|
Bakerite |
 |
Perchiazzi N, Gualtieri A F, Merlino S, Kampf A R |
 |
American Mineralogist 89 (2004) 767-776 |
|
The atomic structure of bakerite and its relationship to datolite |
|
Sample: Refinement of the conventional X-ray data for sample #92735 |
|
_database_code_amcsd 0003541 |
|
4.8014 7.5780 9.5419 90 90.434 90 P2_1/c |
|
atom x y z occ Uiso |
|
Ca .9914 .10838 .33369 .026 |
|
SiT1 .4738 .26347 .08664 .75 .025 |
|
BT1 .4738 .26347 .08664 .25 .025 |
|
BT2 .5629 .41243 .33705 .028 |
|
O1 .2604 .4081 .0389 .75 .020 |
|
OH1 .2604 .4081 .0389 .25 .020 |
|
O2 .6604 .3046 .4559 .027 |
|
O3 .6850 .3265 .2104 .022 |
|
O4 .3226 .0935 .1454 .021 |
|
OH5 .2582 .4115 .3368 .026 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Bakerite |
|
Perchiazzi N, Gualtieri A F, Merlino S, Kampf A R |
|
American Mineralogist 89 (2004) 767-776 |
|
The atomic structure of bakerite and its relationship to datolite |
|
Sample: Refinement of the synchrotron data for sample #92735 |
|
_database_code_amcsd 0003542 |
|
4.8005 7.5788 9.5432 90 90.437 90 P2_1/c |
|
atom x y z occ Uiso |
|
Ca .9918 .10663 .33305 .013 |
|
SiT1 .4793 .2630 .0881 .75 .013 |
|
BT1 .4793 .2630 .0881 .25 .013 |
|
BT2 .5593 .4086 .3395 .021 |
|
O1 .2592 .4013 .0346 .75 .011 |
|
OH1 .2592 .4013 .0346 .25 .011 |
|
O2 .6733 .3050 .4598 .011 |
|
O3 .6854 .3267 .2108 .010 |
|
O4 .3135 .0901 .1454 .019 |
|
OH5 .2540 .4066 .3402 .011 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Bakerite |
|
Perchiazzi N, Gualtieri A F, Merlino S, Kampf A R |
|
American Mineralogist 89 (2004) 767-776 |
|
The atomic structure of bakerite and its relationship to datolite |
|
Sample: Refinement of the neutron data (RT) for sample #92735 |
|
_database_code_amcsd 0003543 |
|
4.7967 7.5711 9.5321 90 90.427 90 P2_1/c |
|
atom x y z occ Uiso |
|
Ca .9936 .1082 .3315 .0054 |
|
SiT1 .4761 .2578 .0896 .75 .014 |
|
BT1 .4761 .2578 .0896 .25 .014 |
|
BT2 .5684 .4063 .3423 .012 |
|
O1 .2616 .4013 .0375 .015 |
|
O2 .6681 .2999 .4611 .009 |
|
O3 .6775 .3320 .2103 .011 |
|
O4 .3166 .0868 .1445 .008 |
|
O5 .2595 .4087 .3392 .012 |
|
H1 .1995 .4668 .4328 .044 |
|
H2 .3994 .4663 -.0066 .25 .044 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Bakerite |
|
Perchiazzi N, Gualtieri A F, Merlino S, Kampf A R |
|
American Mineralogist 89 (2004) 767-776 |
|
The atomic structure of bakerite and its relationship to datolite |
|
Sample: Refinement of the neutron data (LT) for sample #92735 |
|
_database_code_amcsd 0003544 |
|
4.7892 7.5644 9.5362 90 90.476 90 P2_1/c |
|
atom x y z occ Uiso |
|
Ca .9958 .1103 .3326 .012 |
|
SiT1 .4768 .2534 .0857 .75 .008 |
|
BT1 .4768 .2534 .0857 .25 .008 |
|
BT2 .5691 .4074 .3426 .010 |
|
O1 .2614 .4036 .0412 .014 |
|
O2 .6759 .3032 .4632 .014 |
|
O3 .6762 .3259 .2126 .015 |
|
O4 .3146 .0872 .1439 .009 |
|
O5 .2581 .4081 .3397 .008 |
|
H1 .1943 .4595 .4301 .026 |
|
H2 .4142 .4826 .0047 .25 .026 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Bakerite |
|
Perchiazzi N, Gualtieri A F, Merlino S, Kampf A R |
|
American Mineralogist 89 (2004) 767-776 |
|
The atomic structure of bakerite and its relationship to datolite |
|
Sample: Combined refinement |
|
_database_code_amcsd 0003545 |
|
4.80042 7.57864 9.5426 90 90.435 90 P2_1/c |
|
atom x y z occ Uiso |
|
Ca .99295 .10749 .33320 .0129 |
|
SiT1 .4754 .26337 .08782 .75 .0114 |
|
BT1 .4754 .26337 .08782 .25 .0114 |
|
BT2 .5623 .41009 .33929 .014 |
|
O1 .2566 .4032 .03594 .011 |
|
O2 .6685 .3032 .45842 .009 |
|
O3 .6854 .3277 .21010 .008 |
|
O4 .3146 .0909 .14570 .012 |
|
O5 .2557 .4065 .33656 .016 |
|
H1 .1877 .4614 .4290 .031 |
|
H2 .4265 .4772 .0387 .25 .031 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
Multiple datasets can be concatenated into a single downloadable file by selecting the datasets and then clicking
Multiple datasets can be downloaded as individual files inside a ZIP archive by selecting the datasets and then clicking
Total number of retrieved datasets: 