American Mineralogist Crystal Structure Database

18 matching records for this search.

Andradite
Download hom/andradite.pdf
Galuskina I O, Galuskin E V, Dzierzanowski P, Armbruster T, Kozanecki M
Download am/vol90/AM90_1688.pdf
American Mineralogist 90 (2005) 1688-1692
A natural scandian garnet
_database_code_amcsd 0003948
12.331 12.331 12.331 90 90 90 Ia-3d
atom      x     y     z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
CaA    .875     0   .75  .99 .0174  .0131  .0195  .0195      0      0  .0047
MgA    .875     0   .75  .01 .0174  .0131  .0195  .0195      0      0  .0047
Fe3+B     0     0     0 .332 .0119  .0119  .0119  .0119  .0006  .0006  .0006
ZrB       0     0     0 .292 .0119  .0119  .0119  .0119  .0006  .0006  .0006
Ti4+B     0     0     0 .147 .0119  .0119  .0119  .0119  .0006  .0006  .0006
ScB       0     0     0 .077 .0119  .0119  .0119  .0119  .0006  .0006  .0006
CrB       0     0     0 .076 .0119  .0119  .0119  .0119  .0006  .0006  .0006
MgB       0     0     0 .047 .0119  .0119  .0119  .0119  .0006  .0006  .0006
Fe2+B     0     0     0 .020 .0119  .0119  .0119  .0119  .0006  .0006  .0006
HfB       0     0     0 .004 .0119  .0119  .0119  .0119  .0006  .0006  .0006
VB        0     0     0 .002 .0119  .0119  .0119  .0119  .0006  .0006  .0006
SiT    .125     0   .75 .633 .0100  .0069  .0115  .0115      0      0      0
AlT    .125     0   .75 .140 .0100  .0069  .0115  .0115      0      0      0
Ti4+T  .125     0   .75 .120 .0100  .0069  .0115  .0115      0      0      0
Fe3+T  .125     0   .75 .107 .0100  .0069  .0115  .0115      0      0      0
O     .0366 .0493 .6539      .0194  .0210  .0132  .0241 -.0027  .0057 -.0015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Dovyrenite
 
Kadiyski M, Armbruster T, Galuskin E V, Pertsev N N, Zadov A E, Galuskina I O,
Wrzalik R, Dzierzanowski P, Kislov E V
Download am/vol93/AM93_456.pdf
American Mineralogist 93 (2008) 456-462
The modular structure of dovyrenite, Ca6Zr[Si2O7]2(OH)4: alternate stacking of
tobermorite and rosenbuschite-like units
Locality: skarndolomite xenoliths, Dovyren massif, Russia
_database_code_amcsd 0004531
5.666 18.844 3.728 90 90 90 Pnnm
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   .1796 .1958     0     .0114  .0116  .0160  .0065  .0025      0      0
Ca2      .5    .5     0  .5 .0170  .0080  .0310  .0120 -.0070      0      0
Ca3       0    .5    .5  .5 .0156  .0238  .0063  .0166  .0015      0      0
Zr3       0    .5    .5  .5 .0156  .0238  .0063  .0166  .0015      0      0
Si    .1699 .3593 .0703  .5 .0102  .0140  .0086  .0080  .0026 -.0023  .0015
O1   -.0497 .3081     0     .0140  .0190  .0150  .0090  .0000      0      0
OH2   .1730 .0636     0     .0300  .0490  .0120  .0310 -.0010      0      0
O3    .4153 .3204     0     .0140  .0120  .0140  .0150  .0040      0      0
O4    .1480 .4389 .1060  .5 .0160  .0230  .0120  .0150 -.0080  .0000 -.0100
O5    .1560 .3807    .5  .5 .0250  .0310  .0250  .0190  .0190      0      0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Bitikleite
 
Galuskina I O, Galuskin E V, Armbruster T, Lazic B, Dzierzanowski P,
Gazeev V M, Prusik K, Pertsev N N, Winiarski A, Zadov A E, Wrzalik R, Gurbanov A G
 
American Mineralogist 95 (2010) 959-967
Bitikleite-(SnAl) and bitikleite-(ZrFe): New garnets from xenoliths of the
Upper Chegem volcanic structure, Kabardino-Balkaria, Northern Caucasus, Russia
Locality: Kabardino-Balkaria, Northern Caucasus, Russia
_database_code_amcsd 0005051
12.5240 12.5240 12.5240 90 90 90 Ia3d
atom     x     y     z  occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
CaX   .125     0   .25       .0116  .0096  .0126  .0126      0      0  .0026
SnY      0     0     0 .681 .00699  .0069  .0069  .0069 .00000 .00000 .00000
TiY      0     0     0 .319 .00699  .0069  .0069  .0069 .00000 .00000 .00000
FeZ   .375     0   .25 .462  .0073  .0053  .0083  .0083      0      0      0
AlZ   .375     0   .25 .538  .0073  .0053  .0083  .0083      0      0      0
O    .0323 .0503 .6516       .0144  .0144  .0149  .0139 -.0009  .0017 -.0004
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Kimseyite
 
Galuskina I O, Galuskin E V, Armbruster T, Lazic B, Kusz J, Dzierzanowski P,
Gazeev V M, Pertsev N N, Prusik K, Zadov A E, Winiarski A, Wrzalik R, Gurbanov A G
 
American Mineralogist 95 (2010) 1172-1181
Elbrusite-(Zr) - A new uranian garnet from the Upper Chegem caldera,
Kabardino-Balkaria, Northern Caucasus, Russia
Locality: Upper Chegem caldera, Kabardino-Balkaria, Northern Caucasus, Russia
_database_code_amcsd 0016810
12.5965 12.5965 12.5965 90 90 90 Ia3d
atom     x     y     z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
CaX   .125     0   .25      .0170  .0125  .0192  .0192      0      0  .0042
ZrY      0     0     0 .678 .0127  .0127  .0127  .0127  .0003  .0003  .0003
UY       0     0     0 .106 .0127  .0127  .0127  .0127  .0003  .0003  .0003
NbY      0     0     0 .019 .0127  .0127  .0127  .0127  .0003  .0003  .0003
SnY      0     0     0 .096 .0127  .0127  .0127  .0127  .0003  .0003  .0003
TiY      0     0     0 .078 .0127  .0127  .0127  .0127  .0003  .0003  .0003
HfY      0     0     0 .008 .0127  .0127  .0127  .0127  .0003  .0003  .0003
ScY      0     0     0 .009 .0127  .0127  .0127  .0127  .0003  .0003  .0003
SiZ   .375     0   .25 .170 .0142  .0106  .0160  .0160      0      0      0
AlZ   .375     0   .25 .158 .0142  .0106  .0160  .0160      0      0      0
FeZ   .375     0   .25 .582 .0142  .0106  .0160  .0160      0      0      0
TiZ   .375     0   .25 .090 .0142  .0106  .0160  .0160      0      0      0
O    .0332 .0508 .6528       .026   .026   .026   .026 -.0038  .0006 -.0039
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Vorlanite
 
Galuskin E V, Armbruster T, Galuskina I O, Lazic B, Winiarski A, Gazeev V M,
Dzierzanowski P, Zadov A E, Pertzev N N, Wrzalik R, Gurbanov A G, Janeczek J
 
American Mineralogist 96 (2011) 188-196
Vorlanite (Ca(U6+)O4 - A new mineral from the Upper Chegem caldera,
Kabardino-Balkaria, Northern Caucasus, Russia
Note: fluorite structure
Locality: Upper Chegem caldera, Kabardino-Balkaria, Northern Caucasus, Russia
_database_code_amcsd 0017876
5.3813 5.3813 5.3813 90 90 90 Fm-3m
atom   x   y   z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
U      0  .5   0 .47 .0179  .0179  .0179  .0179      0      0      0
Ca     0  .5   0 .53 .0179  .0179  .0179  .0179      0      0      0
O    .25 .25 .25      .057   .057   .057   .057      0      0      0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Kilchoanite
Download hom/kilchoanite.pdf
Galuskin E V, Gfeller F, Savelyeva V B, Armbruster T, Lazic B, Galuskina I O,
Tobbens D M, Zadov A E, Dzierzanowski P, Pertsev N N, Gazeev V M
 
American Mineralogist 97 (2012) 503-512
Pavlovskyite Ca8(SiO4)2(Si3O10): a new mineral of altered silicate-carbonate
xenoliths from the two Russian type localities, Birkhin massif,
Baikal Lake area and Upper Chegem caldera, North Caucasus
Locality: Birkhin massif, Baikal Lake area, North Caucasus, Russia
_database_code_amcsd 0018882
11.4525 5.08670 21.9963 90 90 90 I2cm
atom       x      y       z   Uiso U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3)  U(2,3)
Ca1   .01150      0       0 .00918 .00699 .01065 .00991       0       0  .00053
Ca2   .31064 .99909     .25 .00740 .00655 .00839 .00727  .00055       0       0
Ca3   .03527 .00353 .168222 .00937 .01124 .00687 .01001  .00010 -.00375 -.00149
Ca4  .241867 .49751 .104083 .00734 .00696 .00721 .00783 -.00073  .00062 -.00018
Si1   .12152 .42774     .25 .00589 .00658 .00511 .00598 -.00013       0       0
Si2   .43213 .94159 .100328 .00624 .00661 .00527 .00685  .00017 -.00017  .00003
Si3   .26486      0       0 .00626 .00650 .00613 .00616       0       0 -.00015
O1    .18816 .29836  .19132 .00859  .0098  .0087  .0073   .0004   .0013   .0000
O2    .99064  .2935     .25 .00872  .0064  .0091  .0106  -.0004       0       0
O3    .12178  .7475     .25 .00947  .0118  .0061  .0105   .0003       0       0
O4    .36993 .80255  .15865 .00880  .0104  .0089  .0070  -.0010   .0014   .0000
O5    .05900 .69266  .09191 .00949  .0069  .0091  .0125  -.0009   .0007  -.0010
O6    .35498 .81255  .04103 .00821  .0097  .0075  .0074  -.0001  -.0019   .0003
O7    .42751 .25721  .09613 .00901  .0096  .0061  .0113   .0003  -.0011  -.0001
O8    .18431 .17820  .04188 .01153  .0089  .0125  .0132  -.0001   .0008  -.0055
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pavlovskyite
 
Galuskin E V, Gfeller F, Savelyeva V B, Armbruster T, Lazic B, Galuskina I O,
Tobbens D M, Zadov A E, Dzierzanowski P, Pertsev N N, Gazeev V M
 
American Mineralogist 97 (2012) 503-512
Pavlovskyite Ca8(SiO4)2(Si3O10): a new mineral of altered silicate-carbonate
xenoliths from the two Russian type localities, Birkhin massif,
Baikal Lake area and Upper Chegem caldera, North Caucasus
Locality: Birkhin massif, Baikal Lake area, North Caucasus, Russia
_database_code_amcsd 0018883
5.08510 11.4165 28.6408 90 90 90 Pbcn
atom      x      y      z   Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ca1  .49692 .71708 .44226 .01152  .0123  .0096  .0127 -.0002  .0001  .0003
Ca2       0     .5     .5 .01216  .0107  .0137  .0121 -.0007 -.0021 -.0021
Ca3  .99397 .48889 .37768 .01380  .0112  .0150  .0152  .0004  .0013  .0045
Ca4  .50366 .28416 .33030 .01147  .0116  .0100  .0128 -.0005  .0002 -.0008
Ca5       0 .51645    .25 .01329  .0142  .0105  .0152      0  .0004      0
Si1  .57130 .40471 .44237 .01033  .0098  .0098  .0113  .0004 -.0004  .0006
Si2  .44100 .59487 .32685 .01072  .0098  .0102  .0122 -.0005 -.0001  .0008
Si3      .5 .76288    .25  .0104  .0113  .0093  .0106      0 -.0009      0
O1    .7049 .53615 .44034  .0129  .0121  .0107  .0158  .0002  .0005  .0013
O2    .7027  .3358 .39786  .0138  .0121  .0151  .0141  .0013 -.0003 -.0018
O3    .7018 .34189 .48832  .0129  .0124  .0126  .0138  .0008 -.0008  .0006
O4    .2523  .4051 .44082  .0124  .0082  .0151  .0140  .0018 -.0007 -.0003
O5    .3015  .6569 .37139  .0141  .0126  .0165  .0133  .0006  .0004 -.0004
O6    .3092  .4676 .32021  .0142  .0119  .0120  .0186  .0007 -.0005 -.0001
O7    .3118 .67239 .28132  .0123  .0096  .0126  .0146 -.0005  .0005  .0016
O8    .7570  .5992 .32323  .0129  .0109  .0123  .0155 -.0008  .0002  .0021
O9    .6745  .8431 .28283  .0168  .0176  .0130  .0199  .0000 -.0060  .0005
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Edgrewite
 
Galuskin E V, Lazic B, Armbruster T, Galuskina I O, Pertsev N N, Gazeev V M,
Wlodyka R, Dulski M, Dzierzanowski P, Zadov A E, Dubrovinsky L S
 
American Mineralogist 97 (2012) 1998-2006
Edgrewite Ca9(SiO4)4F2-hydroxyledgrewite Ca9(SiO4)4(OH)2, a new series
of calcium humite-group minerals from altered xenoliths in the ignimbrite
of Upper Chegem caldera, Northern Caucasus, Kabardino-Balkaria, Russia
Locality: Upper Chegem caldera, Northern Caucasus, Kabardino-Balkaria, Russia
_database_code_amcsd 0019557
5.0687 11.3579 15.4004 100.598 90 90 P2_1/b
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      0     .5     .00692  .0044  .0098  .0075   .0002  -.0010  .0039
Ca2  .49508 .94666 .27370     .00698 .00458  .0082 .00785  .00077  .00088 .00066
Ca3  .00478 .13653 .17283     .00645 .00553 .00596 .00842  .00040 -.00017 .00282
Ca4  .50769 .25407 .38901     .00606 .00513 .00561 .00779 -.00014 -.00006 .00211
Ca5  .49245 .87168 .04256     .00696 .00614  .0075 .00770  .00003 -.00082 .00270
Si1  .07123 .06835 .38955     .00430  .0017  .0053  .0064 -.00007 -.00003  .0024
Si2  .07549 .17901 .83411     .00466  .0023  .0052  .0070  .00021  .00012  .0026
O1    .7511 .06609 .38803      .0074  .0032  .0092  .0101  -.0002  -.0005  .0027
O2    .2986 .43501 .38809      .0062  .0054  .0047  .0092  -.0003   .0004  .0035
O3    .2028 .11311 .30359      .0070  .0059  .0082  .0078  -.0007   .0004  .0038
O4    .2017 .15466 .47638      .0073  .0054  .0090  .0077   .0002   .0001  .0016
O5    .2550 .32030 .16362      .0075  .0044  .0077  .0113   .0000  -.0001  .0041
O6    .7950 .95261 .16185      .0068  .0071  .0041  .0100   .0002   .0011  .0031
O7    .7041 .28081 .25414      .0073  .0061  .0078  .0087   .0007  -.0002  .0033
O8    .7073 .23059 .08118      .0067  .0059  .0079  .0065   .0001  -.0002  .0023
O9    .2285  .0404  .0445 .52  .0092
F9    .2619  .0459  .0585 .48  .0092
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Hydroxyledgrewite
 
Galuskin E V, Lazic B, Armbruster T, Galuskina I O, Pertsev N N, Gazeev V M,
Wlodyka R, Dulski M, Dzierzanowski P, Zadov A E, Dubrovinsky L S
 
American Mineralogist 97 (2012) 1998-2006
Edgrewite Ca9(SiO4)4F2-hydroxyledgrewite Ca9(SiO4)4(OH)2, a new series
of calcium humite-group minerals from altered xenoliths in the ignimbrite
of Upper Chegem caldera, Northern Caucasus, Kabardino-Balkaria, Russia
Locality: Upper Chegem caldera, Northern Caucasus, Kabardino-Balkaria, Russia
_database_code_amcsd 0019558
5.0672 11.3545 15.3941 100.587 90 90 P2_1/b
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       0      .5      .00884 .00786 .01119 .00793  .00046 -.00111  .00293
Ca2  .49509 .946623 .273691      .00896 .00786 .01000 .00823  .00077  .00119 -.00042
Ca3  .00492 .136528 .172791      .00835 .00902 .00734 .00887  .00047 -.00022  .00193
Ca4  .50779 .254077 .388989      .00798 .00870 .00686 .00835 -.00025 -.00018  .00133
Ca5  .49252 .871677 .042505      .00889 .00966 .00912 .00793  .00025 -.00081  .00165
Si1  .07117  .06837 .389501      .00639 .00570 .00672 .00670  .00009 -.00008  .00109
Si2  .07545  .17905 .834060      .00666 .00596 .00678 .00712  .00000  .00019  .00099
O1   .75075  .06615  .38795      .00930  .0063  .0113  .0104   .0003  -.0003   .0021
O2   .29857  .43467  .38816      .00824  .0083  .0068  .0097  -.0002   .0000   .0016
O3   .20261  .11343  .30367      .00882  .0087  .0100  .0083  -.0005   .0002   .0030
O4   .20156  .15466  .47629      .00917  .0089  .0092  .0089  -.0005  -.0002   .0003
O5   .25522  .32029  .16366      .00967  .0068  .0104  .0117   .0000  -.0005   .0019
O6   .79505  .95277  .16192      .00910  .0097  .0070  .0105   .0001   .0003   .0014
O7   .70380  .28052  .25421      .00910  .0093  .0099  .0083   .0006   .0000   .0024
O8   .70743  .23048  .08132      .00904  .0087  .0091  .0086   .0001   .0001  -.0002
O9    .2309  .04123   .0463 .608  .0100
F9    .2672   .0464   .0594 .392  .0100
H1     .091   -.012    .023  .60    .22
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Pertsevite-(OH)
 
Galuskina I O, Kadiyski M, Armbruster T, Galuskin E V, Pertsev N N,
Dzierzanowski P, Wrzalik R
 
European Journal of Mineralogy 20 (2008) 951-964
A new natural phase in the system Mg2SiO4-Mg2BO3F-Mg2BO3(OH): composition,
paragenesis and structure of OH-dominant pertsevite
Locality: East Vekhoyan'ye region, northern Siberia
_database_code_amcsd 0007266
20.494 11.890 4.5880 90 90 90 Pnma
atom       x       y      z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Mg1   .37724   .2500  .0193      .0130  .0113  .0110  .0168   .000  .0012   .000
Mg2   .37760 -.02284  .0173      .0128  .0167  .0107  .0110 -.0012 -.0019  .0010
Mg3   .24737  .11148  .0326      .0129  .0100  .0126  .0160 -.0013 -.0005 -.0008
Mg4  -.01370  .12252 -.0079      .0145  .0122  .0140  .0173 -.0005 -.0002 -.0021
Mg5   .11879   .2500  .0133      .0154  .0136  .0155  .0171   .000 -.0017   .000
B1     .3446   .0856 -.4362 .856 .0102
B2     .0243   .2202   .456 .271 .0102
B2A    .4766   -.034  -.076 .144 .0102
B3     .1851   .2500  -.433  .57 .0102
Si1    .3325   .1243 -.3968 .113 .0102
Si2    .0350   .2500  .4291 .398 .0102
Si3    .2104   .2500 -.3917 .404 .0102
O1    .20521   .2500  .2686      .0167  .0200  .0145  .0155   .000 -.0026   .000
O2    .33513  .11208  .2687      .0151  .0146  .0185  .0121 -.0020  .0003  .0002
O3    .03173   .2500 -.2384      .0147  .0135  .0144  .0164   .000  .0017   .000
O4    .32872 -.14794  .2301      .0158  .0157  .0172  .0144  .0007  .0000  .0025
O5    .40017  .11717 -.2806      .0146  .0139  .0165  .0135 -.0002  .0014  .0000
O6    .46568   .2500  .2054      .0150  .0148  .0143  .0159   .000 -.0037   .000
O7    .46278 -.00783  .2486      .0108  .0095  .0087  .0141  .0019 -.0040 -.0006
O8     .4216  -.1257  -.271 .271 .0099
O8A    .4302   -.109  -.233  .14 .0099
O8B    .4312  -.1486 -.2066 .602 .0099
O9    .30137  .01635 -.2816      .0139  .0149  .0138  .0130 -.0021 -.0015 -.0010
O10   .28769   .2500 -.1984      .0254   .030  .0202   .026   .000  .0048   .000
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Chegemite
Download hom/chegemite.pdf
Galuskin E V, Gazeev V M, Lazic B, Armbruster T, Galuskina I O, Zadov A E,
Pertsev N N, Wrzalik R, Dzierzanowski P, Gurbanov A G, Bzowska G
 
European Journal of Mineralogy 21 (2009) 1045-1059
Chegemite Ca7(SiO4)3(OH)2 - a new humite-group mineral from the Northern Caucasus,
Kabardino-Balkaria, Russia
Locality: in the high-temperature skarns in calcareous xenoliths in ignimbrites of
the Upper Chegem volcanic structure, Northern Caucasus, Kabardino-Balkaria, Russia
_database_code_amcsd 0007334
5.0696 11.3955 23.5571 90 90 90 Pbnm
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   .50376 .37818 .176543     .00886 .00768 .01069 .00821 -.00048 -.00120 -.00192
Ca2  -.50687 .65807     .25     .00771 .00827 .00673 .00813  .00048    .000    .000
Ca3  -.00244 .59346 .111399     .00850 .00964 .00691 .00895 -.00077  .00066  .00051
Ca4   .50746 .36064 .027895     .00915 .00957 .00944 .00843 -.00042  .00127  .00022
Si1  -.07130 .47112     .25     .00608  .0047  .0067  .0069  .00016    .000    .000
Si2   .07409 .27988 .107074     .00620 .00551 .00669 .00640 -.00003 -.00011 -.00006
O1    -.7511 .47020     .25      .0094  .0071  .0111  .0100   .0001    .000    .000
O2    -.2981 .83850     .25      .0083  .0082  .0078  .0089   .0001    .000    .000
O3   -.20219 .53681  .19476     .00867  .0093  .0090  .0077   .0008  -.0001   .0011
O4     .7539 .27935  .10590      .0094  .0066  .0103  .0112  -.0002  -.0006  -.0002
O5    .20452 .41215  .10440     .00884  .0088  .0077  .0100   .0004  -.0002  -.0006
O6    .29695 .71759  .16372     .00896  .0086  .0099  .0084   .0001  -.0003   .0013
O7    .20452 .21020  .05265     .00905  .0087  .0096  .0089  -.0001   .0004  -.0018
F8     .7518 .53095  .03410 .12  .0214  .0259  .0109  .0274  -.0042  -.0193   .0030
O8     .7518 .53095  .03410 .88  .0214  .0259  .0109  .0274  -.0042  -.0193   .0030
H1      .912   .502    .019 .44   .050
H2      .619   .540   .0593 .44   .050
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Chlorkyuygenite
 
Galuskin E V, Galuskina I O, Kusz J, Gfeller F, Armbruster T, Bailau R, Dulski M,
Gazeev V M, Pertsev N N, Zadov A E, Dzierzanowski P
 
European Journal of Mineralogy 27 (2015) 113-122
Mayenite supergroup, part II: Chlorkyuygenite from Upper Chegem, Northern Caucasus,
Kabardino-Balkaria, Russia, a new microporous mineral with "zeolitic" H2O
Locality: Upper Chegem Caldera, Northern Caucasus, Russia
_database_code_amcsd 0020461
12.0285 12.0285 12.0285 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)
Ca1  .14823      0    .25      .01311  .0140  .0156  .0098      0      0 .00203
Al1  .26765 .26765 .26765 .903  .0077  .0077  .0077  .0077 .00009 .00009 .00009
Fe1  .26765 .26765 .26765 .097  .0077  .0077  .0077  .0077 .00009 .00009 .00009
Al2    .125     .5    .25 .937  .0074  .0064  .0079  .0079      0      0      0
Si2    .125     .5    .25 .063  .0074  .0064  .0079  .0079      0      0      0
O1   .30513 .21402 .40002       .0203  .0167  .0242  .0199 -.0096 -.0067  .0138
O2   .18464 .18464 .18464       .0147  .0147  .0147  .0147 -.0018 -.0018 -.0018
Cl1    .375      0    .25 .397  .0298  .0158  .0368  .0368      0      0      0
Wat1   .375      0    .25 .603  .0298  .0158  .0368  .0368      0      0      0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Fluorkyuygenite
 
Galuskin E V, Gfeller F, Armbruster T, Galuskina I O, Vapnik Y, Dulski M, Murashko M,
Dzierzanowski P, Sharygin V V, Krivovichev S V, Wirth R
 
European Journal of Mineralogy 27 (2015) 123-136
Mayenite supergroup, part III: fluormayenite, Ca12Al14O32[[]4F2], and
fluorkyuygenite, Ca12Al14O32[(H2O)4F2], two new minerals from pyrometamorphic
rocks of the Hatrurim Complex, South Levant
Locality: Negev Desert, Hatrurim Basin, Arad, Israel
_database_code_amcsd 0020494
11.966 11.966 11.966 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)
Ca1   .1546      0    .25  .661 .0125   .015  .0106  .0118      0      0  .0008
Ca1a  .1877      0    .25  .339 .0125   .015  .0106  .0118      0      0  .0008
Al1  .27006 .27006 .27006  .944 .0087  .0087  .0087  .0087  .0018  .0018  .0018
Fe1  .27006 .27006 .27006  .056 .0087  .0087  .0087  .0087  .0018  .0018  .0018
Al2    .125     .5    .25 .9626 .0093  .0065  .0107  .0107      0      0      0
Si2    .125     .5    .25 .0374 .0093  .0065  .0107  .0107      0      0      0
O1    .3077  .2122  .3997       .0350  .0288  .0454  .0310 -.0246 -.0198  .0311
O2    .1870  .1870  .1870       .0121  .0121  .0121  .0121  .0015  .0015  .0015
F      .375      0    .25 .3157 .0339   .014   .044   .044      0      0      0
OH     .375      0    .25 .0493 .0339   .014   .044   .044      0      0      0
Wat    .375      0    .25  .635 .0339   .014   .044   .044      0      0      0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Fluormayenite
 
Galuskin E V, Gfeller F, Armbruster T, Galuskina I O, Vapnik Y, Dulski M, Murashko M,
Dzierzanowski P, Sharygin V V, Krivovichev S V, Wirth R
 
European Journal of Mineralogy 27 (2015) 123-136
Mayenite supergroup, part III: fluormayenite, Ca12Al14O32[[]4F2], and
fluorkyuygenite, Ca12Al14O32[(H2O)4F2], two new minerals from pyrometamorphic
rocks of the Hatrurim Complex, South Levant
Locality: Jabel Harmun, Judean Mountains, Palestinian Autonomy, Israel
_database_code_amcsd 0020495
11.9894 11.9894 11.9894 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)
Ca1  .13974      0    .25 .7559 .01153  .0138  .0120  .0088      0      0 .00028
Na1  .13974      0    .25 .0031 .01153  .0138  .0120  .0088      0      0 .00028
Ca1a  .1835      0    .25  .241 .01153  .0138  .0120  .0088      0      0 .00028
Al1  .26832 .26832 .26832 .9594 .00754 .00754 .00754 .00754 .00119 .00119 .00119
Fe1  .26832 .26832 .26832 .0338 .00754 .00754 .00754 .00754 .00119 .00119 .00119
Mg1  .26832 .26832 .26832  .005 .00754 .00754 .00754 .00754 .00119 .00119 .00119
Al2   .1250     .5    .25        .0079  .0071  .0083  .0083      0      0      0
O1   .30716 .21386 .40079        .0150  .0115  .0173  .0163 -.0044 -.0034  .0082
O2   .18567 .18567 .18567  .885  .0114  .0114  .0114  .0114 -.0020 -.0020 -.0020
OH2a   .121   .218   .296 .0575   .102  .0114  .0114  .0114 -.0020 -.0020 -.0020
F2a    .121   .218   .296 .0575   .102   .003   .028   .028      0      0      0
OHW   .3750      0    .25 .1209   .020   .003   .028   .028      0      0      0
FW    .3750      0    .25 .1209   .020   .003   .028   .028      0      0      0
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Dellaite
Download hom/dellaite.pdf
Armbruster T, Lazic B, Gfeller F, Galuskin E V, Galuskina I O,
Savelyeva V B, Zadov A E, Pertsev N N, Dzierzanowski P
 
Mineralogical Magazine 75 (2011) 379-394
Chlorine content and crystal chemistry of dellaite from the Birkhin
gabbro massif, Eastern Siberia, Russia
Note: Cl-free dellaite
Locality: the Birkhin gabbro massif, Eastern Siberia, Russia
_database_code_amcsd 0018879
6.8155 6.9363 12.8904 90.652 97.659 98.195 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)
Ca1  .08078 .19501 .10167 .01175 .01179 .00962 .01384 .00088 .00468 .00299
Ca2  .19107 .20688 .48981 .01202 .01053 .01064 .01462 .00028 .00181 .00275
Ca3  .89363 .46847 .29036 .01160 .00861 .01672 .00922 .00005 .00239 .00048
Ca4  .55859 .03393 .32091 .01210 .01715 .00823 .01085 .00044 .00417 .00095
Ca5  .31655 .19088 .87633 .01045 .01159 .00971 .01031 .00048 .00466 .00009
Ca6  .59254 .47476 .70369 .01015 .01043 .01190 .00880 .00234 .00298 .00044
Si1  .61470 .28863 .09768 .00786 .00845 .00782 .00741 .00031 .00247 .00060
Si2  .81039 .28402 .88458 .00744 .00768 .00700 .00773 .00023 .00275 .00016
Si3  .71566 .29857 .50878 .00753 .00792 .00707 .00770 .00009 .00258 .00057
O1   .61764 .48774 .16476 .01056  .0120  .0096  .0103  .0011  .0031  .0015
O2   .39215 .18998 .05336 .01277  .0103  .0152  .0120  .0011  .0018  .0017
O3   .61669 .18463 .80559 .01069  .0111  .0094  .0107  .0011  .0013  .0004
O4   .74537 .15293 .17621 .01106  .0120  .0099  .0113  .0017  .0015  .0012
O5   .98600 .14945 .91036 .01181  .0100  .0107  .0153  .0024  .0025  .0005
Oh6  .23019 .16600 .30036  .0162  .0226  .0139  .0127  .0035  .0037  .0006
O7   .84627 .12816 .48669  .0146  .0116  .0095  .0238  .0020  .0062  .0010
Oh8  .19208 .20696 .68570 .01360  .0144  .0129  .0131  .0004  .0030  .0007
O9   .52307 .21540 .56576 .01119  .0104  .0113  .0118  .0013  .0044  .0006
O10  .74708 .33538 .99990  .0145  .0172  .0161  .0107  .0008  .0075  .0005
O11  .64136 .36964 .39136 .01223  .0138  .0143  .0089  .0017  .0029  .0016
O12  .83545 .48247 .58191 .01078  .0116  .0089  .0112  .0015  .0021  .0015
O13  .11403 .51184 .16863 .01025  .0113  .0091  .0101  .0016  .0037  .0007
H6     .195   .045   .282   .051
H8     .083   .113   .683   .045
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Dellaite
Download hom/dellaite.pdf
Armbruster T, Lazic B, Gfeller F, Galuskin E V, Galuskina I O,
Savelyeva V B, Zadov A E, Pertsev N N, Dzierzanowski P
 
Mineralogical Magazine 75 (2011) 379-394
Chlorine content and crystal chemistry of dellaite from the Birkhin
gabbro massif, Eastern Siberia, Russia
Note: Cl-containing dellaite
Locality: the Birkhin gabbro massif, Eastern Siberia, Russia
_database_code_amcsd 0018880
6.8126 6.9416 12.9412 90.582 97.552 98.251 P-1
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  .07780 .19575 .09934      .01086  .0097  .0107  .0124  .0006  .0037  .0020
Ca2  .18816 .21087 .49388      .01389  .0081  .0124  .0200  .0005  .0018  .0070
Ca3  .89386 .46554 .28978      .01003  .0061  .0169  .0068  .0006  .0007  .0014
Ca4  .56112 .03221 .32089      .01060  .0140  .0101  .0070  .0009  .0016  .0009
Ca5  .31574 .19225 .87654      .00886  .0090  .0102  .0075  .0001  .0029  .0017
Ca6  .59179 .47259 .70343      .00864  .0078  .0128  .0059  .0029  .0016  .0020
Si1  .61338 .28801 .09718      .00662  .0053  .0088  .0056  .0002  .0010  .0005
Si2  .80890 .28349 .88451      .00601  .0049  .0080  .0051  .0002  .0011  .0008
Si3  .71427 .29736 .50829      .00578  .0048  .0072  .0053  .0009  .0004  .0009
O1    .6176  .4862 .16456       .0084  .0089  .0111  .0059  .0031  .0011  .0007
O2    .3910  .1896 .05319       .0105  .0068  .0142  .0088  .0035  .0001  .0001
O3    .6154  .1853 .80662       .0087  .0071  .0120  .0063  .0004  .0003  .0011
O4    .7434  .1515 .17546       .0091  .0078  .0096  .0098  .0025  .0003  .0016
O5    .9847  .1496 .91059       .0098  .0061  .0100  .0131  .0023  .0010  .0015
Cl6   .1899  .1406  .3002 .252  .0132
Oh6   .2344  .1702  .3005 .748  .0132
O7    .8426  .1252  .4851       .0133  .0110  .0090  .0208  .0031  .0032  .0006
Oh8   .1917  .2084  .6868 .966  .0160  .0181  .0179  .0119  .0016  .0020  .0015
Cl8   .1917  .2084  .6868 .034  .0160  .0181  .0179  .0119  .0016  .0020  .0015
O9    .5212  .2156 .56584       .0098  .0081  .0117  .0091  .0010  .0017  .0013
O10   .7460  .3359 .99966       .0127  .0139  .0185  .0063  .0002  .0057  .0009
O11   .6411  .3710 .39196       .0108  .0102  .0160  .0064  .0024  .0010  .0023
O12   .8375  .4795 .58140       .0101  .0117  .0109  .0065  .0024  .0009  .0003
O13   .1151  .5122 .16844       .0084  .0093  .0118  .0034  .0001  .0001  .0009
H6     .238   .040   .280  .75    .05
H8     .080   .111   .682  .97    .09
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Galuskinite
 
Lazic B, Armbruster T, Savelyeva V B, Zadov A E, Pertsev N N, Dzierzanowski P
 
Mineralogical Magazine 75 (2011) 2631-2648
Galuskinite, Ca7(SiO4)3(CO3), a new skarn mineral from the Birkhin gabbro massif,
Eastern Siberia, Russia
Locality: Birkhin gabbro massif, Eastern Siberia, Russia
_database_code_amcsd 0018535
18.7872 6.7244 10.4673 90 90.7880 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)
Ca1   .25320 .99544  .03445      .01055  .0119  .0096  .0101  .00018  .00086 -.00121
Ca2   .00225 .49318 -.29336      .01029  .0112  .0092  .0105 -.00087  .00147 -.00053
Ca3   .46782 .94041  .25248      .01130  .0150  .0093  .0096  .00025  .00180 -.00016
Ca4   .18601 .34203  .24622      .01206  .0124  .0097  .0141  .00056 -.00002 -.00007
Ca5  -.08011 .34023 -.00397      .01214  .0130  .0086  .0148  .00061  .00017 -.00061
Ca6   .41771 .23372 -.00793      .01298  .0099  .0152  .0139 -.00049  .00050   .0051
Ca7   .26033 .51157 -.05254      .01028  .0097  .0095  .0117  .00051  .00092 -.00014
Si1   .42237 .74899 -.00051      .00795  .0080  .0075  .0083   .0004   .0009   .0000
Si2   .17238 .71963 -.25559      .00809  .0092  .0068  .0083  -.0003   .0014   .0001
Si3   .09001 .22209  .00646      .00823  .0082  .0071  .0093  -.0002   .0011  -.0002
O1    .37171  .9182   .0636       .0138  .0127  .0130  .0158   .0041   .0015  -.0016
O2    .37975  .5666 -.06914       .0122  .0106  .0117  .0143  -.0020   .0012  -.0016
O3    .52592  .1483  .10652       .0128  .0141  .0144  .0099  -.0036   .0024   .0016
O4    .47714  .6661  .10925       .0117  .0117  .0113  .0120   .0020   .0007   .0017
O5    .20363  .0054  .23703       .0113  .0145  .0082  .0113  -.0019   .0014   .0001
O6    .21195  .8270  -.1359       .0142  .0174  .0125  .0127   .0010  -.0031  -.0032
O7   -.08658  .2693   .2339       .0133  .0102  .0114  .0184   .0000   .0015   .0001
O8   -.19184  .3392 -.11325       .0128  .0159  .0107  .0118   .0021   .0011  -.0016
O9    .07252  .9886   .0047       .0141  .0148  .0097  .0180  -.0013   .0016  -.0003
O10   .17363  .2609  -.0245       .0127  .0097  .0119  .0166  -.0016   .0017   .0012
O11   .03815  .3388 -.09493       .0127  .0131  .0132  .0119   .0012  -.0003   .0025
O12   .07182  .3198  .14611       .0129  .0139  .0129  .0119   .0010   .0021  -.0022
O13   .30111  .3108  .13532       .0131  .0147  .0130  .0116   .0001  -.0008   .0013
O14   .30607  .3051   .3491       .0133  .0125  .0137  .0137   .0000   .0015  -.0012
O15   .40565  .2799   .2365       .0159  .0111  .0174  .0191   .0008   .0015  -.0004
C     .33806  .3005   .2405       .0113  .0098  .0120  .0122   .0007   .0007   .0001
Wat    .3372   .681    .253 .109   .028
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Vapnikite
 
Galuskin E V, Galuskina I O, Kusz J, Armbruster T, Marzec K M, Dzierzanowski P, Murashko M
 
Mineralogical Magazine 78 (2014) 571-581
Vapnikite Ca3UO6 - a new double-perovskite mineral from pyrometamorphic larnite
rocks of the Jabel Harum, Palestinian Autonomy, Israel
Locality: Hatrurim Formation, Israel
_database_code_amcsd 0020159
5.739 5.951 8.312 90 90.4 90 P2_1/n
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  .5138 .5507 .2409 .978 .0140  .0144  .0085  .0192   .0041  .0023  -.0020
U1'   .495  .569  .294 .022 .0140  .0144  .0085  .0192   .0041  .0023  -.0020
Ca2     .5     0     0 .920 .0062  .0076  .0059  .0052  -.0012 -.0005   .0007
U2      .5     0     0 .080 .0062  .0076  .0059  .0052  -.0012 -.0005   .0007
U3       0    .5     0 .832 .0039  .0048  .0030  .0039 -.00027  .0009 -.00009
Ca3      0    .5     0 .168 .0039  .0048  .0030  .0039 -.00027  .0009 -.00009
O1   .1776 .2117 .9211      .0258   .021   .025   .031    .006 -.0072   -.013
O2   .2958 .6800 .9428      .0279   .025   .025   .034   -.011   .014   -.014
O3   .3729 .9288 .2658  .93 .0129   .018   .006   .014   .0036  .0016   .0014
O3A    .53  .005  .273  .07 .0129   .018   .006   .014   .0036  .0016   .0014
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Download in:

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: 18
View in amc, download in amc

Return to AMCSD Home Page