American Mineralogist Crystal Structure Database

2 matching records for this search.

Margarite-2M1
 
Guggenheim S, Bailey S W
Download am/vol60/AM60_1023.pdf
American Mineralogist 60 (1975) 1023-1029
Refinement of the margarite structure in subgroup symmetry
_database_code_amcsd 0000477
5.1038 8.8287 19.148 90 95.46 90 Cc
atom     x     y     z occ Biso
Ca       0 .0932   .25     1.02
Si1  .4647 .9285 .1416  .5  .99
Si2  .5364 .0752 .8549  .5  .58
Si3  .4567 .2572 .1444  .5  .61
Si4  .5500 .7437 .8573  .5  .97
Al1  .4647 .9285 .1416  .5  .99
Al2  .5364 .0752 .8549  .5  .58
Al3  .4567 .2572 .1444  .5  .61
Al4  .5500 .7437 .8573  .5  .97
Al5  .7469 .9187 .9997      .73
Al6  .2510 .0863 .9998      .55
H1   .3970 .6370 .0830      .78
H2   .6030 .3630 .9170      .78
O1   .9600 .4436 .0512     1.00
O2   .0460 .5585 .9390      .50
O3   .3950 .2540 .0568      .90
O4   .6190 .7489 .9447      .70
O5   .3670 .0974 .1775     1.10
O6   .6410 .9167 .8226      .60
O7   .2660 .7784 .1665      .50
O8   .7110 .2140 .8304     1.10
O9   .2870 .3926 .1785      .40
O10  .7370 .6080 .8211     1.40
O11  .4480 .5693 .0488      .40
O12  .5430 .4417 .9468     1.00
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Margarite
Download hom/margarite.pdf
Guggenheim S, Bailey S W
Download am/vol63/AM63_186.pdf
American Mineralogist 63 (1978) 186-187
Refinement of the margarite structure in subgroup symmetry: correction,
further refinement, and comments
_database_code_amcsd 0000615
5.104 8.829 19.148 90 95.5 90 Cc
atom     x     y      z occ Biso
Ca       0 .0933    .25      .80
Al1  .7449 .9177  .9996      .53
Al2  .2488 .0858 -.0003      .44
Si1  .4623 .9264  .1422  .5  .46
Al1  .4623 .9264  .1422  .5  .46
Si2  .4544 .2567  .1445  .5  .22
Al2  .4544 .2567  .1445  .5  .22
Si11 .5336 .0739  .8551  .5  .59
Al11 .5336 .0739  .8551  .5  .59
Si22 .5467 .7440  .8576  .5  .89
Al22 .5467 .7440  .8576  .5  .89
O1    .962 .4445  .0527      .50
O2    .395 .2544  .0590      .50
OH1   .449 .5696  .0507      .40
O3    .366 .0974  .1781      .80
O4    .267 .7782  .1682      .60
O5    .289 .3924  .1788      .60
O11   .045 .5614  .9401      .60
O22   .618 .7502  .9468      .50
OH11  .543 .4396  .9482      .80
O33   .639 .9172  .8236      .50
O44   .712 .2149  .8323      .60
O55   .737 .6062  .8217      .70
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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Total number of retrieved datasets: 2
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