American Mineralogist Crystal Structure Database

19 matching records for this search.

Metaschoepite
Download hom/metaschoepite.pdf
Klingensmith A L, Deely K M, Kinman W S, Kelly V, Burns P C
Download am/vol92/AM92_662.pdf
American Mineralogist 92 (2007) 662-669
Neptunium incorporation in sodium-substituted metaschoepite
Locality: Katanga, Congo
Sample: Natural
_database_code_amcsd 0004315
14.6801 14.0287 16.7196 90 90 90 Pbcn
atom        x      y      z occ   Uiso U(1,1) U(2,2) U(3,3)  U(1,2) U(1,3)  U(2,3)
Na21     .503   .672   .295 .24   .040
U1     .23381 .74397 .37478     .01545  .0264 .00816  .0118 -.00032  .0002 -.00215
U2     .28634 .76845 .60325     .01605  .0315 .00797 .00865   .0026 -.0018 -.00103
U3     .25577 .51214 .23933     .01607  .0328  .0084 .00695   .0007 -.0014  .00036
U4     .25591 .51731 .51083     .01707  .0316 .00946  .0101  -.0007  .0015  .00165
O1      .1748  .7406  .6145       .035
O2      .1475  .4622  .2320       .032
O3      .1206  .7443  .4156       .026
O4      .4098  .7847  .5967       .019
O5      .3678  .5610  .2511       .024
O6      .1391  .5483  .5295       .021
O7      .3420  .7440  .3315       .028
O8      .3699  .4841  .4895       .026
O9      .2517  .9229  .6173      .0184
OH10    .2082  .3619  .4680       .020
OH11    .2928  .6751  .4885       .028
OH12    .2144  .5628  .3722      .0140
OH13    .3117  .6015  .6385       .017
OH14    .1883  .6854  .2439      .0148
OH15    .1894  .8851  .3128       .016
Wat16A      0  .7528    .25 .59   .040
Wat16B      0   .659    .25 .47   .040
Wat17   .4994  .4181  .1441 .78   .040
Wat18  -.0195  .6443  .5691 .94   .040
Wat19   .0268  .5492  .3679 .81   .040
Wat20   .4972  .6469  .4223 .63   .040
Wat22      .5   .794    .25 .53   .040
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Metaschoepite
Download hom/metaschoepite.pdf
Klingensmith A L, Deely K M, Kinman W S, Kelly V, Burns P C
Download am/vol92/AM92_662.pdf
American Mineralogist 92 (2007) 662-669
Neptunium incorporation in sodium-substituted metaschoepite
Locality: synthetic
Sample: Na-Ms-CRY
_database_code_amcsd 0004316
14.7050 14.0565 16.7051 90 90 90 Pbcn
atom        x       y       z  occ   Uiso U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3)  U(2,3)
Na21    .5025   .6593   .2756 .545   .040
U1     .23566 .739966 .382441      .01284 .02174 .00874 .00805 -.00061 -.00010  .00018
U2     .27743 .764029 .610028      .01368 .02134 .00830 .01139  .00077 -.00230 -.00190
U3     .25494 .515225 .242744      .01410 .02619 .00854 .00757 -.00025 -.00077 -.00003
U4     .25380 .517051 .515841      .01329 .02316 .00811 .00860  .00063  .00093  .00093
O1      .1613   .7403   .6273       .0321   .034   .022   .040    .000    .001   -.009
O2      .1407   .4769   .2292       .0305   .033   .039   .019   -.005    .001   -.005
O3      .1205   .7514   .4139       .0245   .019   .019   .036    .000    .003    .000
O4      .3964   .7804   .6015       .0183   .026   .018   .010   -.002    .000   -.004
O5      .3692   .5517   .2597       .0253   .030   .022   .024    .003    .000   -.004
O6      .1372   .5388   .5383       .0206   .020   .024   .018    .001    .006    .001
O7      .3487   .7302   .3468       .0255   .024   .026   .027   -.007    .002   -.011
O8      .3694   .4935   .4890       .0292   .030   .029   .028    .003    .006    .009
O9      .2419   .9185   .6219       .0217   .046   .012   .007    .006   -.003   .0004
OH10    .2113   .3613   .4716       .0172   .034   .008   .009    .001   -.001  -.0002
O11     .2737   .6741   .4984       .0245   .049   .017   .008   -.004   -.011   -.001
OH12    .2116   .5622   .3781       .0151   .030   .009   .006    .003   -.003  -.0011
OH13    .3086   .6001   .6456       .0152   .030   .009   .007    .000    .000  -.0002
OH14    .1936   .6859   .2487       .0153   .030   .011   .005   -.001    .000    .000
OH15    .2137   .8797   .3136       .0137
Wat16A      0    .723     .25  .39   .040
Wat16B      0    .681     .25  .46   .040
Wat17   .4924   .4026   .1551 .785   .040
Wat18  -.0195   .6642   .5530 .967   .040
Wat19   .0272   .5486   .3775 .926   .040
Wat20   .5067   .6224   .4010 .674   .040
Wat22      .5   .8186     .25 .774   .040
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Metaschoepite
Download hom/metaschoepite.pdf
Klingensmith A L, Deely K M, Kinman W S, Kelly V, Burns P C
Download am/vol92/AM92_662.pdf
American Mineralogist 92 (2007) 662-669
Neptunium incorporation in sodium-substituted metaschoepite
Locality: synthetic
Sample: Na-Ms-CRY-Np
_database_code_amcsd 0004317
14.6401 14.0417 16.7044 90 90 90 Pbcn
atom        x      y      z occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Na21    .5011  .6628  .2840 .61   .040
U1     .23574 .74017 .38168     .01470  .0240  .0097  .0104 -.0011  .0006  .0000
U2     .27735 .76422 .60929     .01475  .0239  .0086  .0117  .0005 -.0023 -.0017
U3     .25531 .51527 .24250     .01534  .0282  .0087  .0092 -.0003 -.0008 -.0006
U4     .25387 .51696 .51512     .01435  .0250  .0083  .0097  .0004  .0005  .0010
O1      .1684  .7423  .6263       .030   .045   .001   .043   .010   .005  -.001
O2      .1449  .4774  .2305       .032   .040   .046   .009   .005   .007  -.012
O3      .1203  .7522  .4109       .029   .023   .029   .034   .013  -.013   .003
O4      .3960  .7779  .6012       .029   .033   .032   .021   .004  -.011  -.003
O5      .3693  .5483  .2620       .024   .017   .027   .027   .000  -.012  -.017
O6      .1368  .5341  .5368       .021   .012   .026   .026   .003  -.010   .009
O7      .3473  .7327  .3479       .019   .006   .026   .024  -.001  -.003  -.009
O8      .3666  .4960  .4876       .028   .037   .024   .022   .001  -.003   .007
O9      .2417  .9217  .6212      .0124
OH10    .2137  .3604  .4705       .013
O11     .2730  .6734  .4989       .018
OH12    .2141  .5627  .3763       .016
OH13    .3057  .6004  .6460       .013
OH14    .1921  .6845  .2491       .017
OH15    .2108  .8792  .3133       .015
Wat16A      0   .738    .25 .33   .040
Wat16B      0   .683    .25 .60   .040
Wat17   .4953  .4039  .1489 .98   .040
Wat18  -.0163  .6641  .5496       .040
Wat19   .0233  .5480  .3758 .98   .040
Wat20   .5061  .6206  .4020 .70   .040
Wat22      .5  .8198    .25 .84   .040
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Metaschoepite
Download hom/metaschoepite.pdf
Klingensmith A L, Deely K M, Kinman W S, Kelly V, Burns P C
Download am/vol92/AM92_662.pdf
American Mineralogist 92 (2007) 662-669
Neptunium incorporation in sodium-substituted metaschoepite
Locality: synthetic
Sample: Na-Ms-AB1
_database_code_amcsd 0004318
14.6317 14.0147 16.6977 90 90 90 Pbcn
atom        x      y      z occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Na21    .5064  .6764  .2832 .58   .040
U1     .23479 .74265 .37739     .01824  .0275  .0125  .0147  .0005  .0000 -.0019
U2     .28370 .76835 .60448     .01861  .0327  .0126  .0105  .0020 -.0017 -.0018
U3     .25685 .51221 .24135     .01698  .0310  .0123  .0077  .0008 -.0012  .0001
U4     .25692 .51835 .51248     .02172  .0353  .0144  .0155 -.0006  .0005  .0009
O1      .1700  .7462  .6131       .042   .061   .021   .044   .006  -.026  -.010
O2      .1506  .4654  .2326       .037   .078   .014   .019   .016  -.016  -.009
O3      .1206  .7424  .4156       .024   .026   .022   .025  -.002   .014   .013
O4      .4025  .7837  .5983       .021   .043   .009   .010   .003   .001   .003
O5      .3715  .5586  .2508       .027   .017   .028   .034  -.013   .009  -.002
O6      .1415  .5477  .5317       .035   .034   .028   .044   .002  -.029   .018
O7      .3449  .7419  .3368       .024   .025   .025   .023   .000  -.010  -.013
O8      .3670  .4875  .4898       .049   .102   .030   .013   .000   .004   .002
O9      .2491  .9237  .6195       .033   .069   .024   .006  -.001   .002   .005
OH10    .2085  .3638  .4705       .023   .034   .011   .023   .001   .000  -.005
OH11    .2903  .6729  .4909       .042   .092   .016   .018  -.005  -.005   .004
OH12    .2147  .5635  .3747       .021   .043   .009   .011  -.001  -.001   .001
OH13    .3121  .6030  .6412       .020   .039   .008   .012  -.003   .000   .001
OH14    .1893  .6840  .2449       .018   .017   .018   .019  -.004  -.002   .006
OH15    .1907  .8840  .3156       .022
Wat16A      0   .755    .25 .26   .040
Wat16B      0   .662    .25 .74   .040
Wat17   .5008  .4049  .1450 .75   .040
Wat18  -.0183  .6485  .5637 .87   .040
Wat19   .0264  .5449  .3768 .89   .040
Wat20   .4983  .6369  .4152 .61   .040
Wat22      .5   .817    .25 .66   .040
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Metaschoepite
Download hom/metaschoepite.pdf
Klingensmith A L, Deely K M, Kinman W S, Kelly V, Burns P C
Download am/vol92/AM92_662.pdf
American Mineralogist 92 (2007) 662-669
Neptunium incorporation in sodium-substituted metaschoepite
Locality: synthetic
Sample: Na-Ms-AB2
_database_code_amcsd 0004319
14.6592 14.0358 16.7148 90 90 90 Pbcn
atom        x      y       z  occ   Uiso U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3)  U(2,3)
Na21     .510   .684    .276 .235   .040
U1     .23414 .74380 .374763      .01425  .0197 .01137 .01163 -.00003 -.00099 -.00143
U2     .28636 .76851  .60317      .01568  .0250 .01074 .01126  .00214 -.00102 -.00153
U3     .25637 .51220 .239215      .01576  .0276 .01094 .00872  .00096 -.00104  .00007
U4     .25652 .51717  .51109      .01603  .0249 .01192 .01126 -.00124  .00134  .00111
O1      .1683  .7458   .6126        .032   .031   .015   .049   -.001   -.011   -.002
O2      .1452  .4616   .2319       .0290   .035   .031   .021    .003   -.004   -.004
O3      .1225  .7450   .4163       .0202   .017   .021   .022    .000    .005    .005
O4      .4057  .7845   .5964       .0194   .020   .015   .023   -.004    .000    .003
O5      .3699  .5601   .2511       .0228   .031   .013   .025   -.003   -.004    .000
O6      .1407  .5489   .5293       .0266   .027   .027   .026    .000    .003   -.006
O7      .3449  .7463   .3310       .0261   .020   .031   .027    .001    .002   -.012
O8      .3721  .4840   .4895       .0293   .022   .041   .026    .005   -.002    .003
O9      .2524  .9225   .6175        .029   .063   .010   .013    .005    .003   -.001
OH10    .2053  .3617   .4685       .0187   .037   .007   .012    .003    .007    .002
OH11    .2966  .6736   .4881        .040   .091   .016   .012   -.008   -.026    .003
OH12    .2123  .5634   .3726       .0179   .035   .012   .007    .008    .002    .002
OH13    .3123  .6005   .6387       .0168   .030   .009   .011   -.004   -.001    .001
OH14    .1869  .6830   .2435       .0169   .022   .016   .012   -.007   -.001   -.001
OH15    .1880  .8848   .3135       .0180
Wat16A      0   .751     .25 .380   .040
Wat16B      0  .6543     .25  .48   .040
Wat17   .5004  .4164   .1427 .681   .040
Wat18  -.0234  .6449   .5705 .801   .040
Wat19   .0294  .5496   .3701 .777   .040
Wat20   .4959  .6404   .4199 .597   .040
Wat22      .5  .8089     .25  .51   .040
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Na[(UO2)4O2(OH)5](H2O)2
 
Burns P C, Deely K M
Download cm/vol40/CM40_1579.pdf
The Canadian Mineralogist 40 (2002) 1579-1586
A topologically novel sheet of uranyl pentagonal bipyramids
in the structure of Na[(UO2)4O2(OH)5](H2O)2
_database_code_amcsd 0005795
8.0746 8.4633 11.2191 80.398 87.492 71.308 P-1
atom        x     y     z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Na(1)   .4220 .9835 .1418 .028   .021   .029   .034  -.001  -.005  -.011
U(1)    .9616 .8725 .1450 .011   .015   .010   .010  -.003   .004  -.002
U(2)    .6822 .6054 .4211 .012   .013   .011   .011  -.003   .002  -.003
U(3)    .6741 .0695 .4169 .011   .013   .012   .011  -.005   .003  -.003
U(4)    .9414 .3401 .1365 .011   .014   .009   .011  -.003   .004  -.003
O(1)    .8098 .0313 .5488 .025
O(2)    .7466 .8969 .0941 .022
O(3)    .8151 .5090 .5537 .019
O(4)    .1682 .2344 .1565 .023
O(5)    .1780 .8387 .1955 .018
O(6)    .7079 .4508 .1091 .020
O(7)    .5562 .6982 .2796 .025
O(8)    .5559 .1065 .2702 .023
O(9)    .9207 .1362 .0436 .018
O(10)   .5823 .8508 .4847 .021
OH(11)  .0351 .5887 .0874 .017
OH(12)  .5669 .3783 .4201 .015
OH(13)  .9045 .1086 .2826 .013
OH(14)  .9155 .4389 .3138 .020
OH(15)  .8736 .7839 .3473 .013
Wat(16) .4816 .7854 .0005 .028
Wat(17) .3677 .4705 .1890 .027
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Zippeite
Download hom/zippeite.pdf
Burns P C, Deely K M, Hayden L A
Download cm/vol41/CM41_687.pdf
The Canadian Mineralogist 41 (2003) 687-706
The crystal chemistry of the zippeite group
_database_code_amcsd 0005847
8.7524 13.9197 17.6972 90 104.178 90 C2
atom         x     y      z occ Uiso
U(1)     .9214 .2948  .0865     .020
U(2)     .5874 .3261 -.0871     .018
U(3)    -.0782 .3345 -.4132     .013
U(4)    -.4120 .3028 -.5868     .014
S(1)     .2494 .3099 -.2488     .020
S(2)    -.7500 .3230 -.7491     .016
K(1)     .3091 .5603 -.0830 .39 .063
K(1A)    .2957 .5583 -.1366 .52 .035
K(2)     .1985 .5689 -.3673 .70 .049
K(2A)    .1852 .5686 -.4274 .30 .028
K(3)     .6781 .0586  .1270 .33 .029
K(3A)    .6138 .0628  .0442 .47 .106
O(1)    -.8216 .3818 -.7007     .022
O(2)    -.6749 .3819 -.7981     .020
O(3)     .3662 .3742 -.1956     .021
O(4)     .1382 .3781 -.2990     .018
O(5)    -.8684 .2635 -.7974     .021
O(6)     .3205 .2453 -.2995     .023
O(7)     .1742 .2406 -.2021     .021
O(8)     .8498 .3066 -.0444     .014
O(9)    -.6282 .2652 -.6978     .021
O(10)    .9157 .4190  .1107     .029
O(11)   -.1442 .2958 -.5441     .016
O(12)    .5819 .4533 -.0655     .023
O(13)   -.3534 .3199 -.4559     .012
O(14)    .5840 .2016 -.1150     .031
O(15)   -.0818 .2104 -.3892     .024
O(16)   -.4171 .4253 -.6171     .030
O(17)    .9152 .1707  .0676     .030
OH(18)   .6447 .2730  .0469     .021
O(19)   -.4073 .1831 -.5610     .025
O(20)   -.0642 .4614 -.4287     .022
Wat(21) -.1515 .0604 -.5940     .061
Wat(22)  .5217 .5611 -.2500     .090
Wat(23)  .0246 .5619 -.2549     .049
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Natrozippeite
Download hom/natrozippeite.pdf
Burns P C, Deely K M, Hayden L A
Download cm/vol41/CM41_687.pdf
The Canadian Mineralogist 41 (2003) 687-706
The crystal chemistry of the zippeite group
Sample : Sodium-zippeite
_database_code_amcsd 0005848
17.6425 14.6272 17.6922 90 104.461 90 P2_1/n
atom         x      y      z Uiso
U(1)     .3384  .2323  .8377 .010
U(2)     .2603  .2250  .0096 .011
U(3)     .5845  .2563  .8347 .010
U(4)     .4991  .2649  .0090 .012
U(5)     .8257  .2186  .8326 .013
U(6)     .7569  .2168  .0078 .011
U(7)     .9965  .2462  .0091 .011
U(8)     .0942  .2516  .8329 .011
S(1)     .9213  .2450  .1710 .008
S(2)     .6668  .2487  .6713 .015
S(3)     .1714  .2458  .6728 .013
S(4)     .4235  .2604  .1748 .018
Na(1)    .1795  .0228  .6734 .036
Na(2)    .9192  .0301  .1916 .032
Na(3)    .6705  .0145  .6745 .048
Na(4)    .2360  .5004  .9907 .046
Na(5)    .5668 -.0291  .8133 .043
O(1)     .7185  .2377  .8768 .013
O(2)     .2214  .2414  .8779 .015
O(3)     .5954  .3747  .8692 .018
O(4)     .8686  .2377  .9643 .022
O(5)     .8847  .3117  .2154 .020
O(6)     .2309  .1871  .7202 .019
O(7)     .2080  .3149  .6278 .018
O(8)     .1337  .3037  .7213 .018
O(9)     .8624  .1848  .1255 .018
O(10)    .4729  .2450  .8799 .013
O(11)    .3696  .2623  .9683 .017
O(12)    .7085  .3147  .6280 .019
O(13)    .3322  .3496  .8121 .021
O(14)    .7216  .1851  .7140 .018
O(15)    .0930  .3690  .8667 .019
O(16)    .3818  .3255  .2160 .018
O(17)    .4992  .1524  .0407 .020
O(18)    .6358  .3083  .7252 .021
O(19)    .4799  .2056  .2320 .022
O(20)    .9539  .3039  .1201 .018
O(21)    .9804  .1908  .2249 .020
O(22)    .3661  .2008  .1288 .020
O(23)    .1148  .1929  .6148 .019
O(24)    .7546  .0975  .9966 .019
O(25)    .4589  .3169  .1254 .027
O(26)    .9956  .3654  .9767 .022
O(27)    .5049  .3870  .9916 .015
O(28)    .2428  .3411  .0265 .017
O(29)    .6054  .2019  .6121 .024
O(30)    .2683  .1061  .9993 .020
O(31)    .0030  .1325  .0427 .027
O(32)    .8352  .3363  .8148 .024
O(33)    .3437  .1129  .8528 .023
O(34)    .5723  .1437  .7954 .024
O(35)    .8250  .0989  .8445 .021
O(36)    .7528  .3328  .0271 .030
O(37)    .0887  .1392  .7969 .016
OH(1)    .6162  .2071  .9681 .012
OH(2)    .1173  .2052  .9675 .010
OH(3)    .9711  .2025  .8742 .015
Wat(1)   .7841  .0122  .1888 .031
Wat(2)   .0414  .0053  .6702 .027
Wat(3)   .6972 -.0229  .8079 .036
Wat(4)   .5305  .0063  .6683 .031
Wat(5)   .0480  .0022  .1788 .051
Wat(6)   .1412 -.0129  .5355 .038
Wat(7)   .1204  .5020  .0309 .034
Wat(8)   .5990  .0173  .9523 .042
Wat(9)   .3089  .0227  .6512 .033
Wat(10)  .8885 -.0189  .0471 .033
Wat(11)  .7943  .0069  .6457 .041
Wat(12)  .4353 -.0215  .8036 .043
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Zippeite
Download hom/zippeite.pdf
Burns P C, Deely K M, Hayden L A
Download cm/vol41/CM41_687.pdf
The Canadian Mineralogist 41 (2003) 687-706
The crystal chemistry of the zippeite group
Sample: SZIPPNH4I
_database_code_amcsd 0005849
8.6987 14.166 17.847 90 104.117 90 C2/m
atom         x     y      z Uiso
U(1)     .6663 .2319  .3347 .011
U(2)     .3339 .2681  .1654 .011
S(1)         0 .2549      0 .020
S(2)         0 .2361    1/2 .007
NH4(1)   .7250   1/2  .5051 .029
NH4(2)   .3040     0  .0118 .026
NH4(3)   .5490     0  .1598 .036
NH4(4)   .4490   1/2  .3265 .022
O(1)    -.1139 .1755  .4461 .012
O(2)    -.1234 .3177 -.0481 .024
O(3)     .4020 .2433  .2947 .018
O(4)    -.0690 .1929  .0488 .021
O(5)    -.0771 .2973  .5474 .015
O(6)     .6000 .2395  .2053 .008
O(7)     .6560 .1050  .3197 .021
O(8)     .3530 .3950  .1786 .019
O(9)     .3090 .1461  .1381 .021
O(10)    .6830 .3549  .3581 .021
Wat(11)  .9370   1/2  .4011 .033
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Zippeite
Download hom/zippeite.pdf
Burns P C, Deely K M, Hayden L A
Download cm/vol41/CM41_687.pdf
The Canadian Mineralogist 41 (2003) 687-706
The crystal chemistry of the zippeite group
Sample: SZIPPNH4II
_database_code_amcsd 0005850
14.2520 8.7748 17.1863 90 90 90 Cmca
atom       x      y     z Uiso
U(1)   .2325  .1268 .4138 .014
S(1)     1/4  .3812   1/4 .021
O(1)   .2434  .3756 .4552 .037
O(2)   .3086  .4696 .3003 .032
O(3)   .1868  .2814 .2993 .020
O(4)   .1070  .1244 .4313 .029
O(5)   .3527  .1286 .3862 .035
NH4(1)     0  .1350 .2504 .091
NH4(2)     0 -.1650 .4030 .119
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Magnesiozippeite
Download hom/magnesiozippeite.pdf
Burns P C, Deely K M, Hayden L A
Download cm/vol41/CM41_687.pdf
The Canadian Mineralogist 41 (2003) 687-706
The crystal chemistry of the zippeite group
Sample: Magnesium-zippeite
_database_code_amcsd 0005851
8.6514 14.1939 17.7211 90 104.131 90 C2/m
atom         x     y      z Uiso
U(1)     .6671 .2324  .3349 .009
U(2)     .3329 .2674  .1651 .010
S(1)         0 .2600      0 .006
S(2)         0 .2552     .5 .011
Mg(1)    .6898    .5  .3783 .027
Mg(2)    .3070     0  .1290 .019
O(1)     .8791 .1883  .4509 .020
O(2)    -.1198 .3168 -.0505 .014
O(3)     .3960 .2399  .2944 .007
O(4)    -.0757 .1960  .0475 .015
O(5)     .9339 .3130  .5515 .016
O(6)     .6010 .2423  .2052 .011
O(7)     .6558 .1083  .3186 .017
O(8)     .3420 .3936  .1813 .020
O(9)     .3156 .1438  .1369 .021
O(10)    .6855 .3568  .3633 .016
Wat(11)  .7023    .5  .4884 .028
Wat(12)  .3460     0  .0103 .046
Wat(13)  .5522     0  .1564 .034
Wat(14)  .4602    .5  .3210 .031
Wat(15)  .9320    .5  .3873 .029
Wat(16)  .1713     0  .2384 .046
Wat(17)  .0661     0  .0749 .033
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Zinczippeite
Download hom/zinczippeite.pdf
Burns P C, Deely K M, Hayden L A
Download cm/vol41/CM41_687.pdf
The Canadian Mineralogist 41 (2003) 687-706
The crystal chemistry of the zippeite group
Sample: Zinc-zippeite
_database_code_amcsd 0005852
8.6437 14.1664 17.701 90 104.041 90 C2/m
atom         x     y      z Uiso
U(1)     .6667 .2320  .3347 .017
U(2)     .3332 .2682  .1650 .016
S(1)         0 .2638      0 .032
S(2)         0 .2508     .5 .006
Zn(1)    .6907    .5  .3768 .033
Zn(2)    .3095     0  .1207 .039
O(1)     .8760 .1891  .4526 .015
O(2)    -.1150 .3206 -.0541 .027
O(3)     .3950 .2391  .2947 .020
O(4)    -.0750 .1982  .0488 .017
O(5)     .9320 .3155  .5500 .024
O(6)     .6030 .2392  .2058 .016
O(7)     .6470 .1046  .3186 .023
O(8)     .3400 .3930  .1825 .027
O(9)     .3260 .1417  .1387 .017
O(10)    .6990 .3560  .3688 .024
Wat(11)  .7130    .5  .4919 .026
Wat(12)  .3500     0  .0089 .035
Wat(13)  .5510     0  .1546 .024
Wat(14)  .4540    .5  .3217 .037
Wat(15)  .9350    .5  .3903 .032
Wat(16)  .1730     0  .2412 .045
Wat(17)  .0680     0  .0762 .031
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Cobaltzippeite
Download hom/cobaltzippeite.pdf
Burns P C, Deely K M, Hayden L A
Download cm/vol41/CM41_687.pdf
The Canadian Mineralogist 41 (2003) 687-706
The crystal chemistry of the zippeite group
Sample: Cobalt-zippeite
_database_code_amcsd 0005853
8.650 14.252 17.742 90 104.092 90 C2/m
atom         x     y      z Uiso
U(1)     .6674 .2317  .3353 .019
U(2)     .3337 .2684  .1654 .010
S(1)         0 .2467      0 .020
S(2)         0 .2400     .5 .020
Co(1)    .6940    .5  .3737 .031
Co(2)    .3080     0  .1261 .029
O(1)    -.8770 .1790  .4520 .022
O(2)    -.1150 .3120 -.0490 .013
O(3)     .3920 .2400  .2915 .032
O(4)    -.0760 .1992  .0535 .012
O(5)     .9430 .3145  .5459 .014
O(6)     .6010 .2414  .2035 .006
O(7)     .6640 .1098  .3190 .015
O(8)     .3520 .3905  .1830 .028
O(9)     .3100 .1445  .1400 .016
O(10)    .6820 .3527  .3680 .020
Wat(11)  .7130    .5  .5010 .060
Wat(12)  .3340     0  .0140 .044
Wat(13)  .5590     0  .1560 .032
Wat(14)  .4600    .5  .3230 .017
Wat(15)  .9350    .5  .3860 .036
Wat(16)  .1610     0  .2350 .060
Wat(17)  .0630     0  .0726 .020
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Magnesiozippeite
Download hom/magnesiozippeite.pdf
Burns P C, Deely K M, Hayden L A
Download cm/vol41/CM41_687.pdf
The Canadian Mineralogist 41 (2003) 687-706
The crystal chemistry of the zippeite group
Sample: SZIPPMg
_database_code_amcsd 0005854
8.6457 17.2004 18.4642 90 102.119 90 P2_1/c
atom         x     y      z Uiso
U(1)     .3788 .5738  .2579 .011
U(2)     .1205 .4062  .2373 .011
U(3)    -.1358 .5746  .2292 .011
U(4)     .6337 .4055  .2652 .011
Mg(1)    .2070 .3953  .4503 .021
Mg(2)    .2791 .6082  .0461 .019
S(1)     .6218 .7404  .2421 .014
S(2)     .1207 .7403  .2393 .016
O(1)     .7585 .3084  .7116 .023
O(2)     .3755 .4449  .2480 .014
O(3)     .6240 .5331  .2437 .019
O(4)     .3277 .5966  .1589 .019
O(5)     .0749 .4163  .1369 .016
O(6)     .1634 .3857  .3356 .017
O(7)    -.0430 .2869  .2115 .020
O(8)     .1253 .5347  .2490 .016
O(9)     .4269 .5612  .3579 .017
O(10)   -.0910 .6035  .3250 .016
O(11)    .5910 .3721  .1698 .018
O(12)    .8078 .2924  .3077 .022
O(13)    .5047 .7908  .1951 .021
O(14)    .7371 .7900  .2925 .021
O(15)    .6773 .4262  .3644 .019
O(16)    .8759 .4462  .2473 .015
O(17)   -.1802 .5573  .1312 .018
O(18)    .0071 .6891  .1910 .018
O(19)    .6983 .6933  .1929 .021
O(20)    .5485 .6898  .2907 .019
Wat(21)  .2289 .6217 -.0653 .025
Wat(22)  .2624 .3983  .5625 .025
Wat(23) -.0281 .3738  .4620 .039
Wat(24)  .2604 .2781  .4460 .035
Wat(25)  .5069 .5729  .0387 .037
Wat(26)  .3551 .7212  .0589 .032
Wat(27)  .0114 .2414  .0667 .050
Wat(28)  .2000 .4932  .0298 .029
Wat(29)  .4470 .4253  .4573 .036
Wat(30)  .1485 .5127  .4378 .037
Wat(31)  .0460 .6409  .0460 .030
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Magnesiozippeite
Download hom/magnesiozippeite.pdf
Burns P C, Deely K M, Hayden L A
Download cm/vol41/CM41_687.pdf
The Canadian Mineralogist 41 (2003) 687-706
The crystal chemistry of the zippeite group
Sample: SZIPPMg
_database_code_amcsd 0005854
8.6457 17.2004 18.4642 90 102.119 90 P2_1/c
atom         x     y      z Uiso
U(1)     .3788 .5738  .2579 .011
U(2)     .1205 .4062  .2373 .011
U(3)    -.1358 .5746  .2292 .011
U(4)     .6337 .4055  .2652 .011
Mg(1)    .2070 .3953  .4503 .021
Mg(2)    .2791 .6082  .0461 .019
S(1)     .6218 .7404  .2421 .014
S(2)     .1207 .7403  .2393 .016
O(1)     .7585 .3084  .7116 .023
O(2)     .3755 .4449  .2480 .014
O(3)     .6240 .5331  .2437 .019
O(4)     .3277 .5966  .1589 .019
O(5)     .0749 .4163  .1369 .016
O(6)     .1634 .3857  .3356 .017
O(7)    -.0430 .2869  .2115 .020
O(8)     .1253 .5347  .2490 .016
O(9)     .4269 .5612  .3579 .017
O(10)   -.0910 .6035  .3250 .016
O(11)    .5910 .3721  .1698 .018
O(12)    .8078 .2924  .3077 .022
O(13)    .5047 .7908  .1951 .021
O(14)    .7371 .7900  .2925 .021
O(15)    .6773 .4262  .3644 .019
O(16)    .8759 .4462  .2473 .015
O(17)   -.1802 .5573  .1312 .018
O(18)    .0071 .6891  .1910 .018
O(19)    .6983 .6933  .1929 .021
O(20)    .5485 .6898  .2907 .019
Wat(21)  .2289 .6217 -.0653 .025
Wat(22)  .2624 .3983  .5625 .025
Wat(23) -.0281 .3738  .4620 .039
Wat(24)  .2604 .2781  .4460 .035
Wat(25)  .5069 .5729  .0387 .037
Wat(26)  .3551 .7212  .0589 .032
Wat(27)  .0114 .2414  .0667 .050
Wat(28)  .2000 .4932  .0298 .029
Wat(29)  .4470 .4253  .4573 .036
Wat(30)  .1485 .5127  .4378 .037
Wat(31)  .0460 .6409  .0460 .030
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Cobaltzippeite
Download hom/cobaltzippeite.pdf
Burns P C, Deely K M, Hayden L A
Download cm/vol41/CM41_687.pdf
The Canadian Mineralogist 41 (2003) 687-706
The crystal chemistry of the zippeite group
Sample: Cobalt-zippeite
_database_code_amcsd 0005853
8.650 14.252 17.742 90 104.092 90 C2/m
atom         x     y      z Uiso
U(1)     .6674 .2317  .3353 .019
U(2)     .3337 .2684  .1654 .010
S(1)         0 .2467      0 .020
S(2)         0 .2400     .5 .020
Co(1)    .6940    .5  .3737 .031
Co(2)    .3080     0  .1261 .029
O(1)    -.8770 .1790  .4520 .022
O(2)    -.1150 .3120 -.0490 .013
O(3)     .3920 .2400  .2915 .032
O(4)    -.0760 .1992  .0535 .012
O(5)     .9430 .3145  .5459 .014
O(6)     .6010 .2414  .2035 .006
O(7)     .6640 .1098  .3190 .015
O(8)     .3520 .3905  .1830 .028
O(9)     .3100 .1445  .1400 .016
O(10)    .6820 .3527  .3680 .020
Wat(11)  .7130    .5  .5010 .060
Wat(12)  .3340     0  .0140 .044
Wat(13)  .5590     0  .1560 .032
Wat(14)  .4600    .5  .3230 .017
Wat(15)  .9350    .5  .3860 .036
Wat(16)  .1610     0  .2350 .060
Wat(17)  .0630     0  .0726 .020
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Zinczippeite
Download hom/zinczippeite.pdf
Burns P C, Deely K M, Hayden L A
Download cm/vol41/CM41_687.pdf
The Canadian Mineralogist 41 (2003) 687-706
The crystal chemistry of the zippeite group
Sample: Zinc-zippeite
_database_code_amcsd 0005852
8.6437 14.1664 17.701 90 104.041 90 C2/m
atom         x     y      z Uiso
U(1)     .6667 .2320  .3347 .017
U(2)     .3332 .2682  .1650 .016
S(1)         0 .2638      0 .032
S(2)         0 .2508     .5 .006
Zn(1)    .6907    .5  .3768 .033
Zn(2)    .3095     0  .1207 .039
O(1)     .8760 .1891  .4526 .015
O(2)    -.1150 .3206 -.0541 .027
O(3)     .3950 .2391  .2947 .020
O(4)    -.0750 .1982  .0488 .017
O(5)     .9320 .3155  .5500 .024
O(6)     .6030 .2392  .2058 .016
O(7)     .6470 .1046  .3186 .023
O(8)     .3400 .3930  .1825 .027
O(9)     .3260 .1417  .1387 .017
O(10)    .6990 .3560  .3688 .024
Wat(11)  .7130    .5  .4919 .026
Wat(12)  .3500     0  .0089 .035
Wat(13)  .5510     0  .1546 .024
Wat(14)  .4540    .5  .3217 .037
Wat(15)  .9350    .5  .3903 .032
Wat(16)  .1730     0  .2412 .045
Wat(17)  .0680     0  .0762 .031
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Magnesiozippeite
Download hom/magnesiozippeite.pdf
Burns P C, Deely K M, Hayden L A
Download cm/vol41/CM41_687.pdf
The Canadian Mineralogist 41 (2003) 687-706
The crystal chemistry of the zippeite group
Sample: Magnesium-zippeite
_database_code_amcsd 0005851
8.6514 14.1939 17.7211 90 104.131 90 C2/m
atom         x     y      z Uiso
U(1)     .6671 .2324  .3349 .009
U(2)     .3329 .2674  .1651 .010
S(1)         0 .2600      0 .006
S(2)         0 .2552     .5 .011
Mg(1)    .6898    .5  .3783 .027
Mg(2)    .3070     0  .1290 .019
O(1)     .8791 .1883  .4509 .020
O(2)    -.1198 .3168 -.0505 .014
O(3)     .3960 .2399  .2944 .007
O(4)    -.0757 .1960  .0475 .015
O(5)     .9339 .3130  .5515 .016
O(6)     .6010 .2423  .2052 .011
O(7)     .6558 .1083  .3186 .017
O(8)     .3420 .3936  .1813 .020
O(9)     .3156 .1438  .1369 .021
O(10)    .6855 .3568  .3633 .016
Wat(11)  .7023    .5  .4884 .028
Wat(12)  .3460     0  .0103 .046
Wat(13)  .5522     0  .1564 .034
Wat(14)  .4602    .5  .3210 .031
Wat(15)  .9320    .5  .3873 .029
Wat(16)  .1713     0  .2384 .046
Wat(17)  .0661     0  .0749 .033
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Natrozippeite
Download hom/natrozippeite.pdf
Burns P C, Deely K M, Hayden L A
Download cm/vol41/CM41_687.pdf
The Canadian Mineralogist 41 (2003) 687-706
The crystal chemistry of the zippeite group
Sample : Sodium-zippeite
_database_code_amcsd 0005848
17.6425 14.6272 17.6922 90 104.461 90 P2_1/n
atom         x      y      z Uiso
U(1)     .3384  .2323  .8377 .010
U(2)     .2603  .2250  .0096 .011
U(3)     .5845  .2563  .8347 .010
U(4)     .4991  .2649  .0090 .012
U(5)     .8257  .2186  .8326 .013
U(6)     .7569  .2168  .0078 .011
U(7)     .9965  .2462  .0091 .011
U(8)     .0942  .2516  .8329 .011
S(1)     .9213  .2450  .1710 .008
S(2)     .6668  .2487  .6713 .015
S(3)     .1714  .2458  .6728 .013
S(4)     .4235  .2604  .1748 .018
Na(1)    .1795  .0228  .6734 .036
Na(2)    .9192  .0301  .1916 .032
Na(3)    .6705  .0145  .6745 .048
Na(4)    .2360  .5004  .9907 .046
Na(5)    .5668 -.0291  .8133 .043
O(1)     .7185  .2377  .8768 .013
O(2)     .2214  .2414  .8779 .015
O(3)     .5954  .3747  .8692 .018
O(4)     .8686  .2377  .9643 .022
O(5)     .8847  .3117  .2154 .020
O(6)     .2309  .1871  .7202 .019
O(7)     .2080  .3149  .6278 .018
O(8)     .1337  .3037  .7213 .018
O(9)     .8624  .1848  .1255 .018
O(10)    .4729  .2450  .8799 .013
O(11)    .3696  .2623  .9683 .017
O(12)    .7085  .3147  .6280 .019
O(13)    .3322  .3496  .8121 .021
O(14)    .7216  .1851  .7140 .018
O(15)    .0930  .3690  .8667 .019
O(16)    .3818  .3255  .2160 .018
O(17)    .4992  .1524  .0407 .020
O(18)    .6358  .3083  .7252 .021
O(19)    .4799  .2056  .2320 .022
O(20)    .9539  .3039  .1201 .018
O(21)    .9804  .1908  .2249 .020
O(22)    .3661  .2008  .1288 .020
O(23)    .1148  .1929  .6148 .019
O(24)    .7546  .0975  .9966 .019
O(25)    .4589  .3169  .1254 .027
O(26)    .9956  .3654  .9767 .022
O(27)    .5049  .3870  .9916 .015
O(28)    .2428  .3411  .0265 .017
O(29)    .6054  .2019  .6121 .024
O(30)    .2683  .1061  .9993 .020
O(31)    .0030  .1325  .0427 .027
O(32)    .8352  .3363  .8148 .024
O(33)    .3437  .1129  .8528 .023
O(34)    .5723  .1437  .7954 .024
O(35)    .8250  .0989  .8445 .021
O(36)    .7528  .3328  .0271 .030
O(37)    .0887  .1392  .7969 .016
OH(1)    .6162  .2071  .9681 .012
OH(2)    .1173  .2052  .9675 .010
OH(3)    .9711  .2025  .8742 .015
Wat(1)   .7841  .0122  .1888 .031
Wat(2)   .0414  .0053  .6702 .027
Wat(3)   .6972 -.0229  .8079 .036
Wat(4)   .5305  .0063  .6683 .031
Wat(5)   .0480  .0022  .1788 .051
Wat(6)   .1412 -.0129  .5355 .038
Wat(7)   .1204  .5020  .0309 .034
Wat(8)   .5990  .0173  .9523 .042
Wat(9)   .3089  .0227  .6512 .033
Wat(10)  .8885 -.0189  .0471 .033
Wat(11)  .7943  .0069  .6457 .041
Wat(12)  .4353 -.0215  .8036 .043
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: 19
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