American Mineralogist Crystal Structure Database

6 matching records for this search.

Heterosite
Download hom/heterosite.pdf
Eventoff W, Martin R, Peacor D R
Download am/vol57/AM57_45.pdf
American Mineralogist 57 (1972) 45-51
The crystal structure of heterosite
Locality: Fletcher Quarry, North Groton, New Hampshire, USA
_database_code_amcsd 0000269
5.83 9.79 4.769 90 90 90 Pmnb
atom     x     y     z occ B(1,1) B(2,2) B(3,3) B(1,2)  B(1,3)  B(2,3)
Fe     .25 .2770 .9449 .65  .0035  .0008  .0047      0       0  -.0007
Mn     .25 .2770 .9449 .35  .0035  .0008  .0047      0       0  -.0007
P      .25 .0935 .3983      .0038  .0009  .0020      0       0   .0001
O1     .25 .1176 .7131      .0072  .0020  .0072      0       0   .0015
O2     .25 .4417 .1614      .0068  .0026  .0046      0       0   .0018
O3   .0461 .1684 .2513      .0049  .0019  .0040  .0010  -.0004  -.0003
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Orthoclase
Download hom/orthoclase.pdf
Prince E, Donnay G, Martin R F
Download am/vol58/AM58_500.pdf
American Mineralogist 58 (1973) 500-507
Neutron diffraction refinement of an ordered orthoclase structure
_database_code_amcsd 0000320
8.5632 12.963 7.2099 90 116.073 90 C2/m
atom      x     y     z occ  U(1,1)  U(2,2)  U(3,3)   U(1,2)  U(1,3)   U(2,3)
Si1   .0095 .1842 .2247  .5 .017478 .012538 .011905 -.002913 .007472 -.001900
Al1   .0095 .1842 .2247  .5 .017478 .012538 .011905 -.002913 .007472 -.001900
Si2   .7085 .1176 .3446     .017478 .012032 .013932  .000253 .006966  .000380
K     .2840     0 .1388     .018998 .030396 .025330        0 .006586        0
OA(1)     0 .1451     0     .026977 .019504 .023810        0 .012032        0
OA(2) .6365     0 .2853     .024570 .012285 .019378        0 .004179        0
OB    .8256 .1459 .2279     .027610 .031030 .028243 -.003040 .018618  .002026
OC    .0353 .3118 .2599     .021024 .017731 .022164 -.003800 .008106 -.004559
OD    .1818 .1252 .4080     .024190 .020264 .012665  .001773 .002913  .001646
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Tremolite
Download hom/tremolite.pdf
Hawthorne F C, Oberti R, Martin R F
Download cm/vol44/CM44_1171.pdf
The Canadian Mineralogist 44 (2006) 1171-1179
Short-range order in amphiboles from the Bear Lake diggings, Ontario
Locality: Bear Lake diggings, Bancroft area of Ontario, Canada
Sample: 757
_database_code_amcsd 0006113
9.868 18.033 5.273 90 104.66 90 C2/m
atom        x      y      z  occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
NaAm    .0361     .5  .0828 .405       .0087  .0020  .0236      0  .0081      0
MgM1        0 .08819     .5 .965       .0016  .0003  .0034      0  .0009      0
Fe2+M1      0 .08819     .5 .035       .0016  .0003  .0034      0  .0009      0
MgM2        0 .17786      0 .915       .0013  .0003  .0037      0  .0006      0
Fe2+M2      0 .17786      0 .075       .0013  .0003  .0037      0  .0006      0
Mn2+M2      0 .17786      0  .01       .0013  .0003  .0037      0  .0006      0
MgM3        0      0      0  .94       .0017  .0004  .0035      0  .0004      0
Fe2+M3      0      0      0  .03       .0017  .0004  .0035      0  .0004      0
AlM3        0      0      0  .03       .0017  .0004  .0035      0  .0004      0
CaM4        0 .27767     .5 .815       .0025  .0004  .0078      0  .0029      0
NaM4        0 .27767     .5 .185       .0025  .0004  .0078      0  .0029      0
SiT1   .27939 .08429 .29682            .0012  .0003  .0030      0  .0004 -.0001
SiT2   .28757 .17119 .80386            .0013  .0003  .0030 -.0001  .0006  .0000
O1     .11174 .08580 .21765            .0012  .0004  .0044      0  .0005 -.0001
O2     .11886 .17044 .72518            .0016  .0005  .0043 -.0001  .0010 -.0001
F3     .10801      0 .71486  .29       .0023  .0005  .0066      0  .0007      0
OH3    .10801      0 .71486  .71       .0023  .0005  .0066      0  .0007      0
O4     .36382 .24797 .79421            .0026  .0004  .0054 -.0004  .0013 -.0002
O5     .34598 .13269 .09692            .0016  .0006  .0048 -.0001  .0006  .0006
O6     .34304 .11829 .58939            .0018  .0005  .0051  .0001  .0006 -.0006
O7     .33680      0 .29379            .0023  .0003  .0099      0  .0011      0
H        .195      0   .775        .4
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Tremolite
Download hom/tremolite.pdf
Hawthorne F C, Oberti R, Martin R F
Download cm/vol44/CM44_1171.pdf
The Canadian Mineralogist 44 (2006) 1171-1179
Short-range order in amphiboles from the Bear Lake diggings, Ontario
Locality: Bear Lake diggings, Bancroft area of Ontario, Canada
Sample: 721
_database_code_amcsd 0006114
9.888 18.022 5.290 90 104.72 90 C2/m
atom        x      y      z  occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
NaAm    .0429     .5  .0948 .255       .0053  .0021  .0208      0  .0051      0
KAm     .0429     .5  .0948  .15       .0053  .0021  .0208      0  .0051      0
MgM1        0 .08908     .5 .835       .0021  .0005  .0060      0  .0012      0
Fe2+M1      0 .08908     .5 .165       .0021  .0005  .0060      0  .0012      0
MgM2        0 .17910      0 .475       .0019  .0005  .0072      0  .0012      0
Fe3+M2      0 .17910      0  .22       .0019  .0005  .0072      0  .0012      0
Fe2+M2      0 .17910      0  .23       .0019  .0005  .0072      0  .0012      0
Mn2+M2      0 .17910      0 .025       .0019  .0005  .0072      0  .0012      0
Ti4+M2      0 .17910      0  .03       .0019  .0005  .0072      0  .0012      0
AlM2        0 .17910      0  .02       .0019  .0005  .0072      0  .0012      0
MgM3        0      0      0  .81       .0021  .0004  .0057      0  .0007      0
Fe2+M3      0      0      0  .17       .0021  .0004  .0057      0  .0007      0
LiM3        0      0      0  .02       .0021  .0004  .0057      0  .0007      0
CaM4        0 .27800     .5 .615       .0034  .0006  .0120      0  .0037      0
NaM4        0 .27800     .5 .385       .0034  .0006  .0120      0  .0037      0
SiT1   .27994 .08484 .29855 .845       .0017  .0004  .0054      0  .0007  .0000
AlT1   .27994 .08484 .29855 .155       .0017  .0004  .0054      0  .0007  .0000
SiT2   .28855 .17151 .80566            .0017  .0004  .0055 -.0001  .0009  .0000
O1     .11024 .08651 .21762            .0021  .0006  .0066 -.0002  .0011 -.0001
O2     .11935 .17063 .72816            .0018  .0007  .0074      0  .0010 -.0001
F3     .10643      0 .71326 .605       .0029  .0006  .0102      0  .0015      0
OH3    .10643      0 .71326 .395       .0029  .0006  .0102      0  .0015      0
O4     .36385 .24892 .79370            .0033  .0006  .0099 -.0004  .0021 -.0002
O5     .34756 .13323 .09709            .0024  .0011  .0088  .0001  .0011  .0012
O6     .34333 .11807 .59368            .0024  .0008  .0103  .0001  .0010 -.0008
O7     .33854      0 .29273            .0029  .0006  .0159      0  .0011  .0000
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View JMOL 3-D Structure
 
Magnesiokatophorite
Download hom/magnesiokatophorite.pdf
Hawthorne F C, Oberti R, Martin R F
Download cm/vol44/CM44_1171.pdf
The Canadian Mineralogist 44 (2006) 1171-1179
Short-range order in amphiboles from the Bear Lake diggings, Ontario
Locality: Bear Lake diggings, Bancroft area of Ontario, Canada
Sample: 761
_database_code_amcsd 0006115
9.866 18.019 5.274 90 104.58 90 C2/m
atom        x      y      z  occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
NaAm    .0415     .5  .0909  .16       .0035  .0022  .0205      0  .0061      0
KAm     .0415     .5  .0909  .09       .0035  .0022  .0205      0  .0061      0
MgM1        0 .08845     .5  .97       .0016  .0004  .0037      0  .0010      0
Fe2+M1      0 .08845     .5  .03       .0016  .0004  .0037      0  .0010      0
MgM2        0 .17821      0  .90       .0015  .0005  .0051      0  .0010      0
Fe3+M2      0 .17821      0  .06       .0015  .0005  .0051      0  .0010      0
Fe2+M2      0 .17821      0  .03       .0015  .0005  .0051      0  .0010      0
Mn2+M2      0 .17821      0 .005       .0015  .0005  .0051      0  .0010      0
AlM2        0 .17821      0 .005       .0015  .0005  .0051      0  .0010      0
MgM3        0      0      0  .97       .0016  .0003  .0034      0  .0007      0
Fe2+M3      0      0      0  .03       .0016  .0003  .0034      0  .0007      0
CaM4        0 .27741     .5  .73       .0029  .0006  .0096      0  .0034      0
NaM4        0 .27741     .5  .27       .0029  .0006  .0096      0  .0034      0
SiT1   .27948 .08442 .29672 .975       .0012  .0003  .0032      0  .0005      0
AlT1   .27948 .08442 .29672 .025       .0012  .0003  .0032      0  .0005      0
SiT2   .28752 .17133 .80369            .0011  .0004  .0031 -.0001  .0007 -.0001
O1     .11141 .08574 .21758            .0013  .0004  .0041 -.0001  .0008 -.0001
O2     .11874 .17024 .72576            .0012  .0006  .0046 -.0001  .0009 -.0002
F3     .10729      0 .71471 .355       .0021  .0006  .0063      0  .0011      0
OH3    .10729      0 .71471 .645       .0021  .0006  .0063      0  .0011      0
O4     .36368 .24830 .79410            .0024  .0005  .0063 -.0004  .0015 -.0002
O5     .34668 .13244 .09605            .0022  .0009  .0065 -.0001  .0011  .0008
O6     .34321 .11793 .58993            .0018  .0007  .0050      0  .0008 -.0007
O7     .33787      0 .29323            .0019  .0004  .0104      0  .0009      0
H        .190      0   .794       1.8
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Magnesiokatophorite
Download hom/magnesiokatophorite.pdf
Hawthorne F C, Oberti R, Martin R F
Download cm/vol44/CM44_1171.pdf
The Canadian Mineralogist 44 (2006) 1171-1179
Short-range order in amphiboles from the Bear Lake diggings, Ontario
Locality: Bear Lake diggings, Bancroft area of Ontario, Canada
Sample: 762
_database_code_amcsd 0006116
9.887 18.023 5.292 90 104.66 90 C2/m
atom        x      y      z  occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
NaAm    .0422     .5  .0936 .255       .0054  .0022  .0203      0  .0047      0
KAm     .0422     .5  .0936  .16       .0054  .0022  .0203      0  .0047      0
MgM1        0 .08890     .5  .81       .0019  .0005  .0044      0  .0010      0
Fe2+M1      0 .08890     .5  .19       .0019  .0005  .0044      0  .0010      0
MgM2        0 .17925      0 .435       .0014  .0005  .0056      0  .0011      0
Fe3+M2      0 .17925      0  .21       .0014  .0005  .0056      0  .0011      0
Fe2+M2      0 .17925      0 .255       .0014  .0005  .0056      0  .0011      0
Mn2+M2      0 .17925      0 .025       .0014  .0005  .0056      0  .0011      0
Ti4+M2      0 .17925      0  .04       .0014  .0005  .0056      0  .0011      0
AlM2        0 .17925      0 .035       .0014  .0005  .0056      0  .0011      0
MgM3        0      0      0  .79       .0017  .0003  .0043      0  .0005      0
Fe2+M3      0      0      0  .19       .0017  .0003  .0043      0  .0005      0
LiM3        0      0      0  .02       .0017  .0003  .0043      0  .0005      0
CaM4        0 .27789     .5  .59       .0032  .0007  .0113      0  .0038      0
NaM4        0 .27789     .5  .41       .0032  .0007  .0113      0  .0038      0
SiT1   .27989 .08495 .29842 .842       .0012  .0004  .0042 -.0001  .0004 -.0001
AlT1   .27989 .08495 .29842 .158       .0012  .0004  .0042 -.0001  .0004 -.0001
SiT2   .28872 .17153 .80567            .0012  .0004  .0043 -.0001  .0007  .0000
O1     .11006 .08655 .21687            .0017  .0006  .0050 -.0002  .0009 -.0001
O2     .11943 .17052 .72834            .0015  .0007  .0060 -.0001  .0006 -.0002
F3     .10592      0 .71251  .68       .0027  .0007  .0079      0  .0012      0
OH3    .10592      0 .71251  .32       .0027  .0007  .0079      0  .0012      0
O4     .36348 .24902 .79434            .0029  .0006  .0088 -.0004  .0020 -.0003
O5     .34769 .13328 .09714            .0018  .0011  .0077  .0002  .0010  .0013
O6     .34359 .11807 .59439            .0019  .0008  .0080      0  .0012 -.0008
O7     .33846      0 .29238            .0024  .0005  .0139      0  .0008      0
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Total number of retrieved datasets: 6
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