American Mineralogist Crystal Structure Database

6 matching records for this search.

Qusongite
 
Fang Q, Bai W, Yang J, Xu X, Li G, Shi N, Xiong M, Rong H
 
American Mineralogist 94 (2009) 387-290
Qusong (WC): A new mineral
Locality: Luobusa ophiolite, Qusong County, Tibet, China
_database_code_amcsd 0004855
2.902 2.902 2.831 90 90 120 P-6m2
atom   x   y  z
W      0   0  0
C    2/3 1/3 .5
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
 
Wagnerite
Download hom/wagnerite.pdf
Ren L, Grew E S, Xiong M, Ma Z
Download cm/vol41/CM41_393.pdf
The Canadian Mineralogist 41 (2003) 393-411
Wagnerite-Ma5bc, a new polytype of Mg2(PO4)(F,OH), from granulite-facies
paragneiss, Larsemann Hills, Prydz Bay, East Antartica
Locality: Larsemann Hills, Prydz Bay, East Antartica
_database_code_amcsd 0005829
9.645 31.659 11.914 90 108.26 90 Ia
atom        x      y      z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Mg(1)   .4443  .2227  .1170 .006   .012   .005   .003   .000   .003  -.001
Mg(2)   .3471  .0223  .7797 .008   .002   .009   .012   .001   .001   .000
Mg(3)   .7026  .2427  .5129 .006   .009   .005   .005  -.001   .003   .000
Mg(4)   .2050  .1427  .0097 .006   .004   .006   .007   .000   .001  -.001
Mg(5)   .8493  .1216  .2900 .010   .006   .009   .015   .000   .004  -.001
Mg(6)   .3520   .772  .2841 .009   .004   .008   .014  -.001   .002   .001
Mg(7)   .0946  .0430  .3879 .010   .009   .012   .008   .004   .002   .003
Mg(8)   .0876  .0573  .8867 .006   .002   .008   .009   .000   .002  -.001
Mg(9)   .5892  .1564  .3903 .008   .007   .012   .004  -.003   .002  -.003
Mg(10)  .9469  .1782 1.1120 .010   .014   .006   .009   .002   .003   .000
Mg(11)  .6881  .0517  .0042 .005   .002   .008   .006  -.002   .003   .002
Mg(12)  .3607  .2211  .8059 .006   .007   .006   .006   .000   .004   .001
Mg(13)  .1895  .1531  .5075 .006   .001   .011   .006   .001   .003   .003
Mg(14) -.3042  .0476  .5060 .006   .004   .010   .006  -.003   .003  -.003
Mg(15)  .4341  .0791  .5937 .013   .015   .007   .021   .001   .012  -.001
Mg(16)  .8620  .1780  .8003 .007   .006   .007   .007  -.002   .001  -.001
Mg(17)  .6068  .1481  .8936 .006   .007   .006   .004   .001   .001   .000
Mg(18) -.0670  .1226  .6011 .011   .012   .005   .018   .001   .008  -.001
Mg(19)  .1033  .2483  .3939 .007   .008   .008   .003   .002  -.001   .000
Mg(20)  .4292  .0217  .0912 .011   .013   .007   .014   .000   .007   .001
P(1)    .0144  .0196  .6221 .007   .007   .008   .006   .001   .003   .000
P(2)    .0136  .0803  .1237 .007   .007   .007   .008   .000   .005  -.001
P(3)    .5165  .1208  .1228 .007   .007   .008   .008  -.001   .005  -.001
P(4)    .5138  .1805  .6250 .006   .006   .006   .007   .000   .005  -.001
P(5)    .0163  .2208  .6234 .007   .008   .006   .006   .000   .003  -.001
P(6)    .7753  .0792  .7743 .007   .008   .008   .007   .000   .002   .001
P(7)    .2790  .1198  .7735 .008   .008   .007   .007  -.001   .000   .001
P(8)    .2757  .1790  .2748 .007   .006   .005   .008   .000   .002   .000
P(9)    .7773  .0208  .2728 .008   .008   .008   .006  -.001   .001   .001
P(10)   .7789  .2200  .2750 .007   .009   .006   .006   .000   .002   .001
O(1)   -.0821  .0587  .5850 .013   .009   .015   .014   .002   .003   .005
O(2)    .1310  .0290  .7428 .012   .011   .015   .009   .001   .004  -.003
O(3)   -.0848 -.0173  .6362 .015   .017   .012   .022  -.008   .013  -.001
O(4)    .0885  .0087  .5309 .017   .021   .015   .018   .007   .010   .003
O(5)   -.0863  .0431  .0815 .012   .007   .015   .015  -.005   .005  -.008
O(6)    .1360  .0682  .2382 .012   .013   .011   .011   .000   .002   .009
O(7)   -.0753  .1171  .1498 .010   .016   .013   .003   .001   .007  -.003
O(8)    .0774  .0931  .0269 .015   .018   .011   .015  -.009   .004  -.001
O(9)    .4204  .1601  .0862 .011   .006   .015   .012   .007   .002   .003
O(10)   .6323  .1288  .2461 .008   .011   .008   .005  -.001   .001  -.004
O(11)   .4110  .0843  .1322 .012   .010   .010   .017  -.001   .005  -.001
O(12)   .5949  .1119  .0334 .013   .017   .010   .010   .004   .002   .000
O(13)   .4120  .1430  .5820 .010   .005   .016   .010  -.001   .002  -.007
O(14)   .6402  .1683  .7366 .012   .011   .011   .016   .002   .005   .006
O(15)   .5738  .1936  .5252 .010   .010   .009   .011  -.006   .002  -.001
O(16)   .4211  .2161  .6527 .008   .018   .008   .000   .000   .008   .000
O(17)  -.0835  .2595  .5841 .012   .009   .015   .010   .005   .002   .004
O(18)   .1371  .2307  .7403 .011   .012   .011   .009   .000   .004  -.003
O(19)   .0859  .2107  .5278 .014   .021   .007   .014   .003   .007  -.001
O(20)  -.0857  .1849  .6397 .009   .013   .007   .011   .000   .008  -.001
O(21)   .8752  .0400  .8180 .007   .008   .002   .013  -.001   .004  -.003
O(22)   .6613  .0709  .6572 .011   .007   .018   .008   .000  -.002   .000
O(23)   .7001  .0895  .8673 .010   .007   .017   .007  -.002   .006   .002
O(24)   .8775  .1146  .7615 .010   .008   .010   .012  -.001   .005   .001
O(25)   .3677  .0836  .7432 .013   .006   .007   .026   .002   .004   .002
O(26)   .2137  .1057  .8710 .009   .007   .015   .006   .005   .006   .001
O(27)   .1566  .1314  .6622 .007   .002   .015   .003   .004  -.002  -.004
O(28)   .3834  .1576  .8232 .008   .012   .002   .007  -.002   .000   .005
O(29)   .3768  .2152  .2656 .007   .009   .007   .007  -.002   .005  -.002
O(30)   .1961  .1891  .3650 .007   .003   .011   .012  -.001   .008   .002
O(31)   .3766  .1402  .3190 .008   .015   .001   .009  -.002   .003  -.001
O(32)   .1651  .1717  .1523 .013   .006   .016   .015   .000   .000  -.001
O(33)   .6557  .0314  .1593 .011   .009   .017   .006   .002   .000  -.004
O(34)   .7095  .0083  .3692 .012   .011   .019   .009  -.004   .008  -.002
O(35)   .8715 -.0151  .2484 .014   .004   .011   .024   .007   .002   .004
O(36)   .8796  .0590  .3198 .010   .015   .002   .013   .001   .006   .002
O(37)   .8814  .2580  .3208 .008   .014   .003   .006  -.002   .003   .002
O(38)   .7068  .2075  .3689 .008   .011   .012   .003   .000   .006  -.002
O(39)   .8691  .1837  .2516 .011   .008   .004   .023  -.001   .005   .001
O(40)   .6610  .2302  .1587 .012   .008   .017   .007  -.003  -.001  -.003
F(1)    .4802  .0318  .9413 .005   .000   .002   .012   .002   .002  -.003
F(2)    .5663  .2847  .4205 .015   .013   .015   .018  -.004   .007   .008
F(3)    .2263  .0149  .9805 .008   .006   .007   .006   .000  -.004  -.005
F(4)    .0651  .1834 -.0843 .018   .009   .016   .028  -.006   .007   .013
F(5)    .8081  .1702  .9562 .026   .032   .032   .012  -.011   .005   .001
F(6)    .3063  .2299 -.0416 .017   .018   .028   .007   .004   .009   .002
F(7)    .4909  .0706  .4366 .044   .064   .017   .028   .016  -.021  -.007
F(8)    .9844  .1303  .4431 .021   .030   .012   .012  -.007  -.007   .002
F(9)    .2347  .0840  .4722 .044   .063   .023   .024  -.030  -.018   .010
F(10)   .7381  .1180  .4783 .051   .081   .021   .020   .036  -.028  -.015
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Zangboite
Download hom/zangboite.pdf
Li G, Fang Q, Shi N, Bai W, Yang J, Xiong M, Ma Z, Rong H
 
The Canadian Mineralogist 47 (2009) 1265-1274
Zangboite, TiFeSi2, a new mineral species from Luobusha, Tibet, China,
and its crystal structure
Locality: Luobusha, Tibet, China
_database_code_amcsd 0006308
8.6053 9.5211 7.6436 90 90 90 Pbam
atom       x      y      z U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3)  U(2,3)
Fe1        0     .5 .74258  .0062  .0040  .0060   .0003       0       0
Fe2  -.08868 .24294 .74824  .0054 .00509  .0048 -.00035 -.00004  .00009
Ti1   .32719 .54777 .73815  .0038  .0044  .0065  .00007   .0001 -.00019
Ti2   .16749 .32052     .5  .0047  .0033  .0057   .0002       0       0
Si1   .12725 .60427     .5  .0059  .0068  .0054   .0006       0       0
Si2   .12376 .59728      0  .0094  .0085  .0059   .0010       0       0
Si3  -.03839 .11931     .5  .0056  .0050  .0057   .0008       0       0
Si4  -.33705 .18159 .84647  .0054  .0070  .0053  -.0002   .0001  -.0001
Si5  -.03895 .12131      0  .0143  .0060  .0050   .0018       0       0
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Dingdaohengite-(Ce)
 
Li G, Yang G, Ma Z, Shi N, Xiong M, Sheng G, Fan H
 
Kuangwu Xuebao 25 (2005) 313-320
The crystal structure of a new mineral dingdaohengite-(Ce)
Locality: Bayun Obo, Inner Mongolia, China
_database_code_amcsd 0014198
13.4656 5.7356 11.0977 90 100.636 90 P2_1/a
atom         x      y      z  occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
CeA1    .43027 .51328 .76028 .525   .014   .028   .015   .000   .003   .001
LaA1    .43027 .51328 .76028 .365   .014   .028   .015   .000   .003   .001
CaA1    .43027 .51328 .76028 .110   .014   .028   .015   .000   .003   .001
CeA2    .14386 .49202 .76557 .525   .018   .016   .017   .000   .003  -.001
LaA2    .14386 .49202 .76557 .365   .018   .016   .017   .000   .003  -.001
CaA2    .14386 .49202 .76557 .110   .018   .016   .017   .000   .003  -.001
FeB          0     .5     .5        .017   .013   .014      0      0      0
TiC1    .25198 .25110 .50003  .44   .015   .012   .013   .000   .002   .000
Fe2+C1  .25198 .25110 .50003  .23   .015   .012   .013   .000   .002   .000
MgC1    .25198 .25110 .50003  .20   .015   .012   .013   .000   .002   .000
Fe3+C1  .25198 .25110 .50003  .13   .015   .012   .013   .000   .002   .000
TiC2A       .5     .5     .5  .99   .015   .014   .014      0   .004      0
NbC2A       .5     .5     .5  .01   .015   .014   .014      0   .004      0
TiC2B       .5      0      0  .97   .025   .015   .012      0   .003      0
NbC2B       .5      0      0  .03   .025   .015   .012      0   .003      0
Si1     .29919  .0006 .76859        .016   .010   .014   .001   .003   .001
Si2     .35776  .4998 .04651        .017   .014   .012   .000   .003   .000
O1       .5219  .2567  .6267        .016   .021   .018   .003   .005   .003
O2       .5228  .7466  .6265        .016   .021   .020   .004   .006   .002
O3       .4212  .2644  .0943        .027   .023   .024   .007   .002   .003
O4       .4307  .7208  .0934        .030   .027   .021   .011   .001   .003
O5       .2753  .2357  .6850        .027   .012   .014   .001   .004   .000
O6       .2686  .7674  .6857        .026   .013   .015   .000   .003   .001
O7       .3543  .5036  .5226        .017   .014   .017   .000   .005   .001
O8       .3137  .5035  .9033        .025   .017   .016   .000   .003   .001
O9       .1521  .4985  .5108        .017   .013   .020   .002   .004   .000
O10      .2296  .0184  .8713        .039   .051   .026  -.005   .019   .003
O11      .4152 -.0178  .8280        .019   .051   .023   .000   .001   .001
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Dingdaohengite-(Ce)
 
Li G, Yang G, Ma Z, Shi N, Xiong M, Sheng G, Fan H
 
Kuangwu Xuebao 25 (2005) 313-320
The crystal structure of a new mineral dingdaohengite-(Ce)
Locality: Bayun Obo, Inner Mongolia, China
_database_code_amcsd 0014199
13.4656 5.7356 11.0977 90 100.636 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)
CeA1   .43028    .5 .76027 .525   .014   .036   .015      0   .003      0
LaA1   .43028    .5 .76027 .365   .014   .036   .015      0   .003      0
CaA1   .43028    .5 .76027 .110   .014   .036   .015      0   .003      0
CeA2   .14385    .5 .76556 .525   .018   .018   .018      0   .003      0
LaA2   .14385    .5 .76556 .365   .018   .018   .018      0   .003      0
CaA2   .14385    .5 .76556 .110   .018   .018   .018      0   .003      0
FeB         0    .5     .5        .017   .014   .014      0   .000      0
TiC1      .25   .25     .5  .44   .016   .013   .013   .000   .002   .000
Fe2+C1    .25   .25     .5  .23   .016   .013   .013   .000   .002   .000
MgC1      .25   .25     .5  .20   .016   .013   .013   .000   .002   .000
Fe3+C1    .25   .25     .5  .13   .016   .013   .013   .000   .002   .000
TiC2A      .5    .5     .5  .99   .016   .014   .014      0   .004      0
NbC2A      .5    .5     .5  .01   .016   .014   .014      0   .004      0
TiC2B      .5     0      0  .97   .026   .015   .012      0   .004      0
NbC2B      .5     0      0  .03   .026   .015   .012      0   .004      0
Si1    .29921     0 .76857        .017   .011   .014      0   .003      0
Si2    .35775    .5 .04647        .018   .015   .013      0   .003      0
O1      .5224 .7449  .6266        .017   .021   .019   .004   .005   .003
O2      .4259 .2715  .0939        .033   .028   .023   .012      0   .003
O3      .2720 .2341  .6853        .030   .014   .015   .001   .004   .001
O4      .3543    .5  .5226        .017   .016   .018      0   .005      0
O5      .3138    .5  .9033        .026   .018   .016      0   .003      0
O6      .1521    .5  .5108        .018   .014   .020      0   .004      0
O7      .2297     0  .8713        .040   .065   .027      0   .019      0
O8      .4152     0  .8281        .020   .062   .024      0   .001      0
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Hanjiangite
 
Liu J, Li G, Mao Q, Wu S, Liu Z, Su S, Xiong M, Yu X
 
American Mineralogist 97 (2012) 281-290
Hanjiangite, a new barium-vanadium phyllosilicate carbonate mineral,
from the Shiti barium deposit in the Dabashan region, China
Note: data is taken from the deposited cif, which unfortunately does not agree
with the published tables.
Locality: Southern Shaanxi, China
_database_code_amcsd 0018777
5.2050 9.033 32.077 90 93.49 90 C2
atom      x      y      z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ba1   .9632 .53413 .41571      .0117  .0113  .0000  .0233 -.0028 -.0020 -.0013
Ba2   .5257  .2287 .08456      .0356  .0174  .0445  .0450  .0017  .0027 -.0009
Ca1      .5  .3635     .5       .016   .033   .005   .010      0      0      0
Ca2     -.5  .5642      0      .0170   .019   .015   .018      0   .003      0
V1    .7418  .0512 .25007 .623  .012   .010   .010   .015  .0000  .0000  .0000
Al1   .7418  .0512 .25007  .38  .012   .010   .010   .015  .0000  .0000  .0000
V2    .2403  .2150 .25020 .700 .0145  .0064   .011   .026 -.0011  .0002 -.0044
Al2   .2403  .2150 .25020  .30 .0145  .0064   .011   .026 -.0011  .0002 -.0044
Si1   .4347 -.2929  .3356       .014   .013   .020   .009   .000   .000   .001
Si2   .9266 -.1185  .3360  .50 .0142  .0052   .007   .031 -.0042  .0019  .0013
Al3   .9266 -.1185  .3360  .50 .0142  .0052   .007   .031 -.0042  .0019  .0013
Si3   .0353  .0588  .1647  .50 .0142  .0052   .007   .031 -.0042  .0019  .0013
Al4   .0353  .0588  .1647  .50 .0142  .0052   .007   .031 -.0042  .0019  .0013
Si4   .5509 -.1093  .1648  .98  .014   .007   .021   .015   .000  -.002  -.003
Al4   .5509 -.1093  .1648  .02  .014   .007   .021   .015   .000  -.002  -.003
O1     .221  -.174  .3513       .023   .008   .023   .035  -.001  -.007   .002
O2     .724  -.239  .3562       .020   .014   .024   .021  -.013  -.011   .011
O3     .886   .042  .3570       .019   .017   .018   .022  -.003   .004  -.004
O4     .880  -.116  .2845      .0153  .0091   .014   .023 -.0030  .0002  .0009
OH5    .432  .0691  .2829      .0153  .0091   .014   .023 -.0030  .0002  .0009
O6     .938   .198  .2844      .0153  .0091   .014   .023 -.0030  .0002  .0009
OH7    .544   .210  .2176      .0153  .0091   .014   .023 -.0030  .0002  .0009
O8     .038  .0704  .2164      .0153  .0091   .014   .023 -.0030  .0002  .0009
O9     .599  -.118  .2153      .0153  .0091   .014   .023 -.0030  .0002  .0009
O10    .088   .223  .1445       .025   .022   .016   .037  -.005   .003   .011
O11    .761  -.004  .1437       .024   .008   .025   .038   .000  -.003  -.013
O12    .259  -.055  .1494       .027   .013   .023   .045   .008      0  -.016
O13    .015   .256  .0481       .044   .019   .027   .082  -.005  -.012   .015
O14   -.194   .468  .0517       .035   .013   .034   .056  -.009  -.010   .004
O15    .238   .458  .0483       .035   .018   .029   .057  -.002   .002      0
O16    .481  .5568  .4501       .022   .025   .011   .029  -.009   .004   .004
O17    .270   .773  .4493       .021   .017   .018   .028  -.006  -.002  -.014
O18    .689   .769  .4496       .024   .025   .011   .036  -.009   .012  -.006
F19      .5   .194      0   .6  .041   .073   .012   .039      0   .007      0
F20       0   .505     .5  .72  .041   .040   .063   .018      0  -.006      0
C1     .475   .704  .4516       .024   .020   .017   .035  -.004  -.001   .003
C2     .013   .396  .0502       .024   .020   .017   .035  -.004  -.001   .003
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Total number of retrieved datasets: 6
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