American Mineralogist Crystal Structure Database

11 matching records for this search.

Sturmanite
Download hom/sturmanite.pdf
Pushcharovsky D Y, Lebedeva Y S, Zubkova N V, Pasero M, Bellezza M,
Merlino S, Chukanov N V
Download cm/vol42/CM42_723.pdf
The Canadian Mineralogist 42 (2004) 723-729
The crystal structure of sturmanite
Locality: Black Rock mine, Kuruman District, Kalahari manganese field, North Cape province, South Africa
_database_code_amcsd 0005934
11.188 11.188 21.91 90 90 120 P31c
atom      x     y     z occ  Uiso
Fe1       0     0 .0527 .29 .0162
Fe2       0     0 .3015 .30 .0174
Ca1   .0088 .8133 .9276     .0224
Ca2   .9966 .1941 .1775     .0298
S1      1/3   2/3 .5454 .24 .0177
B1      1/3   2/3 .5378 .09  .020
S2      1/3   2/3 .8032     .0253
S3      1/3   2/3 .0571     .0341
B4      1/3   2/3 .3036      .049
O1    .9911 .1295 .9935      .028
O2    .0077 .8616 .1070      .024
O3   -.0028 .1371 .8609      .024
O4    .0057 .8691 .2456      .041
O5    .0023 .3355 .0986      .041
O6    .0157 .6591 .0077      .040
O7    .9939 .3553 .2560      .075
O8    .9952 .6660 .8428      .034
O9    .2655 .4111 .6759      .056
O10   .7416 .5858 .4296      .036
O11   .2397 .3986 .1820      .038
O12   .7393 .5784 .9240      .084
O13     1/3   2/3 .4816 .24  .135
O14     1/3   2/3 .7369 .17  .046
O14'    1/3   2/3 .8694 .17  .046
O15     1/3   2/3 .1218      .017
O16   .1995 .6326 .5671      .025
O17   .1914  .579 .8233 .50  .044
O17'  .1963  .632 .7728 .50  .044
O18   .1917 .5844 .0421      .169
O19   .2325 .7100 .2816 .50  .076
O19'  .1861  .572 .3248 .50  .076
O20     1/3   2/3 .3702 .17  .091
O20'    1/3   2/3 .2363 .17  .091
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Calcium catapleiite
Download hom/calciumcatapleiite.pdf
Merlino S, Pasero M, Bellezza M, Pushcharovsky D Y, Gobetchia E R,
Zubkova N V, Pekov I V
Download cm/vol42/CM42_1037.pdf
The Canadian Mineralogist 42 (2004) 1037-1045
The crystal structure of calcium catapleiite
_database_code_amcsd 0005960
7.378 12.779 10.096 90 90 90 Pbnn
atom     x     y     z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ca1     .5    .5     0 .776 .0157  .0188  .0134  .0147  .0043 -.0046 -.0025
Ca2  .7485   .75     0 .224 .0145  .0106  .0213  .0116      0      0  .0044
Zr   .7442   .25     0      .0092  .0098  .0113  .0066      0      0  .0001
Si1  .4545 .3467 .7488      .0119  .0119  .0154  .0087  .0024  .0002 -.0007
Si2    .25 .5528   .75      .0115  .0150  .0108  .0086      0 -.0018      0
O1   .4285 .4746 .7374      .0179  .0160  .0147  .0229  .0010  .0021  .0036
O2     .25 .2949   .75      .0219  .0121  .0181  .0354      0 -.0017      0
O3   .2803 .6148 .8839      .0228  .0259  .0266  .0159 -.0016  .0039 -.0106
O4   .5602 .3030 .6250      .0292  .0393  .0317  .0165 -.0107 -.0098 -.0035
O5   .5434 .3293 .8904      .0234  .0290  .0297  .0115  .0148  .0066 -.0039
O6   .7630 .5827 .9143      .0382  .0300  .0390  .0455  .0069 -.0090 -.0024
H1    .885  .555  .892        .09
H2    .768  .581  .013        .04
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Calciocatapleiite
Download hom/calciocatapleiite.pdf
Merlino S, Pasero M, Bellezza M, Pushcharovsky D Y, Gobetchia E R,
Zubkova N V, Pekov I V
Download cm/vol42/CM42_1037.pdf
The Canadian Mineralogist 42 (2004) 1037-1045
The crystal structure of calcium catapleiite
_database_code_amcsd 0005961
7.378 12.779 10.096 90 90 90 Pbnn
atom     x     y     z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ca1     .5    .5     0 .776 .0157  .0188  .0134  .0147  .0043 -.0046 -.0025
Ca2  .7485   .75     0 .224 .0145  .0106  .0213  .0116      0      0  .0044
Zr   .7442   .25     0      .0092  .0098  .0113  .0066      0      0  .0001
Si1  .4545 .3467 .7488      .0119  .0119  .0154  .0087  .0024  .0002 -.0007
Si2    .25 .5528   .75      .0115  .0150  .0108  .0086      0 -.0018      0
O1   .4285 .4746 .7374      .0179  .0160  .0147  .0229  .0010  .0021  .0036
O2     .25 .2949   .75      .0219  .0121  .0181  .0354      0 -.0017      0
O3   .2803 .6148 .8839      .0228  .0259  .0266  .0159 -.0016  .0039 -.0106
O4   .5602 .3030 .6250      .0292  .0393  .0317  .0165 -.0107 -.0098 -.0035
O5   .5434 .3293 .8904      .0234  .0290  .0297  .0115  .0148  .0066 -.0039
O6   .7630 .5827 .9143      .0382  .0300  .0390  .0455  .0069 -.0090 -.0024
H1    .885  .555  .892        .09
H2    .768  .581  .013        .04
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Mosandrite
 
Bellezza M, Merlino S, Perchiazzi N
Download cm/vol47/CM47_897.pdf
The Canadian Mineralogist 47 (2009) 897-908
Mosandrite: Structural and crystal-chemical relationships with rinkite
Locality: nepheline syenite pegmatites on Laven Island, Langesundsfjord, Norway
_database_code_amcsd 0006295
7.398 5.595 18.662 90 101.37 90 P2_1/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)
TiM1      0     0     0 .96 .023   .014   .040   .015  -.003   .004  -.018
NbM1      0     0     0 .04 .023   .014   .040   .015  -.003   .004  -.018
WatM2    .5     0     0 .70 .027   .024   .044   .013  -.002   .001  -.008
NaM2     .5     0     0 .14 .027   .024   .044   .013  -.002   .001  -.008
CaM2     .5     0     0 .16 .027   .024   .044   .013  -.002   .001  -.008
NaM3  .7507 .5013 .0004 .05 .028   .028   .021   .035  -.001   .007   .005
CaM3  .7507 .5013 .0004 .23 .028   .028   .021   .035  -.001   .007   .005
CeM3  .7507 .5013 .0004 .07 .028   .028   .021   .035  -.001   .007   .005
CaM4  .0944 .6658 .1925 .65 .016   .015   .014   .018   .000   .003   .001
CeM4  .0944 .6658 .1925 .31 .016   .015   .014   .018   .000   .003   .001
ZrM4  .0944 .6658 .1925 .04 .016   .015   .014   .018   .000   .003   .001
CaM5  .5973 .6646 .1918 .83 .016   .015   .016   .019   .000   .004   .002
CeM5  .5973 .6646 .1918 .17 .016   .015   .016   .019   .000   .004   .002
Sil   .3504 .1605 .1385     .014   .017   .013   .012  -.001   .001  -.002
Si2   .7837 .1595 .1365     .014   .019   .014   .010   .000   .003   .000
O1    .2135 .1579 .0611     .032   .032   .041   .017  -.011  -.009  -.002
O2    .8379 .1504 .0581     .030   .038   .039   .017   .008  .0145  -.004
O3    .3369 .3991 .1850     .021   .027   .014   .023  -.002   .008  -.005
O4    .8464 .3984 .1817     .024   .023   .018   .030   .000   .004  -.009
O5    .3366 .9326 .1903     .022   .027   .019   .021  -.001   .006   .002
O6    .8521 .9337 .1886     .019   .026   .012   .020   .002   .004   .001
O7    .5569 .1543 .1189     .040   .015   .065   .043  -.003   .011  -.006
OHF1  .0311 .6958 .0623 .65 .036   .037   .050   .020   .000   .006   .000
FF1   .0311 .6958 .0623 .35 .036   .037   .050   .020   .000   .006   .000
WatF2 .5295 .6659 .0611 .46 .043   .069   .044   .017  -.004   .001  -.006
OHF2  .5295 .6659 .0611 .44 .043   .069   .044   .017  -.004   .001  -.006
FF2   .5295 .6659 .0611 .10 .043   .069   .044   .017  -.004   .001  -.006
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Hiortdahlite
Download hom/hiortdahlite.pdf
Bellezza M, Merlino S, Perchiazzi N
 
The Canadian Mineralogist 50 (2012) 531-548
Distinct domains in "guarinite" from Monte Somma, Italy:
Crystal structures and crystal chemistry
Note: "Guarinite" Domain I
Locality: Monte Somma syenite, Italy
_database_code_amcsd 0019216
10.973 10.306 7.367 90.03 109.63 90.11 P-1
atom        x     y     z occ Uiso
Ca(1)   .4247 .3708 .8430     .018
Ca(2)   .3090 .0964 .5291 .71 .019
Na(2)   .3090 .0964 .5291 .29 .019
Ca(3)   .9333 .1264 .8472 .71 .021
Zr(3)   .9333 .1264 .8472 .29 .021
Ca(4)   .8039 .3972 .5270     .015
Zr      .2953 .0973 .0262     .020
Ca(5)   .8091 .4049 .0258 .55 .015
Mn(5)   .8091 .4049 .0258 .45 .015
NaCa(1) .4207 .3791 .3378 .74 .024
CaNa(1) .4207 .3791 .3378 .26 .024
NaCa(2) .9227 .1239 .3220 .59 .015
CaNa(2) .9227 .1239 .3220 .41 .015
Si(1)   .6231 .1679 .2221     .011
Si(2)   .6203 .1711 .6582     .011
Si(3)   .1293 .3140 .2284     .012
Si(4)   .1221 .3185 .6590     .010
O(1)    .6210 .1460 .4404     .030
O(2)    .7389 .2676 .2380     .025
O(3)    .7471 .2578 .7677     .025
O(4)    .6629 .0229 .1711     .021
O(5)    .6371 .0280 .7371     .025
O(6)    .4792 .2105 .0913     .016
O(7)    .4846 .2361 .6409     .021
O(8)    .1397 .2807 .4524     .037
O(9)    .2470 .2261 .2137     .016
O(10)   .2411 .2297 .7998     .023
O(11)   .1581 .4657 .1971     .025
O(12)   .1475 .4677 .6876     .029
O(13)   .9885 .2636 .0937     .022
O(14)   .9816 .2621 .6420     .029
O(15)   .1147 .0182 .9465     .023
F(16)   .6080 .4937 .9361     .017
F(17)   .3911 .5112 .5818     .025
F(18)   .8880 .0023 .5828     .028
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Wohlerite
Download hom/wohlerite.pdf
Bellezza M, Merlino S, Perchiazzi N
 
The Canadian Mineralogist 50 (2012) 531-548
Distinct domains in "guarinite" from Monte Somma, Italy:
Crystal structures and crystal chemistry
Note: "Guarinite" Domain II
Locality: Monte Somma syenite, Italy
_database_code_amcsd 0019217
10.836 10.270 7.296 90 109.13 90 P2_1
atom       x     y     z occ Uiso
Ca(1)  .3469 .2965 .5526     .019
Nb     .1299 .0521 .1897 .57 .014
ZrNb   .1299 .0521 .1897 .43 .014
Zr     .3427 .2868 .0535     .012
Ca(2)  .1460 .6817 .1986 .82 .012
Fe(2)  .1460 .6817 .1986 .18 .012
Ca(3)  .3693 .9104 .0554     .017
Ca(4)  .1531 .6803 .6995     .014
Na(1)  .1216 .0675 .6909 .77 .021
Ca(1)  .1216 .0675 .6909 .23 .021
Na(2)  .3681 .9142 .5514 .80 .020
Ca(2)  .3681 .9142 .5514 .20 .020
Si(1)  .0808 .3713 .1980     .012
Si(2)  .0724 .3632 .6358     .012
Si(3)  .4374 .6112 .5625     .012
Si(4)  .4319 .6107 .1231     .012
O(1)   .0065 .2360 .1164     .019
O(2)  -.0181 .2386 .6213     .016
O(3)   .0078 .4998 .0912     .024
O(4)   .0169 .4969 .6944     .022
O(5)   .2324 .3699 .2070     .020
O(6)   .2211 .3323 .7754     .017
O(7)   .4871 .4690 .6486     .019
O(8)   .4607 .4603 .0772     .019
O(9)   .4744 .2341 .3201     .016
O(10)  .4664 .2148 .9148     .018
O(11)  .2852 .6371 .5156     .023
O(12)  .2855 .6669 .0197     .019
O(13)  .2461 .1132 .0365     .023
O(14)  .2283 .1135 .4503     .025
F(15)  .2382 .8866 .7445     .018
O(16)  .2178 .8880 .2273     .018
O(17)  .0865 .3886 .4241     .028
O(18)  .5268 .1214 .6404     .022
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Hiortdahlite
Download hom/hiortdahlite.pdf
Bellezza M, Merlino S, Perchiazzi N
 
The Canadian Mineralogist 50 (2012) 531-548
Distinct domains in "guarinite" from Monte Somma, Italy:
Crystal structures and crystal chemistry
Note: "Guarinite" Domain IV
Locality: Monte Somma syenite, Italy
_database_code_amcsd 0019218
10.970 10.943 7.365 109.63 109.65 83.39 P-1
atom       x      y     z occ Uiso
Ca(1)  .3119  .4032 .2269 .72 .018
Na(1)  .3119  .4032 .2269 .28 .018
Ca(2)  .1943  .9033 .4224     .017
Ca(3)  .1928  .8994 .9189     .015
Ca(4)  .4240  .1283 .8912     .016
Zr     .2943  .4028 .7187     .016
MnM    .0669  .6259 .4756 .41 .021
CaM    .0669  .6259 .4756 .40 .021
ZrM    .0669  .6259 .4756 .19 .021
Na     .4223  .1222 .3995     .020
NaCa   .0773  .6244 .9610 .60 .014
CaNa   .0773  .6244 .9610 .40 .014
Si(1)  .6229  .3315 .8153     .012
Si(2)  .6208  .3295 .3765     .014
Si(3)  .1268  .1832 .2435     .016
Si(4)  .1251  .1846 .8103     .014
O(1)   .6208  .3575 .6078     .029
O(2)   .1404  .2188 .0505     .043
O(3)   .4861  .2639 .2253     .020
O(4)   .1604  .0370 .7226     .030
O(5)   .7378  .2307 .8624     .024
O(6)   .1459  .0308 .2190     .032
O(7)   .1156  .4816 .6511     .023
O(8)   .7489  .2465 .3589     .031
O(9)  -.0168  .2352 .7038     .033
O(10)  .2431  .2732 .8399     .024
O(11)  .3627  .5246 .6137     .030
O(12)  .4773  .2897 .7818     .020
O(13)  .2460  .2689 .4305     .023
O(14) -.0132  .2398 .2604     .025
O(15)  .3389  .5245 .0159     .023
F(16)  .3913 -.0070 .0604     .029
F(17)  .3914 -.0094 .5675     .027
F(18)  .1124  .5030 .1921     .026
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Cuspidine
Download hom/cuspidine.pdf
Bellezza M, Merlino S, Perchiazzi N
 
European Journal of Mineralogy 16 (2004) 957-969
Chemical and structural study of the Zr,Ti-disilicates in the venanzite
from Pian di Celle, Umbria, Italy
Locality: Pian di Celle, Umbria, Italy
_database_code_amcsd 0007083
10.919 10.485 7.485 90 109.55 90 P2_1/a
atom     x     y     z occ Uiso
Ca1  .3125 .0879 .0290 .86 .016
Zr1  .3125 .0879 .0290 .14 .016
Ca2  .4198 .3682 .8399     .016
Ca3  .3061 .0950 .5307     .016
Ca4  .4235 .3684 .3310 .83 .015
Na4  .4235 .3684 .3310 .17 .015
Si1  .6309 .1893 .2260     .014
Si2  .6226 .1874 .6545     .013
O1   .6221 .2197 .4376     .038
O2   .7525 .2781 .2303     .021
O3   .7421 .2748 .7783     .024
O4   .6687 .0430 .2104     .028
O5   .6556 .0403 .7042     .033
O6   .4906 .2344 .0921     .023
O7   .4801 .2355 .6412     .021
F1   .6049 .4962 .9292     .019
F2   .3955 .4985 .5744     .020
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Gotzenite
Download hom/gotzenite.pdf
Bellezza M, Merlino S, Perchiazzi N
 
European Journal of Mineralogy 16 (2004) 957-969
Chemical and structural study of the Zr,Ti-disilicates in the venanzite
from Pian di Celle, Umbria, Italy
Locality: Pian di Celle, Umbria, Italy
_database_code_amcsd 0007084
9.636 7.341 5.737 89.94 100.74 101.06 P-1
atom     x     y     z occ Uiso
Ca1  .6322 .9096 .2218 .86 .013
Zr1  .6322 .9096 .2218 .14 .013
Ca2  .6345 .4078 .2194     .011
Ca3  .9935 .2421 .4960 .68 .018
Na3  .9935 .2421 .4960 .32 .018
Ca4      0    .5     0 .58 .025
Na4      0    .5     0 .42 .025
Ti5      0     0     0 .98 .018
Si1  .7179 .6529 .7478     .012
Si2  .7229 .2132 .7510     .016
O1   .7592 .4424 .7899     .024
O2   .6147 .6689 .9339     .017
O3   .6181 .1407 .9314     .016
O4   .6467 .6648 .4764     .021
O5   .6706 .1664 .4755     .027
O6   .8791 .7806 .8184     .022
O7   .8848 .1722 .8307     .023
F1   .8888 .4757 .3059     .019
F2   .8856 .9688 .2635     .028
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Grenmarite
 
Bellezza M, Franzini M, Larsen A O , Merlino S, Perchiazzi N
 
European Journal of Mineralogy 16 (2004) 971-978
Grenmarite, a new member of the gotzenite-seidozerite-rosenbuschite
group from the Langesundsfjord district, Norway: definition and crystal structure
Locality: Langesundsfjord district, Norway
_database_code_amcsd 0007085
5.608 7.139 18.575 90 102.60 90 P2/c
atom     x     y     z occ Uiso
Zr1  .2004 .1197 .0733 .88 .012
Mn1  .2004 .1197 .0733 .12 .012
Zr2      0 .1143   .25 .54 .012
Ti2      0 .1143   .25 .46 .012
Mn3     .5 .3533   .25 .76 .016
Na3     .5 .3533   .25 .24 .016
Na4  .2051 .6151 .0695 .85 .023
Mn4  .2051 .6151 .0695 .15 .023
Na5      0 .6152   .25 .86 .023
Ca5      0 .6152   .25 .14 .023
Na6     .5 .8589   .25 .76 .028
Ca6     .5 .8589   .25 .24 .028
Si1  .7237 .3884 .1034     .012
Si2  .7203 .8413 .1041     .012
O1   .7355 .6144 .1071     .029
O2   .4473 .3259 .0661     .022
O3   .4398 .9015 .0755     .020
O4   .9256 .3239 .0587     .020
O5   .9035 .9074 .0515     .019
O6   .7911 .3185 .1891     .019
O7   .8161 .9100 .1881     .019
O8   .2439 .1266 .1851     .019
F    .3025 .5879 .1919     .034
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Rinkite
Download hom/rinkite.pdf
Bellezza M, Merlino S, Perchiazzi N, Raade G
 
Atti della Societa Toscana di Scienze Naturali, Memorie, Serie A 114 (2009) 1-3
<>: a chemical and structural study
Locality: Barkevik skerry, Langesundsfjord, Norway
_database_code_amcsd 0017796
7.421 5.709 19.019 90 101.23 90 P2_1/c
atom     x     y      z occ Biso
CaM2    .5     0      0 .10 3.34
NaM3 .7547 .5010 .00110 .46 4.21
CaM3 .7547 .5010 .00110 .54 4.21
CaM4 .0935 .6624 .19121 .71 3.07
CeM4 .0935 .6624 .19121 .29 3.07
CaM5 .5972 .6660 .19122 .84 3.16
CeM5 .5972 .6660 .19122 .16 3.16
TiM1     0     0      0 .86 3.45
ZrM1     0     0      0 .09 3.45
NbM1     0     0      0 .05 3.45
NaM2    .5     0      0 .90 3.34
Si1  .3511 .1560 .13998     2.67
Si2  .7845 .1554 .13785     2.68
O1   .2197 .1511 .06120     3.93
O2   .8309 .1419 .05804     3.64
O3   .3379 .3972 .18387     3.67
O4   .8429 .4018 .17807     4.04
O5   .3334 .9352 .19159     3.39
O6   .8561 .9386 .19143     3.25
O7   .5585 .1415 .12134     3.79
FOF1 .0308 .7012 .06006 .55 3.71
OOF1 .0308 .7012 .06006 .45 3.71
FOF2 .5279 .6555 .06071 .80 4.44
OOF2 .5279 .6555 .06071 .20 4.44
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View JMOL 3-D Structure (permalink)
 
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Multiple datasets can be concatenated into a single downloadable file by selecting the datasets and then clicking

Multiple datasets can be downloaded as individual files inside a ZIP archive by selecting the datasets and then clicking

Total number of retrieved datasets: 11
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