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American Mineralogist Crystal Structure Database

1 matching records for this search.

Kayrobertsonite
  
Mills S J, Grey I E, Kampf A R, Birch W D, Macrae C M, Smith J B, Keck E
  
European Journal of Mineralogy 28 (2016) 649-654
Kayrobertsonite, MnAl2(PO4)2(OH)2*6H2O, a new phosphate mineral related to nordgauite
Note: T = 100 K
Locality:  Foote Lithium Company mine, Kings Mountain district, North Carolina, USA
_database_code_amcsd 0020871
10.049 10.205 6.083 91.79 99.70 98.02 P-1
atom      x      y      z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Mn   .58986 .42095 .35167 .97 .0140  .0138  .0171  .0122  .0029  .0029  .0043
Ca   .58986 .42095 .35167 .03 .0140  .0138  .0171  .0122  .0029  .0029  .0043
Al1       0     .5      0     .0112  .0098  .0137  .0106  .0021  .0022  .0025
Al2       0      0     .5     .0148  .0147  .0157  .0135  .0019  .0010  .0015
Al3   .8030 .71886  .1861     .0117  .0124  .0129  .0100  .0018  .0011  .0028
P1   .89520 .73003  .7087     .0119  .0128  .0126  .0102  .0019  .0009  .0024
P2   .66781 .44768  .9240     .0126  .0111  .0144  .0118  .0030  .0011  .0009
O1    .8024  .6914  .4846     .0141   .016   .016  .0113  .0027  .0038  .0015
O2    .8037  .7458  .8815     .0144   .015   .019  .0074  .0029 -.0028  .0005
O3    .9900  .8615  .6982     .0153   .016   .013  .0148  .0012 -.0018  .0000
O4    .9880  .6241  .7721     .0143   .014   .016  .0139  .0042  .0025  .0032
O5    .8115  .4234  .8944     .0141   .010   .018  .0141 -.0003  .0015  .0021
O6    .5931  .3268  .0206     .0157   .012   .020  .0144  .0076  .0011  .0023
O7    .5876  .4784  .6970     .0153   .014   .014  .0165  .0015 -.0017  .0018
O8    .6763  .5608  .1076     .0136   .013   .014  .0131  .0010  .0020  .0006
OH1   .9088  .8870  .2560     .0138   .017   .014  .0098  .0011  .0022 -.0012
OH2   .9501  .6197  .2010     .0133   .010   .016  .0127 -.0008  .0001  .0024
Wat1  .8260  .0355  .5598     .0211   .018   .026   .019  .0040  .0019  .0059
Wat2  .6366  .7986  .1774     .0162   .011   .019   .018  .0020 -.0006  .0029
Wat3  .4491  .2338  .3793     .0201   .026   .017   .021  .0031   .009  .0072
Wat4  .7794  .3486  .4504     .0223   .022   .030   .015 -.0003  .0016   .006
Wat5  .8003  .1461  .9519     .0226   .024   .020   .023  .0003 -.0004  .0048
Wat6  .6192  .0591  .2246     .0253   .021   .021   .032  .0007  -.001  .0033


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