American Mineralogist Crystal Structure Database

1 matching records for this search.

Lavendulan
Download hom/lavendulan.pdf
Giester G, Kolitsch U, Leverett P, Turner P, Williams P A
 
European Journal of Mineralogy 19 (2007) 75-93
The crystal structures of lavendulan, sampleite, and a new polymorph of sampleite
Locality: Hilarion mine, Lavrion, Greece
_database_code_amcsd 0007195
10.011 19.478 10.056 90 90.37 90 P2_1/n
atom       x      y       z   Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Na     .2902  .1083   .6475  .0309  .0259   .042  .0248  .0036  .0008 -.0016
Ca    .78303 .09544  .13674  .0207  .0172  .0260  .0188  .0012  .0000  .0001
Cu1   .05806 .21004  .13981  .0175  .0167  .0253  .0105 -.0032 -.0002 -.0001
Cu2   .52395 .21604  .14172  .0178  .0158  .0264  .0113  .0025  .0005  .0002
Cu3   .29061 .21147  .36580  .0172  .0113  .0242  .0160 -.0001 -.0006  .0027
Cu4   .29423 .21174 -.08393  .0175  .0116  .0262  .0147 -.0002  .0003 -.0026
Cu5   .79415 .09098  .64051 .01656  .0130  .0242  .0125 -.0001  .0002 -.0006
As1  -.00500 .15757  .43069 .01576  .0125  .0236  .0112 -.0005  .0009  .0002
As2   .00026 .15848  .84746 .01530  .0118  .0230  .0111 -.0003 -.0005 -.0007
As3   .58430 .16290  .43480 .01555  .0123  .0224  .0119  .0003 -.0006  .0004
As4   .58955 .16303  .84879 .01553  .0119  .0230  .0117  .0005  .0012 -.0004
O1    -.0729  .0882   .4986  .0216   .021   .027   .017  -.004   .008   .001
O2    -.0455  .1587   .2685  .0207   .027   .025   .010  -.009   .001   .001
O3     .1605  .1539   .4595  .0224   .008   .032   .026  -.001   .001   .007
O4    -.0663  .2307   .5016  .0178   .014   .026   .014   .001  -.003  -.002
O5    -.0622  .0883   .7728  .0210   .017   .025   .021  -.002  -.004  -.002
O6     .1646  .1601   .8155  .0221   .008   .036   .023   .002  -.003  -.009
O7    -.0405  .1570  1.0086  .0219   .018   .033   .016  -.006  -.001  -.001
O8    -.0697  .2312   .7804  .0191   .020   .026   .012  -.001  -.001   .003
O9     .6513  .0936   .5050  .0227   .023   .027   .018   .001  -.008   .003
O10    .4212  .1617   .4674  .0234   .013   .036   .021   .002   .001   .010
O11    .6239  .1627   .2722  .0201   .025   .028   .008   .007  -.004   .001
O12    .6494  .2361   .5021  .0171   .015   .025   .011  -.003  .0036 -.0026
O13    .6656  .0954   .7840  .0229   .022   .029   .017   .002   .008  -.002
O14    .4250  .1604   .8191  .0201   .009   .031   .020   .002   .000  -.007
O15    .6482  .2374   .7790  .0179   .019   .022   .013   .001   .002  .0044
O16    .6329  .1680  1.0119  .0204   .018   .032   .011   .004   .001  -.002
Cl    .30063 .13529   .1362  .0244  .0246  .0276  .0209 -.0016  .0004  .0018
Wat1   .8525  .0042   .2943  .0320   .033   .038   .024   .002  -.005  -.006
Wat2   .2341  .0227   .3557   .046   .070   .027   .040  -.002   .017   .002
Wat3   .4415  .0202   .6420  .0361   .032   .043   .033  -.008   .009  -.002
Wat4   .8513  .0069  -.0096  .0383   .043   .044   .028  -.004   .006  -.005
Wat5   .5882  .0224   .1097   .054   .053   .065   .042  -.030  -.006   .011
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Total number of retrieved datasets: 1
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