 .006 |
|
FeM4 .5 0 0 .84 .001 |
|
ZnM4 .5 0 0 .01 .001 |
|
LiM4 .5 0 0 .03 .001 |
|
MnM4 .5 0 0 .01 .001 |
|
O1 .238 0 .970 .009 |
|
O2 .2546 .1614 .0137 .007 |
|
O3 .0019 .0870 .25 .003 |
|
O4 .017 .2472 .25 .009 |
|
O5 .5237 .098 .25 .007 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Phlogopite |
|
Comodi P, Fumagalli P, Montagnoli M, Zanazzi P F |
|
American Mineralogist 89 (2004) 647-653 |
|
A single-crystal study on the pressure behavior of phlogopite |
|
and petrological implications |
|
P = 0.0001 GPa |
|
_database_code_amcsd 0003534 |
|
5.337 9.240 10.237 90 100.02 90 C2/m |
|
atom x y z occ Uiso |
|
K 0 0 0 .91 .030 |
|
Ba 0 0 0 .03 .030 |
|
Na 0 0 0 .02 .030 |
|
SiT .5743 .1671 .225 .68 .0068 |
|
AlT .5743 .1671 .225 .32 .0068 |
|
MgM1 0 1/2 1/2 .72 .0068 |
|
FeM1 0 1/2 1/2 .28 .0068 |
|
MgM2 0 .8352 1/2 .73 .0045 |
|
FeM2 0 .8352 1/2 .27 .0045 |
|
O1 .831 .2264 .169 .021 |
|
O2 .507 0 .167 .023 |
|
O3 .631 .1674 .393 .004 |
|
O4 .129 0 .389 .05 .009 |
|
F4 .129 0 .389 .09 .009 |
|
OH4 .129 0 .389 .86 .009 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Phlogopite |
|
Comodi P, Fumagalli P, Montagnoli M, Zanazzi P F |
|
American Mineralogist 89 (2004) 647-653 |
|
A single-crystal study on the pressure behavior of phlogopite |
|
and petrological implications |
|
P = 1.2 GPa |
|
_database_code_amcsd 0003535 |
|
5.318 9.210 10.10 90 100.12 90 C2/m |
|
atom x y z occ Uiso |
|
K 0 0 0 .91 .024 |
|
Ba 0 0 0 .03 .024 |
|
Na 0 0 0 .02 .024 |
|
SiT .5747 .1668 .223 .68 .0130 |
|
AlT .5747 .1668 .223 .32 .0130 |
|
MgM1 0 1/2 1/2 .72 .0122 |
|
FeM1 0 1/2 1/2 .28 .0122 |
|
MgM2 0 .8361 1/2 .73 .0126 |
|
FeM2 0 .8361 1/2 .27 .0126 |
|
O1 .834 .2232 .169 .024 |
|
O2 .502 0 .167 .025 |
|
O3 .630 .1663 .391 .020 |
|
O4 .128 0 .391 .05 .021 |
|
F4 .128 0 .391 .09 .021 |
|
OH4 .128 0 .391 .86 .021 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Phlogopite |
|
Comodi P, Fumagalli P, Montagnoli M, Zanazzi P F |
|
American Mineralogist 89 (2004) 647-653 |
|
A single-crystal study on the pressure behavior of phlogopite |
|
and petrological implications |
|
P = 3.2 GPa |
|
_database_code_amcsd 0003536 |
|
5.291 9.160 9.90 90 100.3 90 C2/m |
|
atom x y z occ Uiso |
|
K 0 0 0 .91 .017 |
|
Ba 0 0 0 .03 .017 |
|
Na 0 0 0 .02 .017 |
|
SiT .5725 .1672 .2177 .68 .0071 |
|
AlT .5725 .1672 .2177 .32 .0071 |
|
MgM1 0 1/2 1/2 .72 .0062 |
|
FeM1 0 1/2 1/2 .28 .0062 |
|
MgM2 0 .8365 1/2 .73 .0066 |
|
FeM2 0 .8365 1/2 .27 .0066 |
|
O1 .834 .2208 .160 .017 |
|
O2 .494 0 .158 .016 |
|
O3 .630 .1670 .391 .008 |
|
O4 .126 0 .383 .05 .016 |
|
F4 .126 0 .383 .09 .016 |
|
OH4 .126 0 .383 .86 .016 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Phlogopite |
|
Comodi P, Fumagalli P, Montagnoli M, Zanazzi P F |
|
American Mineralogist 89 (2004) 647-653 |
|
A single-crystal study on the pressure behavior of phlogopite |
|
and petrological implications |
|
P = 5.0 GPa |
|
_database_code_amcsd 0003537 |
|
5.271 9.130 9.78 90 100.3 90 C2/m |
|
atom x y z occ Uiso |
|
K 0 0 0 .91 .0179 |
|
Ba 0 0 0 .03 .0179 |
|
Na 0 0 0 .02 .0179 |
|
SiT .5715 .1673 .2151 .68 .0108 |
|
AlT .5715 .1673 .2151 .32 .0108 |
|
MgM1 0 1/2 1/2 .72 .0085 |
|
FeM1 0 1/2 1/2 .28 .0085 |
|
MgM2 0 .8366 1/2 .73 .0100 |
|
FeM2 0 .8366 1/2 .27 .0100 |
|
O1 .834 .2134 .158 .021 |
|
O2 .490 0 .156 .022 |
|
O3 .629 .1675 .388 .013 |
|
O4 .128 0 .387 .05 .014 |
|
F4 .128 0 .387 .09 .014 |
|
OH4 .128 0 .387 .86 .014 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Phlogopite |
|
Comodi P, Fumagalli P, Montagnoli M, Zanazzi P F |
|
American Mineralogist 89 (2004) 647-653 |
|
A single-crystal study on the pressure behavior of phlogopite |
|
and petrological implications |
|
P = 6.0 GPa |
|
_database_code_amcsd 0003538 |
|
5.256 9.105 9.71 90 100.4 90 C2/m |
|
atom x y z occ Uiso |
|
K 0 0 0 .91 .0141 |
|
Ba 0 0 0 .03 .0141 |
|
Na 0 0 0 .02 .0141 |
|
SiT .5720 .1668 .2160 .68 .0079 |
|
AlT .5720 .1668 .2160 .32 .0079 |
|
MgM1 0 1/2 1/2 .72 .0072 |
|
FeM1 0 1/2 1/2 .28 .0072 |
|
MgM2 0 .8369 1/2 .73 .0074 |
|
FeM2 0 .8369 1/2 .27 .0074 |
|
O1 .834 .2196 .154 .019 |
|
O2 .488 0 .152 .019 |
|
O3 .6317 .1674 .393 .011 |
|
O4 .128 0 .387 .05 .010 |
|
F4 .128 0 .387 .09 .010 |
|
OH4 .128 0 .387 .86 .010 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Clinochlore |
|
Zanazzi P F, Montagnoli M, Nazzareni S, Comodi P |
|
American Mineralogist 91 (2006) 1871-1878 |
|
Structural effects of pressure on chlorite: A single-crystal study |
|
Locality: Alpe Reguzzolo, Val Malenco, Italy |
|
Sample: P = .0001 GPa |
|
_database_code_amcsd 0004250 |
|
5.327 9.233 14.381 90.2 97.2 89.97 C-1 |
|
atom x y z occ Uiso |
|
MgM1 0 0 0 .9 .0069 |
|
FeM1 0 0 0 .1 .0069 |
|
MgM2 .0009 .33362 0 .9 .0070 |
|
FeM2 .0009 .33362 0 .1 .0070 |
|
MgM3 -.0002 .16677 .5 .9 .0073 |
|
FeM3 -.0002 .16677 .5 .1 .0073 |
|
AlM4 0 .5 .5 .0067 |
|
Si1 .23108 .16723 .19144 .79 .0069 |
|
Al1 .23108 .16723 .19144 .21 .0069 |
|
Si2 .73088 .00056 .19143 .79 .0068 |
|
Al2 .73088 .00056 .19143 .21 .0068 |
|
O1 .1925 .1669 .07681 .0081 |
|
O2 .6923 .0003 .07686 .0084 |
|
O3 .2141 .3339 .23258 .0157 |
|
O4 .5102 .0994 .23276 .0156 |
|
O5 .0103 .0686 .23257 .0157 |
|
Oh1 .6913 .3335 .07334 .0098 |
|
Oh2 .1465 -.0003 .43043 .0155 |
|
Oh3 .1418 .3345 .43035 .0157 |
|
Oh4 .6419 .1651 .43078 .0144 |
|
H1 .703 .337 .132 .054 |
|
H2 .122 .001 .374 .054 |
|
H3 .121 .334 .375 .054 |
|
H4 .607 .156 .377 .054 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Clinochlore |
|
Zanazzi P F, Montagnoli M, Nazzareni S, Comodi P |
|
American Mineralogist 91 (2006) 1871-1878 |
|
Structural effects of pressure on chlorite: A single-crystal study |
|
Locality: Alpe Reguzzolo, Val Malenco, Italy |
|
Sample: P = 1.83 GPa |
|
_database_code_amcsd 0004251 |
|
5.298 9.183 14.23 90.22 97.21 89.95 C-1 |
|
atom x y z occ Uiso |
|
MgM1 0 0 0 .9 .0045 |
|
FeM1 0 0 0 .1 .0045 |
|
MgM2 .0010 .3335 -.0010 .9 .0044 |
|
FeM2 .0010 .3335 -.0010 .1 .0044 |
|
MgM3 -.0006 .1667 1/2 .9 .0037 |
|
FeM3 -.0006 .1667 1/2 .1 .0037 |
|
AlM4 0 .5 .5 .0031 |
|
Si1 .2310 .1670 .1915 .79 .0053 |
|
Al1 .2310 .1670 .1915 .21 .0053 |
|
Si2 .7311 .0005 .1931 .79 .0060 |
|
Al2 .7311 .0005 .1931 .21 .0060 |
|
O1 .1905 .1667 .077 .003 |
|
O2 .6935 .0005 .076 .006 |
|
O3 .2084 .3336 .233 .014 |
|
O4 .5137 .1028 .234 .016 |
|
O5 .0131 .0656 .232 .016 |
|
OH1 .6905 .3331 .077 .006 |
|
OH2 .1450 -.0001 .427 .015 |
|
OH3 .141 .3344 .428 .016 |
|
OH4 .6409 .1649 .428 .012 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Clinochlore |
|
Zanazzi P F, Montagnoli M, Nazzareni S, Comodi P |
|
American Mineralogist 91 (2006) 1871-1878 |
|
Structural effects of pressure on chlorite: A single-crystal study |
|
Locality: Alpe Reguzzolo, Val Malenco, Italy |
|
Sample: P = 3.14 GPa |
|
_database_code_amcsd 0004252 |
|
5.280 9.147 14.15 90.20 97.20 89.92 C-1 |
|
atom x y z occ Uiso |
|
MgM1 0 0 0 .9 .0033 |
|
FeM1 0 0 0 .1 .0033 |
|
MgM2 0 .3336 -.0003 .9 .0033 |
|
FeM2 0 .3336 -.0003 .1 .0033 |
|
MgM3 -.0003 .1665 1/2 .9 .0031 |
|
FeM3 -.0003 .1665 1/2 .1 .0031 |
|
AlM4 0 .5 .5 .0024 |
|
Si1 .2313 .1673 .1922 .79 .0045 |
|
Al1 .2313 .1673 .1922 .21 .0045 |
|
Si2 .7321 .0008 .1927 .79 .0044 |
|
Al2 .7321 .0008 .1927 .21 .0044 |
|
O1 .1908 .1667 .078 .004 |
|
O2 .6921 .0009 .078 .003 |
|
O3 .206 .3344 .235 .014 |
|
O4 .5148 .1042 .234 .014 |
|
O5 .0132 .0638 .236 .014 |
|
OH1 .6921 .3331 .078 .005 |
|
OH2 .1475 -.0007 .426 .012 |
|
OH3 .140 .3349 .425 .014 |
|
OH4 .6408 .1649 .426 .010 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Clinochlore |
|
Zanazzi P F, Montagnoli M, Nazzareni S, Comodi P |
|
American Mineralogist 91 (2006) 1871-1878 |
|
Structural effects of pressure on chlorite: A single-crystal study |
|
Locality: Alpe Reguzzolo, Val Malenco, Italy |
|
Sample: P = 4.25 GPa |
|
_database_code_amcsd 0004253 |
|
5.2618 9.114 14.106 90.12 97.20 89.97 C-1 |
|
atom x y z occ Uiso |
|
MgM1 0 0 0 .9 .005 |
|
FeM1 0 0 0 .1 .005 |
|
MgM2 0 .3329 -.0005 .9 .0062 |
|
FeM2 0 .3329 -.0005 .1 .0062 |
|
MgM3 -.0015 .1671 .4994 .9 .006 |
|
FeM3 -.0015 .1671 .4994 .1 .006 |
|
AlM4 0 .5 .5 .006 |
|
Si1 .2300 .1673 .191 .79 .006 |
|
Al1 .2300 .1673 .191 .21 .006 |
|
Si2 .7304 .0005 .191 .79 .007 |
|
Al2 .7304 .0005 .191 .21 .007 |
|
O1 .192 .1661 .079 .012 |
|
O2 .694 .0012 .080 .012 |
|
O3 .200 .3339 .238 .015 |
|
O4 .521 .1066 .238 .018 |
|
O5 .019 .0620 .238 .016 |
|
OH1 .697 .3323 .082 .006 |
|
OH2 .143 -.0014 .424 .012 |
|
OH3 .137 .3346 .422 .012 |
|
OH4 .641 .1654 .422 .009 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Clinochlore |
|
Zanazzi P F, Montagnoli M, Nazzareni S, Comodi P |
|
American Mineralogist 91 (2006) 1871-1878 |
|
Structural effects of pressure on chlorite: A single-crystal study |
|
Locality: Alpe Reguzzolo, Val Malenco, Italy |
|
Sample: P = 4.85 GPa |
|
_database_code_amcsd 0004254 |
|
5.252 9.106 14.11 90.1 97.3 89.93 C-1 |
|
atom x y z occ Uiso |
|
MgM1 0 0 0 .9 .005 |
|
FeM1 0 0 0 .1 .005 |
|
MgM2 0 .3331 -.0003 .9 .0069 |
|
FeM2 0 .3331 -.0003 .1 .0069 |
|
MgM3 -.0005 .1671 .4995 .9 .0048 |
|
FeM3 -.0005 .1671 .4995 .1 .0048 |
|
AlM4 0 .5 .5 .004 |
|
Si1 .2312 .1677 .191 .006 |
|
Al1 .2312 .1677 .191 .006 |
|
Si2 .7312 .0007 .191 .009 |
|
Al2 .7312 .0007 .191 .009 |
|
O1 .189 .1665 .077 .020 |
|
O2 .695 .0002 .082 .015 |
|
O3 .200 .3339 .235 .020 |
|
O4 .522 .1071 .239 .018 |
|
O5 .021 .0620 .240 .017 |
|
OH1 .700 .3327 .087 .006 |
|
OH2 .142 -.0005 .418 .015 |
|
OH3 .139 .3338 .420 .016 |
|
OH4 .641 .1661 .421 .010 |
|
|
| Download AMC data (View Text File)
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|
| |
|
Chlorite |
| |
Zanazzi P F, Montagnoli M, Nazzareni S, Comodi P |
|
American Mineralogist 92 (2007) 655-661 |
|
Structural effects of pressure on monoclinic chlorite: a single-crystal study |
|
Locality: Alpe Raguzzolo, Val Malenco, Italy |
|
Sample: P = 0.0001 GPa |
|
_database_code_amcsd 0004284 |
|
5.3363 9.240 14.37 90 96.93 90 C2/m |
|
atom x y z occ Uiso |
|
MgM1 0 0 0 .764 .0073 |
|
FeM1 0 0 0 .085 .0073 |
|
AlM1 0 0 0 .151 .0073 |
|
MgM2 0 .33269 0 .764 .0074 |
|
FeM2 0 .33269 0 .085 .0074 |
|
AlM2 0 .33269 0 .151 .0074 |
|
MgM3 0 .16654 .5 .764 .0076 |
|
FeM3 0 .16654 .5 .085 .0076 |
|
AlM3 0 .16654 .5 .151 .0076 |
|
MgM4 0 .5 .5 .764 .0064 |
|
FeM4 0 .5 .5 .085 .0064 |
|
AlM4 0 .5 .5 .151 .0064 |
|
SiT .22844 .16673 .19152 .794 .0074 |
|
AlT .22844 .16673 .19152 .206 .0074 |
|
O1 .1914 .1666 .07678 .0087 |
|
O2 .2100 0 .2328 .0163 |
|
O3 .5070 .2344 .2327 .0161 |
|
OH1 .1901 .5 .0734 .0099 |
|
OH2 .1517 0 .4307 .0151 |
|
OH3 .1407 .3368 .4304 .0160 |
|
|
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|
| |
|
Chlorite |
| |
Zanazzi P F, Montagnoli M, Nazzareni S, Comodi P |
|
American Mineralogist 92 (2007) 655-661 |
|
Structural effects of pressure on monoclinic chlorite: a single-crystal study |
|
Locality: Alpe Raguzzolo, Val Malenco, Italy |
|
Sample: P = 0.77 GPa |
|
_database_code_amcsd 0004285 |
|
5.327 9.227 14.23 90 96.9 90 C2/m |
|
atom x y z occ Uiso |
|
MgM1 0 0 0 .764 .006 |
|
FeM1 0 0 0 .085 .006 |
|
AlM1 0 0 0 .151 .006 |
|
MgM2 0 .3326 0 .764 .007 |
|
FeM2 0 .3326 0 .085 .007 |
|
AlM2 0 .3326 0 .151 .007 |
|
MgM3 0 .1674 .5 .764 .006 |
|
FeM3 0 .1674 .5 .085 .006 |
|
AlM3 0 .1674 .5 .151 .006 |
|
MgM4 0 .5 .5 .764 .006 |
|
FeM4 0 .5 .5 .085 .006 |
|
AlM4 0 .5 .5 .151 .006 |
|
SiT .2297 .1667 .1933 .794 .010 |
|
AlT .2297 .1667 .1933 .206 .010 |
|
O1 .192 .1668 .078 .006 |
|
O2 .209 0 .233 .014 |
|
O3 .5077 .2339 .234 .015 |
|
OH1 .192 .5 .072 .011 |
|
OH2 .152 0 .425 .013 |
|
OH3 .141 .3368 .427 .015 |
|
|
| Download AMC data (View Text File)
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|
| |
|
Chlorite |
| |
Zanazzi P F, Montagnoli M, Nazzareni S, Comodi P |
|
American Mineralogist 92 (2007) 655-661 |
|
Structural effects of pressure on monoclinic chlorite: a single-crystal study |
|
Locality: Alpe Raguzzolo, Val Malenco, Italy |
|
Sample: P = 1.52 GPa |
|
_database_code_amcsd 0004286 |
|
5.304 9.190 14.20 90 96.9 90 C2/m |
|
atom x y z occ Uiso |
|
MgM1 0 0 0 .764 .008 |
|
FeM1 0 0 0 .085 .008 |
|
AlM1 0 0 0 .151 .008 |
|
MgM2 0 .3328 0 .764 .007 |
|
FeM2 0 .3328 0 .085 .007 |
|
AlM2 0 .3328 0 .151 .007 |
|
MgM3 0 .1677 .5 .764 .004 |
|
FeM3 0 .1677 .5 .085 .004 |
|
AlM3 0 .1677 .5 .151 .004 |
|
MgM4 0 .5 .5 .764 .005 |
|
FeM4 0 .5 .5 .085 .005 |
|
AlM4 0 .5 .5 .151 .005 |
|
SiT .2286 .1664 .1909 .794 .005 |
|
AlT .2286 .1664 .1909 .206 .005 |
|
O1 .190 .1671 .072 .011 |
|
O2 .207 0 .234 .020 |
|
O3 .509 .2327 .233 .017 |
|
OH1 .189 .5 .072 .008 |
|
OH2 .151 0 .425 .012 |
|
OH3 .141 .3364 .425 .013 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Chlorite |
| |
Zanazzi P F, Montagnoli M, Nazzareni S, Comodi P |
|
American Mineralogist 92 (2007) 655-661 |
|
Structural effects of pressure on monoclinic chlorite: a single-crystal study |
|
Locality: Alpe Raguzzolo, Val Malenco, Italy |
|
Sample: P = 2.28 GPa |
|
_database_code_amcsd 0004287 |
|
5.293 9.168 14.19 90 96.79 90 C2/m |
|
atom x y z occ Uiso |
|
MgM1 0 0 0 .764 .006 |
|
FeM1 0 0 0 .085 .006 |
|
AlM1 0 0 0 .151 .006 |
|
MgM2 0 .3333 0 .764 .005 |
|
FeM2 0 .3333 0 .085 .005 |
|
AlM2 0 .3333 0 .151 .005 |
|
MgM3 0 .1669 .5 .764 .005 |
|
FeM3 0 .1669 .5 .085 .005 |
|
AlM3 0 .1669 .5 .151 .005 |
|
MgM4 0 .5 .5 .764 .005 |
|
FeM4 0 .5 .5 .085 .005 |
|
AlM4 0 .5 .5 .151 .005 |
|
SiT .2284 .1665 .1907 .794 .007 |
|
AlT .2284 .1665 .1907 .206 .007 |
|
O1 .191 .1671 .075 .009 |
|
O2 .204 0 .233 .014 |
|
O3 .511 .2321 .235 .015 |
|
OH1 .188 .5 .073 .009 |
|
OH2 .150 0 .425 .013 |
|
OH3 .142 .3358 .426 .014 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Chlorite |
| |
Zanazzi P F, Montagnoli M, Nazzareni S, Comodi P |
|
American Mineralogist 92 (2007) 655-661 |
|
Structural effects of pressure on monoclinic chlorite: a single-crystal study |
|
Locality: Alpe Raguzzolo, Val Malenco, Italy |
|
Sample: P = 3.66 GPa |
|
_database_code_amcsd 0004288 |
|
5.270 9.132 14.11 90 96.77 90 C2/m |
|
atom x y z occ Uiso |
|
MgM1 0 0 0 .764 .005 |
|
FeM1 0 0 0 .085 .005 |
|
AlM1 0 0 0 .151 .005 |
|
MgM2 0 .3335 0 .764 .006 |
|
FeM2 0 .3335 0 .085 .006 |
|
AlM2 0 .3335 0 .151 .006 |
|
MgM3 0 .1667 .5 .764 .005 |
|
FeM3 0 .1667 .5 .085 .005 |
|
AlM3 0 .1667 .5 .151 .005 |
|
MgM4 0 .5 .5 .764 .005 |
|
FeM4 0 .5 .5 .085 .005 |
|
AlM4 0 .5 .5 .151 .005 |
|
SiT .2285 .1663 .1921 .794 .007 |
|
AlT .2285 .1663 .1921 .206 .007 |
|
O1 .192 .1672 .076 .008 |
|
O2 .199 0 .233 .011 |
|
O3 .514 .2290 .237 .019 |
|
OH1 .190 .5 .075 .008 |
|
OH2 .150 0 .425 .010 |
|
OH3 .142 .3364 .425 .013 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Chlorite |
| |
Zanazzi P F, Montagnoli M, Nazzareni S, Comodi P |
|
American Mineralogist 92 (2007) 655-661 |
|
Structural effects of pressure on monoclinic chlorite: a single-crystal study |
|
Locality: Alpe Raguzzolo, Val Malenco, Italy |
|
Sample: P = 4.52 GPa |
|
_database_code_amcsd 0004289 |
|
5.252 9.103 14.08 90 96.71 90 C2/m |
|
atom x y z occ Uiso |
|
MgM1 0 0 0 .764 .006 |
|
FeM1 0 0 0 .085 .006 |
|
AlM1 0 0 0 .151 .006 |
|
MgM2 0 .3334 0 .764 .006 |
|
FeM2 0 .3334 0 .085 .006 |
|
AlM2 0 .3334 0 .151 .006 |
|
MgM3 0 .1672 .5 .764 .005 |
|
FeM3 0 .1672 .5 .085 .005 |
|
AlM3 0 .1672 .5 .151 .005 |
|
MgM4 0 .5 .5 .764 .005 |
|
FeM4 0 .5 .5 .085 .005 |
|
AlM4 0 .5 .5 .151 .005 |
|
SiT .2278 .1666 .1913 .794 .007 |
|
AlT .2278 .1666 .1913 .206 .007 |
|
O1 .192 .1675 .074 .008 |
|
O2 .196 0 .231 .014 |
|
O3 .514 .2283 .236 .018 |
|
OH1 .189 .5 .075 .010 |
|
OH2 .149 0 .423 .013 |
|
OH3 .142 .3361 .426 .012 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Chlorite |
| |
Zanazzi P F, Montagnoli M, Nazzareni S, Comodi P |
|
American Mineralogist 92 (2007) 655-661 |
|
Structural effects of pressure on monoclinic chlorite: a single-crystal study |
|
Locality: Alpe Raguzzolo, Val Malenco, Italy |
|
Sample: P = 5.47 GPa |
|
_database_code_amcsd 0004290 |
|
5.237 9.078 14.00 90 96.64 90 C2/m |
|
atom x y z occ Uiso |
|
MgM1 0 0 0 .764 .008 |
|
FeM1 0 0 0 .085 .008 |
|
AlM1 0 0 0 .151 .008 |
|
MgM2 0 .3336 0 .764 .008 |
|
FeM2 0 .3336 0 .085 .008 |
|
AlM2 0 .3336 0 .151 .008 |
|
MgM3 0 .1659 .5 .764 .004 |
|
FeM3 0 .1659 .5 .085 .004 |
|
AlM3 0 .1659 .5 .151 .004 |
|
MgM4 0 .5 .5 .764 .007 |
|
FeM4 0 .5 .5 .085 .007 |
|
AlM4 0 .5 .5 .151 .007 |
|
SiT .229 .1670 .190 .794 .004 |
|
AlT .229 .1670 .190 .206 .004 |
|
O1 .186 .167 .071 .007 |
|
O2 .198 0 .237 .014 |
|
O3 .514 .225 .235 .020 |
|
OH1 .192 .5 .077 .008 |
|
OH2 .150 0 .423 .022 |
|
OH3 .140 .338 .421 .014 |
|
|
| Download AMC data (View Text File)
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|
| |
|
Fluorapatite |
|
Comodi P, Liu Y, Zanazzi P F, Montagnoli M |
| |
Physics and Chemistry of Minerals 28 (2001) 219-224 |
|
Structural and vibrational behaviour of fluorapatite with pressure. |
|
Part 1: in situ single-crystal X-ray diffraction investigation |
|
Sample: P = .0001 GPa |
|
_database_code_amcsd 0008534 |
|
9.375 9.375 6.887 90 90 120 P6_3/m |
|
atom x y z Uiso |
|
Ca1 2/3 1/3 .0011 .0130 |
|
Ca2 -.00721 .24154 1/4 .0126 |
|
P .36853 .39785 1/4 .0096 |
|
O1 .4844 .3267 1/4 .0137 |
|
O2 .4666 .5873 1/4 .0163 |
|
O3 .2572 .3416 .0705 .0188 |
|
F 0 0 1/4 .0266 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Fluorapatite |
|
Comodi P, Liu Y, Zanazzi P F, Montagnoli M |
| |
Physics and Chemistry of Minerals 28 (2001) 219-224 |
|
Structural and vibrational behaviour of fluorapatite with pressure. |
|
Part 1: in situ single-crystal X-ray diffraction investigation |
|
Sample: P = 3.04 GPa |
|
_database_code_amcsd 0008535 |
|
9.268 9.268 6.834 90 90 120 P6_3/m |
|
atom x y z Uiso |
|
Ca1 2/3 1/3 .0008 .0106 |
|
Ca2 -.0096 .2396 1/4 .0095 |
|
P .3681 .3975 1/4 .0078 |
|
O1 .4838 .3246 1/4 .0011 |
|
O2 .4675 .5880 1/4 .0014 |
|
O3 .2562 .3421 .0688 .0171 |
|
F 0 0 1/4 .031 |
|
|
| Download AMC data (View Text File)
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|
| |
|
Fluorapatite |
|
Comodi P, Liu Y, Zanazzi P F, Montagnoli M |
| |
Physics and Chemistry of Minerals 28 (2001) 219-224 |
|
Structural and vibrational behaviour of fluorapatite with pressure. |
|
Part 1: in situ single-crystal X-ray diffraction investigation |
|
Sample: P = 4.72 GPa |
|
_database_code_amcsd 0008536 |
|
9.224 9.224 6.805 90 90 120 P6_3/m |
|
atom x y z Uiso |
|
Ca1 2/3 1/3 .0009 .0105 |
|
Ca2 -.011 .2383 1/4 .0100 |
|
P .3683 .3976 1/4 .0072 |
|
O1 .4836 .3233 1/4 .010 |
|
O2 .4695 .5891 1/4 .014 |
|
O3 .2565 .3420 .0694 .0176 |
|
F 0 0 1/4 .035 |
|
|
| Download AMC data (View Text File)
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|
| |
|
Apatite-(CaF) |
|
Comodi P, Liu Y, Zanazzi P F, Montagnoli M |
| |
Physics and Chemistry of Minerals 28 (2001) 219-224 |
|
Structural and vibrational behaviour of fluorapatite with pressure. |
|
Part 1: in situ single-crystal X-ray diffraction investigation |
|
Sample: P = .0001 GPa |
|
_database_code_amcsd 0008537 |
|
9.375 9.375 6.887 90 90 120 P6_3/m |
|
atom x y z Uiso |
|
Ca1 2/3 1/3 .0011 .0130 |
|
Ca2 -.00721 .24154 1/4 .0126 |
|
P .36853 .39785 1/4 .0096 |
|
O1 .4844 .3267 1/4 .0137 |
|
O2 .4666 .5873 1/4 .0163 |
|
O3 .2572 .3416 .0705 .0188 |
|
F 0 0 1/4 .0266 |
|
|
| Download AMC data (View Text File)
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|
| |
|
Apatite-(CaF) |
|
Comodi P, Liu Y, Zanazzi P F, Montagnoli M |
| |
Physics and Chemistry of Minerals 28 (2001) 219-224 |
|
Structural and vibrational behaviour of fluorapatite with pressure. |
|
Part 1: in situ single-crystal X-ray diffraction investigation |
|
Sample: P = 3.04 GPa |
|
_database_code_amcsd 0008538 |
|
9.268 9.268 6.834 90 90 120 P6_3/m |
|
atom x y z Uiso |
|
Ca1 2/3 1/3 .0008 .0106 |
|
Ca2 -.0096 .2396 1/4 .0095 |
|
P .3681 .3975 1/4 .0078 |
|
O1 .4838 .3246 1/4 .0011 |
|
O2 .4675 .5880 1/4 .0014 |
|
O3 .2562 .3421 .0688 .0171 |
|
F 0 0 1/4 .031 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Apatite-(CaF) |
|
Comodi P, Liu Y, Zanazzi P F, Montagnoli M |
| |
Physics and Chemistry of Minerals 28 (2001) 219-224 |
|
Structural and vibrational behaviour of fluorapatite with pressure. |
|
Part 1: in situ single-crystal X-ray diffraction investigation |
|
Sample: P = 4.72 GPa |
|
_database_code_amcsd 0008539 |
|
9.224 9.224 6.805 90 90 120 P6_3/m |
|
atom x y z Uiso |
|
Ca1 2/3 1/3 .0009 .0105 |
|
Ca2 -.011 .2383 1/4 .0100 |
|
P .3683 .3976 1/4 .0072 |
|
O1 .4836 .3233 1/4 .010 |
|
O2 .4695 .5891 1/4 .014 |
|
O3 .2565 .3420 .0694 .0176 |
|
F 0 0 1/4 .035 |
|
|
| Download AMC data (View Text File)
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|
| |
|
Mica |
| |
Comodi P, Drabek M, Montagnoli M, Rieder M, Weiss Z, Zanazzi P F |
| |
Physics and Chemistry of Minerals 30 (2003) 198-205 |
|
Pressure-induced phase transition in synthetic trioctahedral Rb-mica |
|
Sample: P = .0001 GPa, data collected in air |
|
_database_code_amcsd 0008757 |
|
5.476 9.493 10.514 90 99.95 90 C2/m |
|
atom x y z occ Uiso |
|
Rb 0 .5 0 .99 .0317 |
|
FeM1 0 0 .5 .0121 |
|
FeM2 0 .33215 .5 .0126 |
|
FeT .0766 .1665 .22948 .2675 .0139 |
|
SiT .0766 .1665 .22948 .74 .0139 |
|
O1 .047 0 .1736 .0446 |
|
O2 .3139 .2443 .1740 .0445 |
|
O3 .1308 .1665 .3931 .0138 |
|
OH .1322 .5 .3988 .0158 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Mica |
| |
Comodi P, Drabek M, Montagnoli M, Rieder M, Weiss Z, Zanazzi P F |
| |
Physics and Chemistry of Minerals 30 (2003) 198-205 |
|
Pressure-induced phase transition in synthetic trioctahedral Rb-mica |
|
Sample: P = .0001 GPa, data collected at room conditions in the DAC |
|
_database_code_amcsd 0008758 |
|
5.478 9.489 10.521 90 99.95 90 C2/m |
|
atom x y z occ Uiso |
|
Rb 0 .5 0 .99 .021 |
|
FeM1 0 0 .5 .011 |
|
FeM2 0 .3321 .5 .0115 |
|
FeT .0761 .1665 .2291 .2675 .0152 |
|
SiT .0761 .1665 .2291 .74 .0152 |
|
O1 .040 0 .172 .040 |
|
O2 .316 .243 .173 .037 |
|
O3 .131 .167 .391 .013 |
|
OH .133 .5 .410 .014 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Mica |
| |
Comodi P, Drabek M, Montagnoli M, Rieder M, Weiss Z, Zanazzi P F |
| |
Physics and Chemistry of Minerals 30 (2003) 198-205 |
|
Pressure-induced phase transition in synthetic trioctahedral Rb-mica |
|
Sample: P = 1.76 GPa |
|
_database_code_amcsd 0008759 |
|
5.442 9.435 10.185 90 100.3 90 C2/m |
|
atom x y z occ Uiso |
|
Rb 0 .5 0 .99 .024 |
|
FeM1 0 0 .5 .0096 |
|
FeM2 0 .3328 .5 .0102 |
|
FeT .0742 .1664 .223 .2675 .0132 |
|
SiT .0742 .1664 .223 .74 .0132 |
|
O1 .033 0 .167 .040 |
|
O2 .317 .240 .165 .048 |
|
O3 .133 .1666 .401 .011 |
|
OH .135 .5 .395 .018 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Mica |
| |
Comodi P, Drabek M, Montagnoli M, Rieder M, Weiss Z, Zanazzi P F |
| |
Physics and Chemistry of Minerals 30 (2003) 198-205 |
|
Pressure-induced phase transition in synthetic trioctahedral Rb-mica |
|
Sample: P = 2.81 GPa |
|
_database_code_amcsd 0008760 |
|
5.412 9.392 10.120 90 100.2 90 C2/m |
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atom x y z occ Uiso |
|
Rb 0 .5 0 .99 .085 |
|
FeM1 0 0 .5 .006 |
|
FeM2 0 .3328 .5 .006 |
|
FeT .075 .1661 .222 .2675 .018 |
|
SiT .075 .1661 .222 .74 .018 |
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O1 .021 0 .174 .063 |
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O2 .318 .236 .152 .066 |
|
O3 .130 .164 .389 .011 |
|
OH .122 .5 .360 .002 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Mica |
| |
Comodi P, Drabek M, Montagnoli M, Rieder M, Weiss Z, Zanazzi P F |
| |
Physics and Chemistry of Minerals 30 (2003) 198-205 |
|
Pressure-induced phase transition in synthetic trioctahedral Rb-mica |
|
Sample: P = 4.75 GPa |
|
_database_code_amcsd 0008761 |
|
5.420 9.383 9.846 90 100.8 90 C2/m |
|
atom x y z occ Uiso |
|
Rb 0 .5 0 .99 .153 |
|
FeM1 0 0 .5 .011 |
|
FeM2 0 .3327 .5 .011 |
|
FeT .076 .1663 .227 .2675 .022 |
|
SiT .076 .1663 .227 .74 .022 |
|
O1 .11 0 .18 .149 |
|
O2 .273 .263 .155 .064 |
|
O3 .144 .158 .417 .033 |
|
OH .127 .5 .366 .000 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Mica |
| |
Comodi P, Drabek M, Montagnoli M, Rieder M, Weiss Z, Zanazzi P F |
| |
Physics and Chemistry of Minerals 30 (2003) 198-205 |
|
Pressure-induced phase transition in synthetic trioctahedral Rb-mica |
|
Sample: P = 7.2 GPa |
|
_database_code_amcsd 0008762 |
|
5.410 9.325 9.645 90 100.7 90 C2/m |
|
atom x y z occ Uiso |
|
Rb 0 .5 0 .99 .146 |
|
FeM1 0 0 .5 .015 |
|
FeM2 0 .334 .5 .012 |
|
FeT .068 .167 .211 .2675 .027 |
|
SiT .068 .167 .211 .74 .027 |
|
O1 .09 0 .17 .096 |
|
O2 .276 .271 .16 .076 |
|
O3 .129 .164 .39 .014 |
|
OH .131 .5 .372 .000 |
|
|
| 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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