American Mineralogist Crystal Structure Database

2 matching records for this search.

Litidionite
 
Pozas J M M, Rossi G, Tazzoli V
Download am/vol60/AM60_471.pdf
American Mineralogist 60 (1975) 471-474
Re-examination and crystal structure analysis of litidionite
_database_code_amcsd 0000464
9.800 8.010 6.970 114.1 99.5 105.6 P-1
atom     x     y     z Biso  B(1,1)  B(2,2)  B(3,3)   B(1,2)   B(1,3)  B(2,3)
K    .0038 .2033 .3348 1.58 .005340 .005423 .012209  .001408  .002489 .003093
Na   .4090 .1295 .6633 1.57 .004459 .010439 .008062  .001432  .002706 .004216
Cu   .4122 .1287 .1624  .74 .001786 .004830 .004531  .000565  .000710 .002641
Si1  .8593 .1742 .8119  .65 .001533 .004668 .004995  .001086  .001283 .002761
Si2  .7222 .3545 .5664  .66 .002878 .003507 .003055  .000887  .001167 .001925
Si3  .2110 .2877 .9582  .59 .002198 .003139 .003762  .001234  .001155 .001571
Si4  .7256 .3825 .1557  .68 .002980 .003758 .003328  .000718  .001287 .002263
O1   .5682 .2072 .0323 1.25 .003331 .007957 .005251 -.000245  .000198 .003200
O2   .2716 .1161 .9166 1.04 .003887 .005760 .007700  .002986  .001632 .003833
O3   .8535 .3320 .0452 1.22 .003722 .005574 .007298  .000845  .001585 .001732
O4   .0302 .1851 .8549 1.64 .001777 .005987 .017376  .001499 -.000100 .002388
O5   .2521 .0432 .2803 1.34 .004219 .006424 .010182  .001112  .003272 .003990
O6   .7943 .4314 .4102 1.20 .003699 .008258 .005115  .000223  .000554 .004353
O7   .5561 .2017 .4459 1.30 .002919 .009372 .006857 -.000004  .000899 .004652
O8   .2562 .4471 .2155 1.76 .009178 .008213 .005731  .004616  .002535 .002637
O9   .8331 .2535 .6323 1.30 .005585 .009502 .007220  .004201  .003383 .006148
O10  .2716 .4072 .8286 1.61 .008394 .006952 .014613  .005080  .007536 .008123
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Litidionite
 
Brandao P, Rocha J, Reis M S, dos Santos A M, Jin R
 
Journal of Solid State Chemistry 182 (2009) 253-258
Magnetic properties of KNaMSi4O10 compounds (M=Mn,Fe,Cu)
Locality: synthetic
_database_code_amcsd 0019812
6.9704 8.0111 9.7896 105.559 99.534 114.156 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)
K     .1652  .7969  .49606  .0207  .0243  .0121  .0194  .0053  .0057  .0026
Na    .1625 1.1287   .9084  .0188  .0160  .0221  .0171  .0086  .0061  .0057
Cu   .33764 .87111 1.08760 .00953  .0108  .0111  .0073  .0064  .0021  .0027
Si1   .3119 1.1738  .35912  .0081  .0095  .0087  .0061  .0047  .0018  .0029
Si2   .3438  .6171  .77415  .0083  .0076  .0084  .0088  .0045  .0023  .0022
Si3   .4582 1.2878  .71053  .0073  .0087  .0072  .0068  .0040  .0026  .0035
Si4   .0661  .3543  .22202  .0088  .0069  .0084  .0103  .0039  .0019  .0025
O1    .4673  .7918   .9322  .0148   .012   .017   .011  .0057  .0025  .0001
O2    .3550 1.1848   .5303  .0195   .034   .013   .008   .008  .0041  .0057
O3    .4550  .6681   .6477  .0132   .012   .014   .013  .0041  .0060  .0071
O4    .0541  .7982   .9446  .0145   .011   .016   .013  .0078  .0009 -.0006
O5    .2210  .9575  1.2468  .0143   .015  .0094   .013  .0044  .0045 -.0011
O6    .0897  .5678   .7053  .0128   .010   .017  .0106  .0095  .0017  .0012
O7    .5825  .8843  1.2281  .0109   .014  .0103  .0114  .0061  .0030  .0080
O8   -.3276  .5934   .2285  .0175   .022   .014   .026  .0134   .015  .0094
O9    .2840  .5528   .2436  .0195   .010   .013   .032  .0022  .0031   .012
O10  -.1322  .7482   .6674  .0145   .014   .017   .018  .0103  .0056  .0101
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View JMOL 3-D Structure (permalink)
 
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