American Mineralogist Crystal Structure Database

2 matching records for this search.

Trilithionite
 
Brigatti M F, Caprilli E, Malferrari D, Medici L, Poppi L
 
European Journal of Mineralogy 17 (2005) 475-481
Crystal structure and chemistry of trilithionite-2M2 and polylithionite-2M2
Note: sample Lch 59a
Locality: Chedeville, France
_database_code_amcsd 0007103
9.056 5.216 20.282 90 99.64 90 C2/c
atom        x      y      z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
KA          0  .0929    .25 .872 .0289  .0287  .0289  .0290      0  .0041      0
NaA         0  .0929    .25 .073 .0289  .0287  .0289  .0290      0  .0041      0
BaA         0  .0929    .25 .002 .0289  .0287  .0289  .0290      0  .0041      0
LiM1      .25    .75      0       .027   .020   .034   .028   .011   .006  -.006
AlM2   .08478  .2548 .00005 .695 .0135  .0138  .0122  .0150  .0000  .0038 -.0010
LiM2   .08478  .2548 .00005 .261 .0135  .0138  .0122  .0150  .0000  .0038 -.0010
MnM2   .08478  .2548 .00005 .240 .0135  .0138  .0122  .0150  .0000  .0038 -.0010
Fe2+M2 .08478  .2548 .00005 .013 .0135  .0138  .0122  .0150  .0000  .0038 -.0010
TiM2   .08478  .2548 .00005 .003 .0135  .0138  .0122  .0150  .0000  .0038 -.0010
Cr3+M2 .08478  .2548 .00005 .001 .0135  .0138  .0122  .0150  .0000  .0038 -.0010
SiT1   .12577  .5861 .13434 .797 .0134  .0139  .0123  .0140  .0018  .0021  .0001
AlT1   .12577  .5861 .13434 .203 .0134  .0139  .0123  .0140  .0018  .0021  .0001
SiT2   .29499  .0933 .13432 .797 .0125  .0115  .0133  .0133  .0013  .0036  .0000
AlT2   .29499  .0933 .13432 .203 .0125  .0115  .0133  .0133  .0013  .0036  .0000
O1      .0885  .5708 .05271      .0186  .0192  .0213  .0150  .0024  .0016  .0007
O2      .2684  .1115 .05309      .0202  .0223  .0224  .0151 -.0014  .0011  .0001
O3      .2033  .3192 .16694      .0227  .0284  .0195  .0213  .0068  .0077  .0005
O4      .4733  .1302 .16629      .0276  .0189  .0378  .0257 -.0008  .0025 -.0034
O5      .2434  .8199 .16143      .0235  .0244  .0196  .0249 -.0047 -.0008  .0035
F       .9491  .0699 .04940 .770 .0313  .0296  .0438  .0212  .0137  .0062 -.0004
OH      .9491  .0699 .04940 .230 .0313  .0296  .0438  .0212  .0137  .0062 -.0004
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View JMOL 3-D Structure (permalink)
 
Trilithionite
 
Brigatti M F, Caprilli E, Malferrari D, Medici L, Poppi L
 
European Journal of Mineralogy 17 (2005) 475-481
Crystal structure and chemistry of trilithionite-2M2 and polylithionite-2M2
Note: sample Lch 132
Locality: Chedeville, France
_database_code_amcsd 0007104
9.033 5.210 20.271 90 99.71 90 C2/c
atom        x      y      z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
KA          0  .0930    .25 .903 .0289  .0243  .0255  .0270      0  .0019      0
NaA         0  .0930    .25 .045 .0289  .0243  .0255  .0270      0  .0019      0
CaA         0  .0930    .25 .002 .0289  .0243  .0255  .0270      0  .0019      0
LiM1      .25    .75      0       .028   .024   .033   .029   .000   .005  -.011
AlM2   .08495  .2550 .00002 .679 .0111  .0095  .0114  .0121  .0018  .0010  .0000
LiM2   .08495  .2550 .00002 .286 .0111  .0095  .0114  .0121  .0018  .0010  .0000
MnM2   .08495  .2550 .00002 .022 .0111  .0095  .0114  .0121  .0018  .0010  .0000
Fe2+M2 .08495  .2550 .00002 .004 .0111  .0095  .0114  .0121  .0018  .0010  .0000
TiM2   .08495  .2550 .00002 .002 .0111  .0095  .0114  .0121  .0018  .0010  .0000
SiT1   .12582  .5869 .13437 .823 .0105  .0086  .0095  .0131  .0006  .0009 -.0003
AlT1   .12582  .5869 .13437 .177 .0105  .0086  .0095  .0131  .0006  .0009 -.0003
SiT2   .29486  .0950 .13441 .823 .0107  .0091  .0097  .0132  .0006  .0015  .0003
AlT2   .29486  .0950 .13441 .177 .0107  .0091  .0097  .0132  .0006  .0015  .0003
O1      .0872  .5698 .05290      .0188  .0229  .0188  .0140 -.0003  .0009 -.0019
O2      .2681  .1152 .05297      .0189  .0179  .0235  .0148 -.0015  .0016  .0009
O3      .2034  .3199 .16710      .0226  .0277  .0198  .0201  .0099  .0034  .0012
O4      .4730  .1301 .16689      .0217  .0112   .034  .0195 -.0014  .0022  .0002
O5      .2432  .8163 .16081      .0239  .0257  .0212  .0223 -.0056 -.0028  .0044
F       .9502  .0675 .04946 .794 .0293  .0249   .044  .0195  .0100  .0037 -.0017
OH      .9502  .0675 .04946 .206 .0293  .0249   .044  .0195  .0100  .0037 -.0017
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: 2
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