American Mineralogist Crystal Structure Database

1 matching records for this search.

Niocalite
Download hom/niocalite.pdf
Mellini M
 
Tschermaks Mineralogische und Petrographische Mitteilungen 30 (1982) 249-266
Niocalite revised: Twinning and crystal structure
Note: cuspidine structure
Locality: Oka, Quebec, Canada
_database_code_amcsd 0015690
10.863 10.431 7.370 90 110.1 90 Pa
atom     x      y     z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ca1  .9253  .6539 .4781   .018   .008   .008  -.005   .007   .000
Ca2  .9179  .6651 .9733   .007   .009   .005   .000   .003   .001
Ca3  .8123  .3743 .6825   .012   .009   .010  -.002   .004   .000
Ca4  .8200  .3679 .1700   .032   .015   .011   .003   .008   .000
Nb1  .6823  .1395 .8605   .003   .002   .001   .002   .001   .001
Ca5  .6628  .1325 .3504   .011   .014   .016  -.004   .004  -.001
Ca6  .5731 -.1617 .5523   .027   .013   .008  -.013   .006  -.004
Ca7  .5639 -.1542 .0428   .012   .005   .008  -.002   .003  -.002
Si1  .3651  .0654 .6663   .010   .008   .011  -.001   .004  -.003
Si2  .3776  .0541 .2414   .010   .008   .011   .001   .004   .000
Si3  .6169  .5578 .3524   .010   .014   .019   .000   .005  -.003
Si4  .6094  .5593 .7925   .010   .009   .009   .004   .000   .002
O1    .506   .009  .788   .008   .015   .024   .000   .000   .012
O2    .509  -.026  .269   .005   .027   .024   .004   .002  -.001
O3    .236  -.003  .686   .006   .024   .030  -.004   .009   .016
O4    .244   .005  .078   .008   .024   .015   .000  -.011  -.020
O5    .345   .219  .680   .028   .011   .025   .008   .004   .004
O6    .404   .201  .222   .084   .000   .024  -.006   .034  -.009
O7    .755   .502  .363   .020   .022   .030   .006   .013   .003
O8    .745   .505  .921   .011   .008   .045  -.002   .006   .001
O9    .493   .470  .240   .019   .020   .031  -.008   .007  -.013
O10   .482   .475  .775   .014   .016   .020  -.006   .002   .008
O11   .587   .704  .300   .055   .003   .011   .008   .002   .001
O12   .578   .710  .808   .012   .022   .014   .009   .001  -.005
O13   .626   .239  .042   .009   .033   .018  -.004  -.003   .007
O14   .623   .237  .622   .012   .007   .039   .000   .004  -.007
F     .853   .246  .447   .013   .040   .055   .004  -.002  -.015
O16   .845   .225  .937   .000   .040   .021  -.008  -.008   .008
O17   .339   .032  .436   .049   .013   .025  -.007   .020  -.003
O18   .623   .533  .576   .055   .034   .014   .009   .022  -.001
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