American Mineralogist Crystal Structure Database

1 matching records for this search.

Ottensite
 
Sabelli C, Nakai I, Katsura S
Download am/vol73/AM73_398.pdf
American Mineralogist 73 (1988) 398-404
Crystal structures of cetineite and its synthetic Na analogue
Na3.6(Sb2O3)3(SbS3)(OH)0.6.2.4(H2O)
Sample: Synthetic Na analogue
_database_code_amcsd 0001145
14.152 14.152 5.5758 90 90 120 P6_3
atom      x      y     z occ B(1,1) B(2,2) B(3,3) B(1,2)  B(1,3)  B(2,3)
Sb1A    1/3    2/3 .8736  .5 .00194 .00194 .00722 .00097       0       0
Sb1B    1/3    2/3 .6263  .5 .00592 .00592 .02007 .00296       0       0
Sb2  .16383 .44662 .2475     .00298 .00345 .01935 .00186  .00164  .00011
Sb3  .38448 .40157 .2471     .00319 .00301 .01274 .00200  .00007 -.00007
Na1   .1921  .3000 .7602     .00614 .00561 .03666 .00228  .00139  .00216
S     .3575  .5267 .6967     .00468 .00346 .04055 .00243  .00214 -.00012
Na2       0      0 .5149 .61 .00291 .00291 .01243 .00146       0       0
O1    .2252  .3495 .2479     .00340 .00396 .02937 .00228 -.00477  .00120
O2    .0606  .3522 .4958     .00649 .00407 .01062 .00231  .00250  .00097
O3    .0630  .3537 .9907     .00250 .00738 .03037 .00238 -.00414  .00137
Wat1  .1301  .1148 .2756 .52 .00624 .01010 .01862 .00301 -.00204 -.00359
Wat2  .1353  .1052 .7127 .48 .00726 .00484 .01635 .00174  .00311  .00215
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Download in:

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: 1
View in amc, download in amc

Return to AMCSD Home Page