American Mineralogist Crystal Structure Database

2 matching records for this search.

Schmidite
 
Grey I E, Keck E, Kampf A R, Cashion J D, MacRae C M, Glenn A M
 
Mineralogical Magazine 83 (2019) 181-190
Schmidite and wildenauerite, two new schoonerite-group minerals from the
Hagendorf-Sud pegmatite, Oberpfalz, Bavaria
Note: Sample IGC-1
Locality: Hagendorf-Sud pegmatite, Oberpfalz, Bavaria, Germany
_database_code_amcsd 0020865
11.0350 25.383 6.4110 90 90 90 Pmab
atom      x       y      z  occ   Uiso U(1,1) U(2,2) U(3,3)  U(1,2) U(1,3)  U(2,3)
Zn1a    .25  .10314 .85061 .850 .01953  .0088  .0261  .0236       0      0 -.00800
Zn1b    .25   .0672  .8848 .150  .0357  .0076   .081  .0185       0      0   .0073
Mn1     .25 .415349 .22501  .32 .01821  .0084  .0264  .0198       0      0 -.00286
Fe1     .25 .415349 .22501  .48 .01821  .0084  .0264  .0198       0      0 -.00286
Zn1     .25 .415349 .22501 .200 .01821  .0084  .0264  .0198       0      0 -.00286
Fe2       0     .25 .08894  .64 .01720  .0131  .0178  .0207 -.00119      0       0
Mn2       0     .25 .08894   .3 .01720  .0131  .0178  .0207 -.00119      0       0
Zn2       0     .25 .08894 .059 .01720  .0131  .0178  .0207 -.00119      0       0
Fe3       0     .25 .57307   .1 .01675  .0114  .0220  .0168  .00069      0       0
Mn3       0     .25 .57307  .32 .01675  .0114  .0220  .0168  .00069      0       0
Zn3       0     .25 .57307 .422 .01675  .0114  .0220  .0168  .00069      0       0
Fe4     .25 .187676 .32490      .01426  .0127  .0188  .0113       0      0 -.00011
P1   .03028  .11883 .14187      .01406  .0091  .0188  .0143 -.00041 -.0006  .00048
O1   .02402  .32918  .0575       .0194  .0114  .0226  .0244   .0005  .0030  -.0043
O2   .06868  .41668  .2290       .0197  .0132  .0242  .0216  -.0029 -.0003  -.0022
O3   .09112  .08959  .9597       .0202  .0147  .0247  .0211  -.0024  .0010  -.0055
O4   .12081  .13050  .3187       .0171  .0100  .0245  .0169  -.0026 -.0013   .0009
P2      .25  .21665 .82626       .0131  .0084  .0174  .0133       0      0   .0002
O5      .25  .17979  .0152       .0177  .0132  .0238  .0161       0      0   .0012
O6      .25  .17922  .6370       .0195  .0161  .0295  .0129       0      0  -.0034
O7   .13300  .24983  .8298       .0235  .0139  .0230  .0335   .0049 -.0016   .0011
Oh   .12200  .24221  .3233       .0240  .0151  .0250  .0319   .0071 -.0027  -.0021
Ow1  .02789  .33281  .6159       .0237  .0184  .0351  .0177   .0010 -.0051   .0038
Ow2     .25  .34515  .4219       .0250  .0237  .0258  .0257       0      0   .0009
Ow3     .25  .36491  .9571       .0230  .0113  .0287  .0291       0      0  -.0028
Ow4     .25  .46060  .5042       .0234  .0153  .0308  .0241       0      0  -.0009
Ow5     .25  .48647  .0461       .0274  .0142  .0439  .0240       0      0  -.0060
Ow6     .25  .06362  .5894       .0458   .097  .0235  .0173       0      0   .0013
Ow7  .05800  .48154  .7603       .0251  .0178  .0255  .0320  -.0012  .0037   .0031
H1a   -.019   .3492   .532        .052
H1b    .075   .3134   .547        .052
H2    .3130   .3493   .497        .052
H3    .3124   .3457   .958        .052
H4    .3139   .4639   .581        .052
H5    .3127   .4892  -.029        .052
H7a    .009   .4599   .817        .052
H7b    .020   .5103   .731        .052
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Schmidite
 
Grey I E, Keck E, Kampf A R, Cashion J D, MacRae C M, Glenn A M
 
Mineralogical Magazine 83 (2019) 181-190
Schmidite and wildenauerite, two new schoonerite-group minerals from the
Hagendorf-Sud pegmatite, Oberpfalz, Bavaria
Note: Sample IGC-31
Locality: Hagendorf-Sud pegmatite, Oberpfalz, Bavaria, Germany
_database_code_amcsd 0020866
11.002 25.310 6.3900 90 90 90 Pmab
atom      x      y      z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
P1   .03038 .11899 .14146      .0127  .0145  .0138  .0097  .0002 -.0004  .0004
P2      .25 .21666  .8272      .0117  .0141  .0119  .0092      0      0  .0002
Mg1     .25 .41505 .22376  .05 .0164  .0130  .0206  .0157      0      0 -.0040
Mn1     .25 .41505 .22376  .31 .0164  .0130  .0206  .0157      0      0 -.0040
Fe1     .25 .41505 .22376  .52 .0164  .0130  .0206  .0157      0      0 -.0040
Zn1     .25 .41505 .22376 .131 .0164  .0130  .0206  .0157      0      0 -.0040
Fe2       0    .25 .09232  .65 .0147  .0174  .0118  .0151 -.0007      0      0
Mn2       0    .25 .09232  .35 .0147  .0174  .0118  .0151 -.0007      0      0
Fe3       0    .25 .57169  .14 .0153  .0164  .0170  .0126  .0014      0      0
Mn3       0    .25 .57169  .22 .0153  .0164  .0170  .0126  .0014      0      0
Zn3       0    .25 .57169 .445 .0153  .0164  .0170  .0126  .0014      0      0
Fe4     .25 .18799 .32585  .94 .0110  .0158  .0121  .0052      0      0  .0002
Al4     .25 .18799 .32585  .06 .0110  .0158  .0121  .0052      0      0  .0002
Zn1a    .25 .10306 .84840 .752 .0176  .0140  .0192  .0195      0      0 -.0085
Fe1a    .25 .10306 .84840  .04 .0176  .0140  .0192  .0195      0      0 -.0085
Zn1b    .25  .0655  .8895 .171 .0256   .013   .049   .015      0      0  .0054
Fe1b    .25  .0655  .8895  .02 .0256   .013   .049   .015      0      0  .0054
O1    .0233 .32879  .0587      .0166  .0149  .0139  .0209  .0002  .0010 -.0031
O2    .0693 .41629  .2284      .0179  .0176  .0174  .0186 -.0035 -.0001 -.0008
O3    .0907 .08995  .9593      .0190  .0212  .0208  .0150 -.0023  .0014 -.0061
O4    .1208 .13030  .3199      .0151  .0166  .0191  .0094 -.0029 -.0014  .0012
O5      .25 .17983  .0164      .0152   .022   .019  .0049      0      0  .0012
O6      .25 .17925  .6382      .0189   .021   .025  .0108      0      0 -.0025
O7    .1328 .24971  .8301      .0233  .0228  .0175  .0297  .0065  .0012  .0009
Oh    .1211 .24191  .3249      .0214  .0207  .0207  .0229  .0086 -.0053 -.0037
Ow1   .0281 .33127  .6130      .0262  .0271   .032  .0192 -.0003 -.0058  .0042
Ow2     .25 .34463  .4170      .0230   .026   .017   .026      0      0  .0027
Ow3     .25 .36478  .9552      .0232   .018   .024   .027      0      0  -.011
Ow4     .25 .45945  .5031      .0210   .019   .030   .014      0      0 -.0046
Ow5     .25  .4858  .0451      .0263   .016   .046   .017      0      0  -.003
Ow6     .25  .0627  .5853      .0390   .081   .021   .016      0      0   .000
Ow7   .0582 .48125  .7579      .0270  .0280  .0213  .0317  .0004  .0062  .0044
H1a   -.014   .355   .552   .8  .077
H1b    .081   .346   .696   .8  .077
H2    .3128   .343  .4932       .077
H3    .3131  .3455   .949       .077
H4    .3127   .452   .574       .077
H5    .3127   .487 -.0310       .077
H6    .3128   .048    .63   .5  .077
H7a    .010   .460   .824       .077
H7b    .024  .5114   .744       .077
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View JMOL 3-D Structure (permalink)
 
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Total number of retrieved datasets: 2
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