American Mineralogist Crystal Structure Database

1 matching records for this search.

Spryite
 
Bindi L, Morana M
 
Minerals 11 (2021) 286
Twinning, superstructure and chemical ordering in spryite,
Ag8(As3+0.50As5+0.50)S6, at ultra-low temperature: An X-ray single-crystal study
Note: T = 30 K
Locality: Uchucchacua, Oyon district, Catajambo, Lima Department, Peru
_database_code_amcsd 0020943
14.866 22.240 10.3940 90 90 90 Pna2_1
atom       x      y      z   Uiso U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3) U(2,3)
Ag1A   .1257 .07361  .3742  .0383  .0386  .0369  .0395  -.0010   .0017  .0011
Ag1B   .1269 .40562  .3764  .0359  .0364  .0350  .0364  -.0002   .0009  .0004
Ag1C   .1269  .7341  .3739  .0393  .0402  .0385  .0392   .0012   .0055 -.0012
Ag2A  .06183 .07485 .83671 .02599  .0262  .0260  .0257  .00011  .00011  .0002
Ag2B  .05993 .40511 .83817 .02494  .0250  .0252  .0246 -.00010 -.00013 .00006
Ag2C  .06321 .73552 .83630 .02402  .0239  .0241  .0240  .00026 -.00013 .00014
Ag3A  .43197 .02050 .01921 .03304  .0333  .0331  .0328  .00012  -.0001 -.0002
Ag3B  .43246 .35041 .01990 .02850  .0288  .0285  .0282   .0002 -.00015 -.0001
Ag3C  .43262 .68067 .01956 .03866  .0391  .0387  .0382   .0000   .0001  .0000
Ag4A   .2768  .1662  .0834  .0290  .0286  .0289  .0295   .0001  -.0004 -.0006
Ag4B  .27687 .50675 .08245  .0286  .0288  .0283  .0285   .0000  .00011 -.0005
Ag4C   .2770  .8364  .0819  .0391  .0395   .040   .038  -.0003   .0006 -.0002
Ag5A  .41845 .03021 .69619 .03584  .0361  .0360  .0354  -.0001   .0000  .0000
Ag5B  .41848 .36017 .69717 .03396  .0340  .0342  .0336   .0000   .0001  .0000
Ag5C  .41868 .70034 .69693 .02805  .0283  .0283  .0275 -.00003   .0000 -.0001
Ag6A  .27281 .12823 .68399 .02865  .0289  .0288  .0283 -.00004   .0001  .0001
Ag6B  .27274 .46785 .68435 .03504  .0353  .0351  .0348   .0001   .0000  .0002
Ag6C  .27304 .79812 .68428 .02883  .0289  .0289  .0287  -.0001  -.0002  .0000
Ag7A  .01698  .0045 .60282  .0387  .0401   .036  .0400   .0001  .00003 -.0003
Ag7B   .0175  .3339  .6021  .0249  .0251  .0261  .0234   .0000   .0001  .0002
Ag7C   .0168  .6639  .6036  .0351  .0351  .0338   .036  -.0004   .0000  .0007
Ag8A  .25877 .04283 .90577 .03030  .0306  .0305  .0298  .00009   .0000  .0001
Ag8B  .25881 .37291 .90561 .03138  .0314  .0316  .0311   .0001   .0002 -.0001
Ag8C  .25860 .70268 .90549 .02573  .0258  .0258  .0256  .00000   .0000  .0001
As5   .37565 .07852 .34985 .02252  .0230  .0224  .0222  .00017   .0001  .0001
Ge4+  .37583 .40121 .34959 .01968  .0201  .0197  .0193 -.00010  -.0001  .0000
As3   .37990 .78942 .29965 .02286  .0231  .0233  .0222  .00002   .0001  .0001
S1A    .1227  .1644  .9763   .030   .033   .035   .023   -.002    .003   .000
S1B   .12244  .5046  .9770   .037  .0399   .032  .0397  -.0003  -.0002  .0003
S1C    .1221  .8341  .9774   .046   .039   .042   .056   -.002   -.004   .001
S2A  -.00394 .09037  .2315  .0388  .0388  .0388  .0387   .0000  -.0007  .0001
S2B  -.00418 .42044  .2316  .0380  .0381  .0386  .0375   .0000  -.0007  .0000
S2C  -.00434 .75029  .2313  .0358  .0367  .0354  .0354   .0001   .0003  .0005
S3A   .37300 .15601  .4794  .0362  .0362  .0366  .0357  -.0001   .0000 -.0007
S3B   .37279 .48499  .4791  .0379  .0384  .0381  .0373  -.0001   .0001 -.0001
S3C   .37272 .81480  .4788  .0327  .0325  .0332  .0323   .0002  -.0003 -.0001
S4A   .25826 .07751  .2306  .0380  .0372  .0379  .0391  -.0002   .0009  .0002
S4B   .25859 .40740  .2300  .0402  .0390  .0402  .0415  -.0006   .0007  .0001
S4C   .25859 .73719  .2306  .0407  .0406  .0401  .0412  -.0002   .0005  .0001
S5A    .3861  .1054  .8663  .0334   .034   .032   .035  -.0001  -.0014 -.0005
S5B    .3867  .4357  .8691  .0322   .031   .028   .037  -.0024   -.003  -.003
S5C    .3855  .7631   .879  .0398   .037   .034   .049    .004   -.015  .0019
S6A   .12309 .08887  .6117  .0320  .0321  .0317  .0322   .0000   .0002 -.0007
S6B   .12280 .42869  .6117  .0351  .0349  .0346  .0358   .0003  -.0001  .0003
S6C   .12278 .75866  .6112  .0337  .0343  .0331  .0336   .0000   .0004 -.0003
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