American Mineralogist Crystal Structure Database

2 matching records for this search.

Holtedahlite
Download hom/holtedahlite.pdf
Romming C, Raade G
 
Mineralogy and Petrology 40 (1989) 91-100
The crystal structure of natural and synthetic holtedahlite
Locality: Tingelstadtjern serpentine-magnesium deposit, Modum, Norway
_database_code_amcsd 0014621
11.203 11.203 4.977 90 90 120 P31m
atom      x      y      z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Mg1  .67060 .14796      0     .011  .0061  .0108  .0105  .0015  .0005 -.0029
Mg2  .82494 .14560  .5032     .008  .0066  .0058  .0085  .0027  .0002  .0000
P1        0      0  .7273 .76 .006  .0039  .0039  .0102  .0019      0      0
C1        0      0   .615 .24 .007  .0039  .0039  .0102  .0019      0      0
P2      2/3    1/3  .4786     .005  .0046  .0046  .0055  .0023      0      0
P3   .66114 .66114  .0289     .005  .0038  .0038  .0061  .0022 -.0002 -.0002
O1    .1255  .1255  .6261     .015  .0097  .0097  .0217  .0056  .0033  .0033
O2    .7214  .2395  .3662     .010  .0094  .0086  .0086  .0057 -.0010 -.0014
O3    .7329  .7329  .2929     .010  .0092  .0092  .0089  .0062 -.0021 -.0021
O4    .8707  .2438  .8635     .009  .0061  .0094  .0085  .0022 -.0014 -.0014
O5    .5273  .5273  .0947     .010  .0060  .0060  .0159  .0014  -.003 -.0002
O6      2/3    1/3  .7986     .013  .0120  .0120  .0113   .006      0      0
OH1   .3713  .3713  .6918     .010  .0094  .0094  .0093  .0054  .0002  .0001
OH2   .2797  .2797  .1939     .010  .0094  .0094  .0082  .0051 -.0024 -.0023
OH3       0      0   .038 .76 .033  .0039  .0039  .0009  .0019      0      0
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Holtedahlite
Download hom/holtedahlite.pdf
Romming C, Raade G
 
Mineralogy and Petrology 40 (1989) 91-100
The crystal structure of natural and synthetic holtedahlite
Locality: synthetic
_database_code_amcsd 0014622
11.186 11.186 4.977 90 90 120 P31m
atom     x     y     z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Mg1  .6705 .1461     0 .015  .0087  .0176  .0119  .0047  .0004 -.0044
Mg2  .8246 .1457 .5065 .008  .0073  .0051  .0080  .0027 -.0011 -.0007
P1       0     0 .7287 .006  .0048  .0048  .0081  .0024      0      0
P2   .6667 .3333 .4781 .006  .0051  .0051  .0051  .0025      0      0
P3   .6609 .6609 .0323 .005  .0042  .0042  .0050  .0019  .0002  .0001
O1   .1285 .1285 .6340 .013   .007   .007   .025   .004   .003   .003
O2   .7207 .2409 .3685 .011   .011   .009   .009   .007   .000   .000
O3   .7326 .7326 .2973 .010   .009   .009   .008   .005  -.005  -.005
O4   .8706 .2440 .8674 .009   .007   .009   .007   .002  -.001   .000
O5   .5280 .5280 .0981 .010   .006   .006   .015   .001   .000   .000
O6   .6667 .3333 .7893 .016   .019   .019   .004  .0095      0      0
Oh1  .3727 .3727 .6898 .009   .008   .008   .007   .002   .001   .001
Oh2  .2805 .2805 .1975 .013   .013   .013   .009   .008  -.001  -.001
OH3      0     0  .044 .036   .042   .042   .011   .021      0      0
H1    .438  .438  .632 .019
H2    .229  .229  .183 .019
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: 2
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