American Mineralogist Crystal Structure Database

3 matching records for this search.

Svenekite
 
Ferraris G, Jones D W, Yerkess J
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-7681&volume=28&spage=2430
Acta Crystallographica B28 (1972) 2430-2437
A neutron diffraction study of the crystal structure of calcium
bis(dihydrogen arsenate), Ca(H2AsO4)2
Locality: synthetic
_database_code_amcsd 0018340
8.558 7.697 5.721 92.35 109.52 109.59 P-1
atom      x      y       z B(1,1) B(2,2) B(3,3)  B(1,2) B(1,3)  B(2,3)
As1  .34157 .23990 -.01476 .00298 .00406 .00744  .00079 .00207  .00131
As2  .18712 .76648  .33085 .00325 .00387 .00779  .00121 .00182  .00046
Ca1   .0815  .1866   .3125 .00592 .00558 .00992  .00196 .00307  .00145
O1    .1741  .0617   .0032 .00449 .00480 .01036  .00046 .00289  .00112
O2    .3785  .4014   .2368 .00614 .00666 .01152  .00084 .00364 -.00098
O3    .5417  .2082   .0734 .00472 .00886 .01355  .00303 .00257  .00210
O4    .3109  .3252  -.2793 .00587 .00534 .00886  .00074 .00201  .00204
O5    .0454  .6701   .0306 .00743 .00367 .01027  .00168 .00037  .00065
O6    .1255  .9065   .4759 .00605 .00539 .01143  .00271 .00420  .00105
O7    .1701  .5672   .4665 .00690 .00602 .01214  .00261 .00245  .00322
O8    .3971  .8595   .3405 .00414 .00803 .01462  .00121 .00402 -.00039
H1    .5672  .1760  -.0775 .00730 .01372 .02507  .00434 .00565  .00079
H2    .4895  .5151   .2763 .00890 .00769 .02179 -.00032 .00295 -.00184
H3    .2593  .5993   .6362 .01287 .01886 .01860  .00705 .00144  .00672
H4        0     .5       0 .01011 .01470 .01639  .00453 .00251  .00336
H5       .5      0      .5 .01175 .01646 .02835  .00784 .00992  .00876
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Svenekite
 
Chiari G, Ferraris G
 
Atti della Accademia delle Scienze di Torino, Classe di Scienze Fisiche, Matematiche e Naturali 105 (1971) 725-743
The crystal structure of calcium dihydrogen arsenate, Ca(H2AsO4)2
Locality: synthetic
_database_code_amcsd 0018339
8.558 7.697 5.721 92.583 109.867 109.983 P-1
atom      x      y       z B(1,1) B(2,2) B(3,3) B(1,2)  B(1,3)  B(2,3)
Ca1  .08155 .18633  .31161 .00541 .00598 .00741 .00099  .00139  .00113
As1  .34162 .23977 -.01531 .00469 .00538 .00884 .00075  .00171  .00119
As2  .18696 .76630  .33088 .00478 .00528 .00946 .00094  .00165  .00086
O1    .1743  .0612   .0029 .00469 .00652 .00982 .00066  .00133  .00139
OH2   .3781  .4013   .2355 .00969 .00978 .01286 .00198  .00368  .00086
OH3   .5319  .2080   .0759 .00568 .01112 .00625 .00170  .00025 -.00033
O4    .3097  .3241  -.2816 .00672 .00820 .00893 .00141  .00120  .00225
OH5   .0473  .6716   .0331 .00757 .00420 .00866 .00075 -.00006  .00099
O6    .1252  .9062   .4767 .00902 .00751 .01054 .00259  .00323  .00113
OH7   .1713  .5671   .4679 .00798 .00761 .01357 .00141  .00177  .00299
O8    .3965  .8607   .3366 .00491 .00820 .01402 .00004  .00165 -.00033
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Svenekite
 
Ondrus P, Skala R, Plasil J, Sejkora J, Veselovsky F, Cejka J, Kallistova A,
Hlousek J, Fejfarova K, Skoda R, Dusek M, Gabasova A, Machovic V, Lapcak L
 
Mineralogical Magazine 77 (2013) 2711-2724
Svenekite, Ca[AsO2(OH)2]2. a new mineral from Jachymov, Czech Republic
Locality: Jachymov, Czech Republic
_database_code_amcsd 0019984
8.5606 7.6926 5.7206 92.605 109.9002 109.9017 P-1
atom       x      y      z   Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ca    .08168 .18648 .31266  .0127  .0119  .0150  .0105  .0022  .0041  .0044
As1   .34172 .23993 .98495 .01135  .0091  .0136  .0103  .0019  .0045  .0021
As2  -.18668 .23399 .66951 .01220  .0108  .0129  .0126  .0009  .0046  .0040
O1    -.1744 -.0618 -.0028  .0149   .011   .015   .017   .003   .008   .000
O2     .3771  .4001  .2362  .0207  .0200  .0204  .0178 -.0042  .0105  .0009
O3     .5416  .2079  .0750  .0211  .0149  .0351  .0168  .0061  .0076  .0120
O4     .3116  .3252  .7213  .0152  .0143  .0159  .0113  .0049  .0037  .0015
O5    -.0457  .3292 -.0304  .0168  .0197  .0112  .0124 -.0010  .0001  .0037
O6    -.1254  .0935  .5244  .0144  .0155  .0151  .0153  .0006  .0082  .0067
O7    -.1691  .4339  .5344  .0206  .0172  .0232  .0157  .0051  .0000  .0068
O8    -.3974  .1412  .6588  .0186  .0117  .0227  .0199 -.0042  .0088  .0029
H2     -.229   .410   .431  .0248
H3      .449   .463   .253  .0248
H5      .559   .202   .983  .0253
H7         0     .5      0  .0202
H8        .5      0     .5  .0223
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
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Total number of retrieved datasets: 3
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