American Mineralogist Crystal Structure Database

3 matching records for this search.

Nambulite
Download hom/nambulite.pdf
Nagashima M, Armbruster T, Kolitsch U, Pettke T
 
American Mineralogist 99 (2014) 1462-1470
The relation between Li <-> Na substitution and hydrogen bonding in five-periodic
single-chain silicates nambulite and marsturite: A single-crystal X-ray study
Locality: Fianel mine, Grisons, Switzerland
_database_code_amcsd 0020222
7.5391 11.7475 6.7137 93.024 95.147 106.266 P-1
atom      x      y      z  occ   Uiso U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3)  U(2,3)
NaM5  .6726  .1108  .3628 .275   .055   .051   .050   .058   -.001    .042   -.007
LiM5  .6726  .1108  .3628 .725   .055   .051   .050   .058   -.001    .042   -.007
MnM1 .59457 .65350 .06068      .00995  .0078  .0104  .0102  .00042  .00033  .00035
MnM2 .81481 .94088 .12908      .01211  .0117  .0104  .0133  .00242 -.00005 -.00034
MnM3 .03859 .23512 .18048  .81 .00978  .0081  .0082  .0117  .00076 -.00016 -.00025
MgM3 .03859 .23512 .18048  .19 .00978  .0081  .0082  .0117  .00076 -.00016 -.00025
MnM4 .24687 .51374 .26525  .90 .01218  .0087  .0118  .0131 -.00067 -.00134 -.00137
CaM4 .24687 .51374 .26525  .10 .01218  .0087  .0118  .0131 -.00067 -.00134 -.00137
Si1  .28019 .05957 .35765      .00960  .0087  .0073  .0108   .0002  -.0015  -.0002
Si2  .47475 .32697 .42820      .00699  .0063  .0054  .0078  -.0002  -.0004   .0002
Si3  .81894 .45595 .22172      .00653  .0041  .0057  .0086  -.0004  -.0002   .0012
Si4  .00894 .72550 .30111      .00798  .0067  .0063  .0096   .0003  -.0007  -.0001
Si5  .35105 .85360 .11409      .00694  .0048  .0071  .0082   .0012  -.0006  -.0009
O1    .1991  .0096  .5608       .0149  .0146  .0150  .0123  -.0007   .0013   .0030
O2    .1205  .0682  .1861       .0120  .0092  .0115  .0134   .0021  -.0039  -.0011
O3    .4468  .1830  .4173       .0127  .0124  .0058  .0167  -.0008  -.0032  -.0008
O4    .3288  .3497  .2544       .0093  .0074  .0097  .0101   .0017  -.0011   .0003
O5    .5290  .6165  .3520       .0117  .0111  .0137  .0082   .0008   .0005  -.0021
O6    .6941  .3839  .3879       .0132  .0064  .0155  .0158  -.0006   .0013   .0069
O7    .9797  .3976  .1737       .0124  .0099  .0129  .0156   .0053   .0024   .0004
O8    .6806  .4708  .0339       .0098  .0066  .0108  .0099   .0001  -.0025   .0004
O9    .9330  .5859  .3363       .0138  .0168  .0055  .0138  -.0032  -.0056   .0008
O10   .8813  .7671  .1307       .0103  .0076  .0100  .0134   .0030  -.0010   .0018
O11  -.0241  .2026  .4827       .0157  .0249  .0090  .0121   .0031   .0025  -.0006
O12   .2178  .7457  .2282       .0143  .0077  .0184  .0161   .0020   .0015   .0058
O13   .5376  .8233  .0693       .0120  .0081  .0100  .0178   .0021   .0020   .0019
O14   .7653  .1196  .0847       .0109  .0084  .0116  .0112   .0013  -.0030   .0017
O15   .3996  .9728  .2753       .0137  .0120  .0107  .0167   .0036  -.0041  -.0065
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View JMOL 3-D Structure (permalink)
 
Nambulite
Download hom/nambulite.pdf
Nagashima M, Armbruster T, Kolitsch U, Pettke T
 
American Mineralogist 99 (2014) 1462-1470
The relation between Li <-> Na substitution and hydrogen bonding in five-periodic
single-chain silicates nambulite and marsturite: A single-crystal X-ray study
Locality: Gozaisho mine, Iwaki, Japan
_database_code_amcsd 0020223
7.5372 11.7267 6.7078 93.057 95.147 106.240 P-1
atom      x      y      z  occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2)  U(1,3)  U(2,3)
NaM5  .6665  .1202  .3488 .179  .0432   .043   .058   .045  .0300   .0296   .0217
LiM5  .6665  .1202  .3488 .821  .0432   .043   .058   .045  .0300   .0296   .0217
MnM1 .59473 .65395 .06110      .00945 .00884 .00998 .00884 .00150  .00118  .00067
MnM2 .81507 .94164 .12933      .00930 .00988 .00879 .00908 .00231  .00179  .00018
MnM3 .03828 .23486 .17946  .74 .00942 .00901 .00867 .01043 .00235  .00100  .00049
MgM3 .03828 .23486 .17946  .26 .00942 .00901 .00867 .01043 .00235  .00100  .00049
MnM4 .24670 .51372 .26589  .95 .01148 .00960 .01167 .01110 .00033 -.00033 -.00033
CaM4 .24670 .51372 .26589  .05 .01148 .00960 .01167 .01110 .00033 -.00033 -.00033
Si1  .27910 .05960 .35814      .00649  .0068  .0058 .00664 .00153  .00002  .00030
Si2  .47395 .32678 .42779      .00658  .0069  .0062  .0060 .00096  .00016  .00066
Si3  .81858 .45512 .22094      .00666  .0060  .0066  .0073 .00151  .00075  .00131
Si4  .00911 .72515 .30072      .00685  .0068  .0061  .0072 .00126  .00038  .00060
Si5  .35079 .85358 .11427      .00665  .0062  .0072 .00669 .00233  .00052  .00023
O1   .20002 .00859 .56108       .0117  .0128  .0125  .0080  .0006   .0016   .0017
O2   .12134 .06896 .18570       .0090  .0084  .0111  .0079  .0037   .0000   .0007
O3   .44631 .18254  .4172       .0105  .0111  .0061  .0128  .0006  -.0013   .0006
O4   .32764 .34914 .25387       .0091  .0089  .0099  .0084  .0031  -.0005   .0011
O5   .53014 .61611 .35240       .0107  .0129  .0113  .0076  .0032   .0012  -.0010
O6   .69321 .38359  .3878       .0114  .0078  .0134  .0125  .0012   .0020   .0063
O7   .97941 .39692  .1734       .0127  .0110  .0137  .0152  .0061   .0024   .0013
O8   .67970 .46980  .0335       .0103  .0090  .0128  .0081  .0022  -.0013   .0017
O9   .93241 .58563  .3368       .0126  .0151  .0061  .0130 -.0014  -.0035   .0015
O10  .88200 .76755  .1304       .0096  .0085  .0106  .0102  .0037   .0002   .0020
O11  -.0227 .20339  .4825       .0147  .0244  .0092  .0091  .0023   .0032  -.0008
O12  .21798 .74572  .2299       .0113  .0074  .0138  .0133  .0030   .0023   .0051
O13  .53802 .82382  .0706       .0097  .0079  .0087  .0132  .0033   .0028   .0005
O14  .76642 .12076 .08387       .0100  .0104  .0106  .0090  .0035  -.0009   .0019
O15  .39871 .97295  .2733       .0114  .0111  .0115  .0121  .0058  -.0015  -.0031
H11   -.107  .1242   .494        .050
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Nambulite
Download hom/nambulite.pdf
Narita H, Koto K, Morimoto N, Yoshii M
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-7681&volume=31&spage=2422
Acta Crystallographica B31 (1975) 2422-2426
The crystal structure of nambulite (Li,Na)Mn4Si5O14(OH)
_database_code_amcsd 0009545
7.621 11.761 6.731 92.767 95.083 106.867 P-1
atom      x     y     z occ Biso
LiM5  .6751 .1432 .3681 .55 1.16
NaM5  .6751 .1432 .3681 .45 1.16
MnM1  .5912 .6514 .0631      .26
MnM2  .8103 .9417 .1258      .28
MnM3  .0407 .2354 .1759      .49
MnM4  .2433 .5143 .2645      .76
Si1   .2720 .0599 .3592      .91
Si2   .4698 .3291 .4275      .92
Si3   .8152 .4539 .2202      .87
Si4   .0008 .7244 .3034      .82
Si5   .3454 .8545 .1203      .94
O1    .1880 .0074 .5595     1.37
O2    .1194 .0699 .1845      .95
O3    .4254 .1847 .4257     1.55
O4    .3276 .3521 .2517     1.12
O5    .5379 .6123 .3542     1.19
O6    .6878 .3757 .3806     1.10
O7    .9767 .3973 .1736     1.36
O8    .6812 .4695 .0341     1.03
O9    .9246 .5832 .3399     1.17
O10   .8758 .7658 .1325     1.07
O11  -.0138 .2042 .4830     1.28
O12   .2109 .7451 .2357     1.36
O13   .5313 .8234 .0776     1.11
O14   .7675 .1196 .0748     1.15
O15   .3935 .9729 .2811     1.07
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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