American Mineralogist Crystal Structure Database

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Shcherbinaite
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Shklover V, Haibach T, Ried F, Nesper R, Novak P
Journal of Solid State Chemistry 123 (1996) 317-323
Crystal structure of the product of Mg2+ insertion into V2O5 single crystals
Locality: synthetic
Sample: I
_database_code_amcsd 0013889
11.544 4.383 3.574 90 90 90 Pmn2_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)
V    .1487 .3924      0     .014   .004   .023   .016  -.001   .000   .006
Mg      .5  .077  -.001 .01 .032
O1   .1461 .0324 -.0009     .024   .021   .021   .030  -.002   .009   .023
O2   .3193 .5056 -.0032     .018   .007   .033   .015  -.003   .004  -.023
O3       0 .5017 -.0033     .018   .008   .028   .019      0      0   .011
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