American Mineralogist Crystal Structure Database

3 matching records for this search.

Sadanagaite
Download hom/sadanagaite.pdf
Banno Y, Miyawaki R, Matsubara S, Makino K, Bunno M, Yamada S, Kamiya T
 
European Journal of Mineralogy 16 (2004) 177-183
Magnesiosadanagaite, a new member of the amphibole group
from Kasuga-mura, Gifu Prefecture, central Japan
Sample: GSJ M35151-1
Locality: Kasuga-mura, Gifu Prefecture, central Japan
_database_code_amcsd 0007034
9.869 17.933 5.322 90 105.29 90 C2/m
atom      x      y      z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
NaA2      0  .4776      0 .455  .068   .058   .080   .087      0   .057      0
KA2       0  .4776      0 .045  .068   .058   .080   .087      0   .057      0
Mg1       0 .08999     .5  .81 .0079  .0111  .0064  .0078      0  .0053      0
Fe1       0 .08999     .5  .19 .0079  .0111  .0064  .0078      0  .0053      0
Al2       0 .17726      0  .49 .0104  .0121  .0090  .0109      0  .0047      0
Mg2       0 .17726      0 .265 .0104  .0121  .0090  .0109      0  .0047      0
Ti2       0 .17726      0  .15 .0104  .0121  .0090  .0109      0  .0047      0
Fe2       0 .17726      0 .095 .0104  .0121  .0090  .0109      0  .0047      0
Mg3       0      0      0  .75 .0080  .0106  .0061  .0081      0  .0039      0
Fe3       0      0      0  .25 .0080  .0106  .0061  .0081      0  .0039      0
Ca4       0 .28122     .5 .975 .0109  .0152  .0076  .0124      0  .0078      0
Na4       0 .28122     .5 .015 .0109  .0152  .0076  .0124      0  .0078      0
Mn4       0 .28122     .5  .01 .0109  .0152  .0076  .0124      0  .0078      0
Si1  .27999 .08616 .30473  .49 .0077  .0092  .0056  .0089 -.0008  .0036  .0002
Al1  .27999 .08616 .30473  .51 .0077  .0092  .0056  .0089 -.0008  .0036  .0002
Si2  .29136 .17386 .81769  .86 .0080  .0098  .0060  .0096  .0003  .0050  .0002
Al2  .29136 .17386 .81769  .14 .0080  .0098  .0060  .0096  .0003  .0050  .0002
O1    .1050 .09056  .2122      .0132  .0123  .0173  .0113 -.0040  .0054 -.0011
O2    .1182 .17486  .7402      .0108  .0115  .0087  .0128  .0010  .0039  .0010
O3    .1083      0  .7139 .935 .0112  .0104  .0088  .0149      0  .0042      0
F3    .1083      0  .7139 .065 .0112  .0104  .0088  .0149      0  .0042      0
O4    .3700 .25190  .7921      .0126  .0171  .0083  .0147 -.0011  .0081  .0007
O5    .3522 .14168  .1176      .0130  .0136  .0110  .0154 -.0008  .0056  .0021
O6    .3425 .11659  .6141      .0143  .0125  .0136  .0172  .0009  .0044 -.0039
O7    .3368      0  .2715      .0154  .0164  .0122  .0188      0  .0068      0
H      .173      0    .85 .935   .15
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Sadanagaite
Download hom/sadanagaite.pdf
Banno Y, Miyawaki R, Matsubara S, Makino K, Bunno M, Yamada S, Kamiya T
 
European Journal of Mineralogy 16 (2004) 177-183
Magnesiosadanagaite, a new member of the amphibole group
from Kasuga-mura, Gifu Prefecture, central Japan
Sample: GSJ M35151-2
Locality: Kasuga-mura, Gifu Prefecture, central Japan
_database_code_amcsd 0007035
9.906 17.971 5.3190 90 105.48 90 C2/m
atom        x      y      z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
NaA2/m      0     .5      0  .73  .111   .063   .205   .089      0   .062      0
KA2/m       0     .5      0  .27  .111   .063   .205   .089      0   .062      0
Mg1         0 .08973     .5  .83 .0074  .0085  .0085  .0062      0  .0040      0
Fe1         0 .08973     .5  .17 .0074  .0085  .0085  .0062      0  .0040      0
Al2         0 .17709      0  .43 .0113  .0119  .0113  .0117      0  .0047      0
Mg2         0 .17709      0  .30 .0113  .0119  .0113  .0117      0  .0047      0
Ti2         0 .17709      0 .145 .0113  .0119  .0113  .0117      0  .0047      0
Fe2         0 .17709      0 .125 .0113  .0119  .0113  .0117      0  .0047      0
Mg3         0      0      0  .81 .0056  .0075  .0050  .0042      0  .0011      0
Fe3         0      0      0  .19 .0056  .0075  .0050  .0042      0  .0011      0
Ca4         0 .28089     .5 .985 .0096  .0109  .0089  .0109      0  .0062      0
Mn4         0 .28089     .5  .01 .0096  .0109  .0089  .0109      0  .0062      0
Na4         0 .28089     .5 .005 .0096  .0109  .0089  .0109      0  .0062      0
Si1    .27942 .08595 .30443 .525 .0066  .0062  .0069  .0069 -.0008  .0022  .0000
Al1    .27942 .08595 .30443 .475 .0066  .0062  .0069  .0069 -.0008  .0022  .0000
Si2    .29054 .17353 .81600  .84 .0068  .0072  .0069  .0070  .0000  .0032  .0003
Al2    .29054 .17353 .81600  .16 .0068  .0072  .0069  .0070  .0000  .0032  .0003
O1     .10562 .08934  .2147      .0119  .0095  .0165  .0099 -.0025  .0030 -.0007
O2     .11888 .17438  .7371      .0101  .0076  .0124  .0099  .0004  .0013  .0014
O3      .1088      0  .7157  .95 .0140  .0162  .0119  .0141      0  .0044      0
F3      .1088      0  .7157 .035 .0140  .0162  .0119  .0141      0  .0044      0
Cl3     .1088      0  .7157 .015 .0140  .0162  .0119  .0141      0  .0044      0
O4     .36869 .25114  .7914      .0112  .0135  .0094  .0125 -.0009  .0066  .0001
O5     .35101 .14053  .1155      .0122  .0115  .0141  .0114  .0003  .0036  .0049
O6     .34361 .11710  .6125      .0131  .0102  .0150  .0142  .0003  .0036 -.0043
O7      .3372      0  .2766      .0159  .0115  .0149  .0192      0  .0006      0
H        .189      0   .750  .95  .000
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Wadalite
 
Tsukimura K, Kanazawa Y, Aoki M, Bunno M
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-2701&volume=49&spage=205
Acta Crystallographica C49 (1993) 205-207
Structure of wadalite Ca6Al5Si2O16Cl3
Note: the values for the anisoU's are from ICSD
_database_code_amcsd 0010280
12.001 12.001 12.001 90 90 90 I-43d
atom      x      y      z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ca    .1043      0    .25 .96 .0086  .0082  .0092  .0084      0      0  .0110
Mg    .1043      0   .250 .04 .0086  .0082  .0092  .0084      0      0  .0110
AlT1 -.0169 -.0169 -.0169 .60 .0065  .0065  .0065  .0065  .0005  .0005  .0005
SiT1 -.0169 -.0169 -.0169 .28 .0065  .0065  .0065  .0065  .0005  .0005  .0005
FeT1 -.0169 -.0169 -.0169 .12 .0065  .0065  .0065  .0065  .0005  .0005  .0005
AlT2   .375      0    .25 .68 .0066  .0016  .0090  .0090      0      0      0
SiT2   .375      0    .25 .32 .0066  .0016  .0090  .0090      0      0      0
O1    .0628  .0628  .0628     .0178  .0178  .0178  .0178  .0096  .0096  .0096
O2    .0308  .0500  .6488     .0120  .0088  .0122  .0151  .0020  .0014 -.0005
Cl     .125     .5    .25 .92 .0189  .0078  .0244  .0244      0      0      0
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Total number of retrieved datasets: 3
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