American Mineralogist Crystal Structure Database

3 matching records for this search.

Calderonite
 
Gonzalez del Tanago J, La Iglesia A, Rius J, Santin S F
Download am/vol88/AM88_1703.pdf
American Mineralogist 88 (2003) 1703-1708
Calderonite, a new lead-iron-vanadate of the brackebuschite group
_database_code_amcsd 0003183
7.649 6.101 8.904 90 112.23 90 P2_1/m
atom       x     y     z  occ Uiso
VT1    .5587   3/4 .8250 .977 .010
VT2    .9601   3/4 .6621 .935 .010
FeM1       0     0     0      .010
PbM2  -.2614   3/4 .2554 .979 .024
PbM3   .3227   3/4 .3970 .958 .032
O1     .4923 .9783 .7061      .024
O2     .4525   3/4 .9556      .040
O3     .8084   3/4 .9431      .018
O4     .7299   3/4 .5449      .036
O5    -.0106 .0167 .2193      .020
O6     .0760   3/4 .5352      .029
OH7    .1855   3/4 .0810      .015
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View JMOL 3-D Structure
 
Gayite
 
Kampf A R, Colombo F, Gonzalez del Tanago J
 
American Mineralogist 95 (2010) 386-391
Gayite, a new dufrenite-group mineral from the Gigante granitic pegmatite,
Cordoba province, Argentina
Locality: Gigante granitic pegmatite, Punilla department,
Cordoba province, Argentina
_database_code_amcsd 0005031
25.975 5.1766 13.929 90 111.293 90 C2/c
atom      x      y     z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Na        0 -.1704   .25     .034   .028   .046   .024   .000   .007   .000
Fe1       0      0     0 .73 .029   .032   .030   .021  -.001   .008   .000
Al1       0      0     0 .27 .029   .032   .030   .021  -.001   .008   .000
Mn2     .25    .25     0 .93 .028   .028   .025   .022  -.002   .001  -.003
Fe2     .25    .25     0 .07 .028   .028   .025   .022  -.002   .001  -.003
Fe3   .1531 -.0199 .1095 .76 .026   .030   .027   .019   .001   .005  -.001
Al3   .1531 -.0199 .1095 .24 .026   .030   .027   .019   .001   .005  -.001
Fe4   .1397 -.2286 .3495 .87 .027   .033   .025   .020   .000   .006   .001
Al4   .1397 -.2286 .3495 .13 .027   .033   .025   .020   .000   .006   .001
P1    .2165  .2614 .3309     .030   .038   .023   .027   .002   .009   .000
P2    .0785  .2707 .3918     .034   .037   .034   .028   .002   .010   .002
O1    .0879  .0548 .3239     .038   .060   .025   .026   .010   .014  -.005
O2    .0775  .5317 .3391     .036   .050   .032   .022   .000   .009   .014
O3    .0227  .2278 .4024     .040   .036   .044   .033   .008   .003   .003
O4    .1241  .2720 .4986     .036   .025   .045   .030   .003   .001   .002
OH5   .1687  .2285 .0105     .036   .045   .034   .022   .008   .003   .000
O6    .2074  .0108 .3822     .036   .035   .040   .028  -.002   .006  -.005
O7    .1987 -.5111 .3821     .031   .043   .027   .021  -.004   .010  -.002
OH8   .1285 -.2671 .2010     .036   .043   .045   .018  -.002   .011   .007
O9    .1777  .2548 .2188     .036   .041   .037   .024   .005   .006  -.008
O10   .2241 -.2125 .1557     .034   .025   .040   .036   .006   .009   .003
OH11  .0753  .1330 .0676     .038   .033   .041   .036   .004   .007   .004
Wat12 .0232 -.2897 .1075     .036   .048   .037   .025  -.004   .014   .008
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Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Carlhintzeite
Download hom/carlhintzeite.pdf
Kampf A R, Colombo F, Gonzalez del Tanago J
 
Mineralogical Magazine 74 (2010) 623-632
Carlhintzeite, Ca2AlF7*H2O, from the Gigante granitic pegmatite,
Cordoba province, Argentina: description and crystal structure
Locality: Gigante pegmatite, Punilla Department, Cordoba Province, Argentina
_database_code_amcsd 0017800
9.4227 6.9670 9.2671 90.974 104.802 90.026 C-1
atom      x      y      z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ca1  .58447 .99988 .35406 .0124  .0111  .0142  .0121  .0001  .0035  .0003
Ca2  .15860 .00061 .20308 .0132  .0111  .0156  .0125  .0004  .0024  .0009
Al1      .5      0      0 .0118  .0120  .0153  .0082 -.0004  .0028  .0001
Al2       0      0     .5 .0104  .0082  .0137  .0096  .0009  .0028  .0009
F1    .3830  .0293  .1242 .0234  .0166  .0413  .0136 -.0004  .0063  .0000
F2    .6195  .1794  .1143 .0192  .0187  .0180  .0187 -.0001  .0010 -.0020
F3    .6020  .8208  .1247 .0178  .0226  .0137  .0145  .0013  .0002  .0008
F4    .8251  .0012  .3695 .0219  .0099  .0401  .0147  .0016  .0015  .0015
F5    .5654  .6760  .3878 .0169  .0235  .0136  .0173 -.0009  .0119  .0015
F6    .5626  .3232  .3821 .0175  .0235  .0158  .0162 -.0005  .0106 -.0003
F7    .3564  .9934  .3963 .0186  .0111  .0323  .0122  .0001  .0024  .0018
OWat  .8927  .9824  .0868 .0224  .0161  .0332  .0176 -.0001  .0036  .0019
H1     .852   .091   .104  .050
H2     .845   .882   .108  .050
Download AMC data (View Text File)
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View JMOL 3-D Structure
 
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Total number of retrieved datasets: 3
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