American Mineralogist Crystal Structure Database

3 matching records for this search.

Mottramite
Download hom/mottramite.pdf
Cooper M A, Hawthorne F C
Download cm/vol33/CM33_1119.pdf
The Canadian Mineralogist 33 (1995) 1119-1124
The crystal structure of mottramite, and the nature of Cu=Zn solid solution in
the mottramite-descloizite series
_database_code_amcsd 0005468
7.667 6.053 9.316 90 90 90 Pnma
atom      x    y      z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Cu       .5    0      0        .0181  .0177  .0127  .0001  .0013 -.0011
Pb   .13186  .25 .17374        .0168  .0276  .0142      0  .0002      0
V     .8778  .75  .1939        .0150  .0145  .0119      0  .0009      0
H       .71  .25   -.02 .0200
O1    .8847 .507  .2954        .0199  .0172  .0216 -.0054 -.0013  .0011
O2     .053  .75   .085        .0170  .0299  .0226      0  .0053      0
O3     .703  .75   .081        .0131  .0184  .0159      0 -.0011      0
Oh     .637  .25   .063        .0211  .0052  .0147      0 -.0016      0
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View JMOL 3-D Structure (permalink)
 
Mottramite
Download hom/mottramite.pdf
Permer L, Laligant Y, Ferey G
 
European Journal of Solid State and Inorganic Chemistry 30 (1993) 383-392
Crystal structure of (Pb2.8Fe1.2)Cu4O1.6(VO4)4(OH)2;
structural relationships with mineral gamagarite
_cod_database_code 1000426
_database_code_amcsd 0012569
7.525 5.900 9.640 90 90 90 Pnma
atom     x    y     z  occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Fe   .3767  .25 .1788 .280  .0094  .0158  .0114      0  .0004      0
Pb   .3767  .25 .1788 .720  .0094  .0158  .0114      0  .0004      0
V    .8613  .25 .6710        .008   .009   .014      0  -.007      0
Cu       0    0     0        .012   .007   .015  .0007   .003 -.0006
O1    .176  .25  .948        .018   .006   .031      0  -.003      0
O2    .540  .25 -.071        .015   .024   .019      0  -.007      0
O3    .369 .488  .729        .022   .013   .022  -.003   .011  -.011
O4    .856  .25  .066 .900   .015   .010   .018      0   .005      0
H      .74  .25     0   .5
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Mottramite
Download hom/mottramite.pdf
Krause W, Kolitsch U, Bernhardt H J, Effenberger H
 
Neues Jahrbuch fur Mineralogie, Monatshefte 2003 (2003) 75-96
Duhamelite discredited
Locality: Shaba, Congo
_database_code_amcsd 0019267
7.486 9.620 5.881 90 90 90 Pnam
atom     x      y    z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
PbA  .1212 .18560  .25 .43 .0204  .0171  .0261  .0179  .0005      0      0
BiA  .1212 .18560  .25 .36 .0204  .0171  .0261  .0179  .0005      0      0
CaA  .1212 .18560  .25 .19 .0204  .0171  .0261  .0179  .0005      0      0
Cu       0     .5    0     .0149  .0120   .025  .0078  .0012  .0009 -.0006
V    .8580  .1713  .75     .0159   .011   .026   .011   .000      0      0
O1    .866  .2700 .506      .028   .041   .026   .017  -.017  -.007   .002
O2    .039   .070  .75      .044   .008    .07    .06   .008      0      0
O3    .667   .052  .75      .021   .031   .028   .004  -.001      0      0
OH    .652   .073  .25 .64  .086    .05    .16    .04   -.04      0      0
Oh    .652   .073  .25 .29  .086    .05    .16    .04   -.04      0      0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
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Total number of retrieved datasets: 3
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