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American Mineralogist Crystal Structure Database

1 matching records for this search.

Yakovenchukite-(Y)
 
Krivovichev S V, Pakhomovsky Y A, Ivanyuk G Y, Mikhailova J A, Men'shikov Y P,
Armbruster T, Selivanova E A, Meisser N
Download am/vol92/AM92_1525.pdf
American Mineralogist 92 (2007) 1525-1530
Yakovenchukite-(Y), K3NaCaY2(Si12O30)(H2O)4, a new mineral from the Khibiny
massif, Kola Peninsula, Russia: a novel type of octahedral-tetrahedral
open-framework structure
Locality: Khibiny massif, Kola Peninsula, Russia
_database_code_amcsd 0004453
14.972 14.137 14.594 90 90 90 Pcca
atom      x      y     z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
K1       .5  .2677   .25 .88  .041  .0308   .026   .065   .000   .026      0
K2    .0896  .2619 .1022 .94 .0384  .0180   .037   .061  .0046  .0013  .0041
Na      .25     .5 .0128      .042   .047   .053   .027  -.014      0      0
Ca1     .25      0 .0300     .0157  .0096   .020   .017  .0040      0      0
Ca2   .0392   .244  .006 .06  .013
Y1        0     .5    .5 .84 .0137  .0103  .0159  .0151 -.0002  .0008  .0006
Yb1       0     .5    .5 .16 .0137  .0103  .0159  .0151 -.0002  .0008  .0006
Y2        0      0    .5 .82 .0143  .0099  .0176  .0154  .0008  .0014  .0013
Yb2       0      0    .5 .18 .0143  .0099  .0176  .0154  .0008  .0014  .0013
Si1   .1252  .3588 .3440     .0149   .010   .011   .024 -.0004 -.0027 -.0027
Si2   .1215  .1434 .3510     .0161   .014   .019   .015 -.0007  .0012 -.0013
Si3   .1699  .6402 .3768     .0169  .0121   .019   .020 -.0023  .0013 -.0023
Si4   .1759 -.1359 .3717     .0141  .0120   .011   .020  .0003 -.0002 -.0021
Si5   .0972 -.0264 .2175     .0158  .0144   .017   .016 -.0007  .0003  .0015
Si6   .1452  .5182 .2019     .0207  .0159   .026   .020  .0008  .0001 -.0009
O1        0 -.0642   .25      .022   .013   .022   .030      0  -.005      0
O2    .1407  .6031 .2768      .025   .027   .025   .024   .000  -.004  -.007
O3    .1150  .0775 .2608      .019   .029   .015   .013   .005  -.005   .007
O4    .1142  .4183 .2503      .025   .019   .024   .031  -.003  -.008   .006
O5    .1667 -.1019 .2656      .017   .015   .026   .009   .003   .000  -.006
O6    .2233  .3810 .3887      .020   .016   .023   .020  -.004   .004  -.009
O7    .1234  .2500 .3074      .020   .019   .015   .025  -.005   .006  -.004
O8    .2185  .1219 .4007      .019   .005   .023   .030  -.003  -.003   .000
O9    .0445  .1289 .4250      .021   .016   .020   .027  -.005   .006   .004
O10   .0499  .3799 .4176      .020   .015   .030   .016  -.007   .002  -.003
O11   .1508  .7520 .3767      .022   .013   .019   .035   .003   .003   .004
O12   .0906  .5452 .1147      .028   .025   .039   .020  -.007  -.007   .002
O13   .1075 -.0264 .1103      .024   .031   .032   .010   .005  -.004   .005
O14   .1188  .5910 .4586      .023   .022   .022   .024  -.002   .003   .007
O15     .25     .5 .1732      .028   .021   .048   .017  -.002      0      0
O16   .1198 -.0744 .4401      .020   .015   .025   .018   .007   .002  -.005
Wat17 .4059  .2524 .0825      .057   .069   .038   .064   .008   .002   .009
Wat18 .2429  .1640 .1046      .041   .035   .059   .030   .020  -.006   .003
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