American Mineralogist Crystal Structure Database

2 matching records for this search.

Phengite
 
Smyth J R, Jacobsen S D, Swope R J, Angel R J, Arlt T, Domanik K, Holloway J R
 
European Journal of Mineralogy 12 (2000) 955-963
Crystal structures and compressibilities of synthetic 2M_1 and 3T phengite micas
Sample: synthetic 2M_1
_database_code_amcsd 0006844
5.2046 9.0368 19.886 90 95.615 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)
K        0  .0936    .25 .964 .0314  .0303  .0271   .037      0  .0027      0
AlM2 .2463 .08152 .00008 .588 .0144  .0167  .0116  .0146  .0002  .0004  .0005
MgM2 .2463 .08152 .00008 .365 .0144  .0167  .0116  .0146  .0002  .0004  .0005
FeM2 .2463 .08152 .00008 .019 .0144  .0167  .0116  .0146  .0002  .0004  .0005
SiT1 .4619 .92804 .13519 .952 .0135  .0151  .0093  .0160 -.0003  .0009  .0002
AlT1 .4619 .92804 .13519 .048 .0135  .0151  .0093  .0160 -.0003  .0009  .0002
SiT2 .4524 .25805 .13522 .952 .0140  .0145  .0121  .0153 -.0003  .0009  .0002
AlT2 .4524 .25805 .13522 .048 .0140  .0145  .0121  .0153 -.0003  .0009  .0002
O1   .4601  .0931 .16892      .0187  .0235  .0124  .0201 -.0005  .0017  .0009
O2   .2253  .8349 .16261      .0179  .0129  .0198  .0211 -.0038  .0021 -.0004
O3   .2256  .3478 .16924      .0193  .0209  .0200  .0167  .0046  .0007 -.0011
O4   .4530  .9349 .05491      .0182  .0183  .0198  .0166 -.0020  .0019  .0002
O5   .4016  .2513 .05458      .0176  .0184  .0186  .0152 -.0003 -.0015  .0020
Oh6  .4555  .5661 .05460   .6 .0261  .0354  .0205  .0228  .0067  .0043 -.0013
F6   .4555  .5661 .05460   .4 .0261  .0354  .0205  .0228  .0067  .0043 -.0013
H     .395   .634   .058   .6  .023
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View JMOL 3-D Structure
 
Phengite
 
Smyth J R, Jacobsen S D, Swope R J, Angel R J, Arlt T, Domanik K, Holloway J R
 
European Journal of Mineralogy 12 (2000) 955-963
Crystal structures and compressibilities of synthetic 2M_1 and 3T phengite micas
Sample: synthetic 3T
_database_code_amcsd 0006845
5.2110 5.2110 29.689 90 90 120 P3_112
atom      x       y      z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
K     .1239   .2477    1/6      .0347  .0280   .038  .0413  .0191 -.0018      0
AlM2 -.1975 -.09875      0 .403 .0124  .0122  .0122  .0128  .0061      0 -.0006
MgM2 -.1975 -.09875      0  .25 .0124  .0122  .0122  .0128  .0061      0 -.0006
FeM2 -.1975 -.09875      0 .013 .0124  .0122  .0122  .0128  .0061      0 -.0006
AlM3  .4550   .2275      0 .403 .0175   .015  .0131   .025  .0075      0   .001
MgM3  .4550   .2275      0  .25 .0175   .015  .0131   .025  .0075      0   .001
FeM3  .4550   .2275      0 .013 .0175   .015  .0131   .025  .0075      0   .001
SiT1  .7900   .5815  .0903 .952 .0159  .0182  .0219  .0069  .0106 -.0012  .0005
AlT1  .7900   .5815  .0903 .048 .0159  .0182  .0219  .0069  .0106 -.0012  .0005
SiT2  .4714   .9221  .0900 .952 .0115  .0014  .0014   .029 -.0011 -.0011 -.0009
AlT2  .4714   .9221  .0900 .048 .0115  .0014  .0014   .029 -.0011 -.0011 -.0009
O1    .7564   .5698  .0361       .016   .008   .008   .022  -.004   .001   .001
O2    .4973   .9267  .0367       .019   .018   .011   .018  -.001  -.000   .005
O3    .6411   .7568  .1129       .021   .016   .028   .026   .016  -.002  -.003
O4    .1273   .7350  .1092       .017   .015   .015   .021  -.011   .001   .001
O5     .616    .252  .1124       .025   .042   .030   .021   .032  -.002  -.001
Oh6    .133    .198  .0363   .6  .024   .032   .029   .023   .022  -.002  -.003
F6     .133    .198  .0363   .4  .024   .032   .029   .023   .022  -.002  -.003
H      .076    .280   .039   .6   .03
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
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Total number of retrieved datasets: 2
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