American Mineralogist Crystal Structure Database

26 matching records for this search.

Bavenite
Download hom/bavenite.pdf
Armstrong J A, Friis H, Lieb A, Finch A A, Weller M T
 
American Mineralogist 95 (2010) 519-526
Combined single-crystal X-ray and neutron powder diffraction structure analysis
exemplified through full structure determinations of
framework and layer beryllate minerals
Locality: Ilimaussaq alkaline complex, South Greenland
_database_code_amcsd 0005039
23.1965 4.9741 19.4221 90 90 90 Cmcm
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   .08223 .25504 .15368     .01166  .0130  .0167  .0053 -.0029 -.0004  .0007
Si1T1      0  .7747    .25      .0091  .0079  .0123  .0071      0      0      0
Be1T2  .1243  .8228    .25     .01079   .009   .017   .007   .001      0      0
BeT3       0  .7213 .10447  .5 .00593  .0053  .0102  .0023      0      0  .0003
AlT3       0  .7213 .10447 .25 .00593  .0053  .0102  .0023      0      0  .0003
SiT3       0  .7213 .10447 .25 .00593  .0053  .0102  .0023      0      0  .0003
SiT4  .09395     .5      0 .75 .01079  .0133  .0137  .0054      0      0  .0000
AlT4  .09395     .5      0 .25 .01079  .0133  .0137  .0054      0      0  .0000
Si3T5 .17045      0      0     .00943  .0092  .0146  .0045      0      0 -.0014
Si4T6 .21395  .8627 .14410      .0084  .0092  .0123  .0037 -.0002  .0003  .0002
O1         0  .5747 .18217     .00885  .0079  .0134  .0052      0      0 -.0010
O2         0  .0360 .10927     .01115  .0110  .0139  .0085      0      0  .0015
O3    .05783  .5960 .06927     .01223  .0120  .0162  .0085  .0016  .0030 -.0007
O4    .13132  .2378 .03387     .01215  .0132  .0163  .0070  .0016  .0008 -.0034
O5    .20858  .8728 .06086     .01121  .0123  .0163  .0051  .0000 -.0002  .0004
O6    .23302  .5612 .16604     .01084  .0117  .0130  .0079 -.0001  .0022  .0010
O7    .15420  .9410 .18013     .01063  .0124  .0136  .0058  .0013  .0026  .0019
O8    .12101  .4963    .25      .0099  .0094   .013  .0077  .0000      0      0
O9    .05790  .9578    .25     .00924  .0095  .0141  .0041  .0004      0      0
H1     .3413   .938    .25       .019
H2         0   .099   .069  .5   .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)
 
Bavenite
Download hom/bavenite.pdf
Cannillo E, Coda A, Fagnani G
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0365-110X&volume=20&spage=301
Acta Crystallographica 20 (1966) 301-309
The crystal structure of bavenite
_database_code_amcsd 0009299
23.19 5.005 19.39 90 90 90 Cmcm
atom     x     y     z Biso U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3)  U(2,3)
Ca   .0842 .2425 .1524 1.29 .01440 .02234 .01225  .00000  .00000  .00125
Be2  .1252 .8218   .25 1.37 .02402 .01597 .01210  .00389       0       0
Al4  .0958    .5     0  .97 .01000 .01689 .01000       0       0  .00024
Si1      0 .7802   .25  .77 .00490 .01440 .01000       0       0       0
Si3      0 .7227 .1047  .92 .01000 .01690 .00810       0       0       0
Si5  .1704     0     0  .94 .00810 .01956 .00813       0       0  .00060
Si6  .2141 .8539 .1428  .81 .00816 .01433 .00810 -.00065  .00000  .00000
O1       0 .5769 .1830  .88 .01690 .00758 .00881       0       0 -.00169
O2       0 .0302 .1139 1.36 .01690 .02250 .01210       0       0  .00000
O3   .0572 .5976 .0718 1.47 .01902 .02371 .01300  .00352  .00485 -.00035
O4   .1314 .2298 .0361 1.29 .01618 .01952 .01325  .00335  .00218  .00238
O5   .2081 .8636 .0598 1.21 .01381 .01827 .01390  .00255 -.00131 -.00022
O6   .2337 .5575 .1646 1.18 .01058 .02129 .01290 -.00102  .00056  .00343
O7   .1547 .9245 .1799 1.14 .01396 .01588 .01344 -.00135  .00072  .00123
O8   .1211 .4868   .25 1.22 .01059 .01631 .01960 -.00192       0       0
O9   .0586 .9504   .25  .91 .00813 .01210 .01440  .00034       0       0
H     .100  .267   .25
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Bavenite
Download hom/bavenite.pdf
Lussier A J, Hawthorne F C
 
Mineralogical Magazine 75 (2011) 213-239
Short-range constraints on chemical and structural variations in bavenite
Locality: Rincon, San Diego County, California
Sample: 2ABAV
_database_code_amcsd 0019874
23.2080 4.9833 19.4266 90 90 90 Cmcm
atom      x      y      z   occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2)  U(1,3) U(2,3)
Na   .08316 .25083 .15316 .0125 .01349  .0146  .0136  .0122 -.0012 -.00107  .0017
Ca   .08316 .25083 .15316  .985 .01349  .0146  .0136  .0122 -.0012 -.00107  .0017
SiT1      0  .7762    .25        .0086  .0081  .0086  .0092      0       0      0
BeT2 .12460  .8188    .25        .0074  .0067   .009   .007 -.0008       0      0
SiT3      0  .7224 .10362 .5945  .0083  .0091  .0087  .0072      0       0 -.0002
BeT3      0  .7224 .10362 .4055  .0083  .0091  .0087  .0072      0       0 -.0002
SiT4 .09415     .5      0 .4105  .0065  .0089  .0055  .0052      0       0  .0002
AlT4 .09415     .5      0 .5895  .0065  .0089  .0055  .0052      0       0  .0002
SiT5 .17025      0      0        .0099  .0108  .0101  .0089      0       0 -.0009
SiT6 .21413 .85950 .14428       .00859  .0092  .0081  .0084  .0003   .0009  .0002
O1        0  .5757 .18208        .0098  .0138  .0085  .0073      0       0 -.0024
O2        0  .0366 .11016        .0127  .0121  .0093  .0168      0       0 -.0011
O3   .05747  .5972 .06905        .0144  .0172  .0136  .0124  .0043   .0044  .0007
O4   .13055  .2394 .03389        .0143  .0160  .0141  .0130  .0031  -.0001 -.0029
O5   .20832  .8702 .06111        .0139  .0165  .0162  .0090  .0021   .0006  .0011
O6   .23315  .5583 .16618        .0115  .0131  .0078  .0135  .0024   .0025  .0012
O7   .15428  .9349 .18009        .0121  .0119  .0127  .0117  .0034   .0048  .0023
O8   .12108  .4919    .25        .0113  .0108  .0073  .0159 -.0004       0      0
O9   .05802  .9555    .25        .0087  .0086  .0084  .0091 -.0007       0      0
H8    .1627   .459    .25         .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Bavenite
Download hom/bavenite.pdf
Lussier A J, Hawthorne F C
 
Mineralogical Magazine 75 (2011) 213-239
Short-range constraints on chemical and structural variations in bavenite
Locality: Ilimaussaq, Kangerluarsuk Fjord, Greenland
Sample: 7BAV
_database_code_amcsd 0019875
23.2028 4.9805 19.4290 90 90 90 Cmcm
atom      x      y      z    occ   Uiso U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3) U(2,3)
Na   .08264 .25225 .15336   .006 .01283 .01287 .01479 .01083 -.00195 -.00051 .00133
Ca   .08264 .25225 .15336 .97925 .01283 .01287 .01479 .01083 -.00195 -.00051 .00133
SiT1      0 .77468    .25        .00850  .0067  .0081  .0107       0       0      0
BeT2 .12434  .8213    .25         .0106  .0108  .0106  .0105  -.0001       0      0
SiT3      0 .72113 .10437    .77  .0087  .0080  .0095  .0087       0       0  .0006
BeT3      0 .72113 .10437    .23  .0087  .0080  .0095  .0087       0       0  .0006
SiT4 .09400     .5      0  .2595  .0071  .0085  .0070  .0057       0       0  .0002
AlT4 .09400     .5      0  .7405  .0071  .0085  .0070  .0057       0       0  .0002
SiT5 .17025      0      0        .00960  .0089  .0106  .0093       0       0 -.0016
SiT6 .21395 .86185 .14400        .00858  .0082  .0089 .00862  .00011  .00094 .00035
O1        0  .5746 .18229         .0099  .0115  .0100  .0082       0       0 -.0006
O2        0  .0364 .10970         .0129  .0112  .0100  .0175       0       0  .0010
O3   .05766  .5957 .06957         .0147  .0148  .0154  .0138   .0039   .0043  .0011
O4   .13101  .2369 .03407         .0145  .0142  .0154  .0140   .0043   .0008 -.0034
O5   .20826  .8718 .06072         .0139  .0140  .0186  .0092   .0018  -.0005  .0004
O6   .23320  .5603 .16554         .0120  .0122  .0093  .0145   .0019   .0023  .0014
O7   .15437  .9381 .18009         .0126  .0110  .0132  .0136   .0022   .0041  .0022
O8   .12121  .4935    .25         .0116  .0098  .0086  .0165  -.0004       0      0
O9   .05806  .9560    .25         .0093  .0072  .0096  .0112  -.0001       0      0
H8    .1619   .441    .25          .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Bavenite
Download hom/bavenite.pdf
Lussier A J, Hawthorne F C
 
Mineralogical Magazine 75 (2011) 213-239
Short-range constraints on chemical and structural variations in bavenite
Locality: Government Pit, Albany, New Hampshire
Sample: 10BAV
_database_code_amcsd 0019876
23.2068 4.9929 19.4340 90 90 90 Cmcm
atom      x      y      z    occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Na   .08343 .24779 .15288 .00925 .01301  .0141  .0118  .0131 -.0010 -.0006  .0013
Ca   .08343 .24779 .15288  .9865 .01301  .0141  .0118  .0131 -.0010 -.0006  .0013
SiT1      0  .7773    .25         .0088  .0090  .0075  .0098      0      0      0
BeT2  .1248  .8179    .25         .0092   .011   .005   .012  .0014      0      0
SiT3      0  .7228 .10419   .701  .0080  .0093  .0059  .0089      0      0  .0001
BeT3      0  .7228 .10419  .4055  .0080  .0093  .0059  .0089      0      0  .0001
SiT4 .09465     .5      0  .4105  .0078  .0103  .0058  .0074      0      0  .0003
AlT4 .09465     .5      0   .299  .0078  .0103  .0058  .0074      0      0  .0003
SiT5 .17020      0      0         .0098  .0107  .0087  .0101      0      0 -.0012
SiT6 .21404 .85830 .14362        .00903  .0099  .0070  .0102  .0005  .0004  .0004
O1        0  .5758 .18238         .0105  .0126  .0098  .0091      0      0  -.002
O2        0  .0360 .11158         .0129  .0126  .0073  .0189      0      0 -.0002
O3   .05771  .5981 .07017         .0140   .016  .0116   .015  .0046  .0043  .0007
O4   .13117  .2345 .03488         .0143   .017  .0123  .0141  .0034  .0014 -.0026
O5   .20825  .8683 .06049         .0140   .016  .0152  .0103  .0022 -.0010  .0009
O6   .23340  .5581 .16530         .0119  .0138  .0067   .015  .0021  .0008  .0015
O7   .15449  .9320 .18001         .0121  .0124  .0105   .013  .0015  .0038  .0022
O8   .12110  .4900    .25         .0121  .0101  .0090  .0171 -.0015      0      0
O9   .05832  .9538    .25         .0094  .0092  .0064  .0126  -.000      0      0
H8    .1627  .4572    .25          .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Bavenite
Download hom/bavenite.pdf
Lussier A J, Hawthorne F C
 
Mineralogical Magazine 75 (2011) 213-239
Short-range constraints on chemical and structural variations in bavenite
Locality: Kalisay, Kyrgizstan
Sample: 11BAV
_database_code_amcsd 0019877
23.2110 4.9721 19.4189 90 90 90 Cmcm
atom      x      y      z   occ   Uiso U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3) U(2,3)
Na   .08246 .25168 .15327 .0015 .01355  .0136  .0167  .0103 -.00215 -.00052 .00150
Ca   .08246 .25168 .15327       .01355  .0136  .0167  .0103 -.00215 -.00052 .00150
SiT1      0   .772    .25        .0095  .0077  .0107  .0102       0       0      0
BeT2 .12424  .8211    .25        .0118  .0123   .014  .0091   .0000       0      0
SiT3      0  .7203 .10458 .5025  .0094  .0096  .0115  .0070       0       0  .0012
BeT3      0  .7203 .10458 .4975  .0094  .0096  .0115  .0070       0       0  .0012
SiT4 .09372     .5      0 .4735  .0081  .0103  .0087  .0051       0       0  .0003
AlT4 .09372     .5      0 .5265  .0081  .0103  .0087  .0051       0       0  .0003
SiT5 .17005      0      0       .01049  .0101  .0127  .0087       0       0 -.0021
SiT6 .21387 .86129 .14392       .00951  .0094  .0110  .0081   .0005   .0009  .0006
O1        0  .5717 .18225        .0107   .014  .0100  .0081       0       0 -.0001
O2        0  .0337 .11071        .0114  .0108  .0087   .015       0       0  .0000
O3   .05783  .5961 .06979        .0151  .0148  .0174  .0130   .0034   .0042  .0003
O4   .13110  .2367 .03410        .0157  .0149  .0187  .0134   .0048  -.0000 -.0037
O5   .20806  .8723 .06065        .0145  .0152  .0196  .0089   .0019  -.0006  .0005
O6   .23296  .5585 .16527        .0125  .0135  .0100  .0139   .0020   .0020  .0018
O7   .15439  .9376 .17999        .0128  .0116  .0139  .0128   .0024   .0041  .0025
O8   .12121  .4917    .25        .0127   .012  .0092  .0172   .0004       0      0
O9   .05795  .9553    .25        .0105   .009  .0106  .0120  -.0005       0      0
H8    .1626   .452    .25         .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Bavenite
Download hom/bavenite.pdf
Lussier A J, Hawthorne F C
 
Mineralogical Magazine 75 (2011) 213-239
Short-range constraints on chemical and structural variations in bavenite
Locality: Baveno, Italy
Sample: 12BAV
_database_code_amcsd 0019878
23.198 4.9620 19.4262 90 90 90 Cmcm
atom      x     y      z    occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Na   .08175 .2578 .15418 .02175 -.0012  .0142  .0146  .0158 -.0012  .0015  .0121
Ca   .08175 .2578 .15418 .93625 -.0012  .0142  .0146  .0158 -.0012  .0015  .0121
SiT1      0 .7725    .25             0  .0081  .0072  .0081      0      0  .0089
BeT2  .1241 .8235    .25          .003  .0100   .007   .015      0      0   .007
SiT3      0 .7216 .10338   .395      0  .0084  .0084  .0093      0 -.0017  .0075
BeT3      0 .7216 .10338   .605      0  .0084  .0084  .0093      0 -.0017  .0075
SiT4 .09309    .5      0   .689      0  .0076   .011  .0076      0  .0009  .0045
AlT4 .09309    .5      0   .311      0  .0076   .011  .0076      0  .0009  .0045
SiT5 .17006     0      0             0  .0089  .0085  .0102      0 -.0027  .0080
SiT6 .21372 .8670 .14452         .0002  .0081  .0082  .0092  .0008  .0002  .0069
O1        0 .5756 .18213             0  .0094   .012   .009      0 -.0019  .0070
O2        0 .0370  .1082             0   .013   .013   .006      0  .0028   .021
O3   .05742 .5933 .06836         .0056  .0124  .0133  .0105  .0032  .0022  .0134
O4   .13069 .2410 .03210         .0013  .0141  .0141  .0158  .0005 -.0039  .0124
O5   .20770 .8777 .06124         .0004  .0125  .0141  .0183 -.0008  .0000  .0052
O6   .23307 .5642 .16577         .0014  .0106  .0121  .0068  .0005  .0036  .0130
O7   .15426 .9430 .18014         .0010  .0113  .0106  .0136  .0033  .0015  .0096
O8   .12103 .4975    .25         .0011  .0114  .0079   .009      0      0   .017
O9   .05789 .9593    .25        -.0018  .0082  .0059   .010      0      0  .0088
H8    .1606  .428    .25          .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Bavenite
Download hom/bavenite.pdf
Lussier A J, Hawthorne F C
 
Mineralogical Magazine 75 (2011) 213-239
Short-range constraints on chemical and structural variations in bavenite
Locality: Londonderry, West Australia
Sample: 13BAV
_database_code_amcsd 0019879
23.2164 5.0023 19.4447 90 90 90 Cmcm
atom      x      y      z    occ   Uiso U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3) U(2,3)
Na   .08358 .24639 .15279   .009 .01325  .0148  .0120  .0131 -.00100 -.00046 .00117
Ca   .08358 .24639 .15279 .98825 .01325  .0148  .0120  .0131 -.00100 -.00046 .00117
SiT1      0  .7774    .25         .0093  .0092  .0080  .0109       0       0      0
BeT2 .12475  .8158    .25         .0097  .0111  .0083  .0100  -.0002       0      0
SiT3      0 .72300 .10435   .755  .0098  .0111  .0079  .0099       0       0 -.0002
BeT3      0 .72300 .10435   .245  .0098  .0111  .0079  .0099       0       0 -.0002
SiT4 .09492     .5      0  .2505  .0087  .0101  .0066  .0083       0       0  .0001
AlT4 .09492     .5      0  .7495  .0087  .0101  .0066  .0083       0       0  .0001
SiT5 .17026      0      0        .01000  .0111  .0088  .0104       0       0 -.0006
SiT6 .21409 .85757 .14342        .00931  .0101  .0079  .0101  .00015  .00063 .00061
O1        0  .5754 .18265         .0105  .0152  .0072  .0096       0       0 -.0010
O2        0  .0363 .11202         .0137  .0125  .0091  .0194       0       0  .0004
O3   .05767  .5980 .07061         .0151  .0162  .0150  .0150   .0036   .0044  .0010
O4   .13135  .2328 .03539         .0144  .0165  .0121  .0147   .0032   .0013 -.0020
O5   .20829  .8669 .06028         .0141  .0156  .0155  .0114   .0026  -.0010  .0004
O6   .23342  .5575 .16511         .0130  .0146  .0080  .0163   .0029   .0027  .0016
O7   .15456  .9317 .18005         .0133  .0136  .0117  .0147   .0021   .0037  .0029
O8   .12100  .4903    .25         .0127  .0116  .0095   .017   .0001       0      0
O9   .05849  .9537    .25         .0106  .0097  .0090  .0134  -.0008       0      0
H8    .1620   .442    .25          .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Bavenite
Download hom/bavenite.pdf
Lussier A J, Hawthorne F C
 
Mineralogical Magazine 75 (2011) 213-239
Short-range constraints on chemical and structural variations in bavenite
Locality: Sandvik Property, Zealand Twp., Kenora District, Ontario
Sample: 14BAV
_database_code_amcsd 0019880
23.2066 4.9681 19.4085 90 90 90 Cmcm
atom      x      y      z    occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2)  U(1,3) U(2,3)
Na   .08246 .25474 .15347  .0065 .01302  .0128  .0147  .0116 -.0014 -.00087 .00141
Ca   .08246 .25474 .15347 .99425 .01302  .0128  .0147  .0116 -.0014 -.00087 .00141
SiT1      0  .7742    .25         .0079  .0060  .0088  .0090      0       0      0
BeT2 .12439  .8223    .25         .0092  .0079   .009  .0102  .0001       0      0
SiT3      0  .7220 .10354    .46  .0087  .0083  .0095  .0087      0       0 -.0002
BeT3      0  .7220 .10354    .54  .0087  .0083  .0095  .0087      0       0 -.0002
SiT4 .09334     .5      0  .5385  .0066  .0075  .0069  .0053      0       0  .0001
AlT4 .09334     .5      0  .4615  .0066  .0075  .0069  .0053      0       0  .0001
SiT5 .16995      0      0         .0095  .0091  .0103  .0091      0       0 -.0007
SiT6 .21395 .86276 .14434        .00823  .0076  .0085  .0085  .0004   .0009  .0004
O1        0  .5748 .18191         .0097  .0113  .0088  .0091      0       0 -.0005
O2        0  .0363 .10896         .0112  .0081  .0079  .0178      0       0  .0008
O3   .05747  .5953 .06855         .0145  .0143  .0167  .0126  .0047   .0043  .0006
O4   .13050  .2412 .03336         .0146  .0150  .0149  .0139  .0035   .0002 -.0026
O5   .20823  .8738 .06105         .0134  .0137  .0181  .0085  .0021  -.0004  .0005
O6   .23308  .5603 .16616         .0112  .0114  .0080  .0145  .0030   .0023  .0016
O7   .15415  .9397 .18013         .0116  .0090  .0124  .0135  .0022   .0039  .0028
O8   .12117  .4947    .25         .0106  .0080  .0076  .0164  .0007       0      0
O9   .05786  .9574    .25         .0088  .0062  .0088  .0116 -.0003       0      0
H8    .1622   .448    .25          .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Bavenite
Download hom/bavenite.pdf
Lussier A J, Hawthorne F C
 
Mineralogical Magazine 75 (2011) 213-239
Short-range constraints on chemical and structural variations in bavenite
Locality: Foote Mine, King's Mountain, Cleavland County, North Carolina
Sample: 15BAV
_database_code_amcsd 0019881
23.1995 5.0111 19.4454 90 90 90 Cmcm
atom      x      y      z    occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2)  U(1,3) U(2,3)
Na   .08409 .24341 .15245 .00225 .01013  .0107  .0103  .0094 .00016 -.00044 .00131
Ca   .08409 .24341 .15245        .01013  .0107  .0103  .0094 .00016 -.00044 .00131
SiT1      0  .7795    .25         .0067  .0068  .0077  .0054      0       0      0
BeT2  .1249  .8140    .25         .0091   .011   .009   .008 -.0018       0      0
SiT3      0 .72322 .10442   .911  .0066  .0075  .0068  .0054      0       0  .0003
BeT3      0 .72322 .10442   .089  .0066  .0075  .0068  .0054      0       0  .0003
SiT4 .09567     .5      0   .059  .0069  .0083  .0067  .0057      0       0  .0002
AlT4 .09567     .5      0   .941  .0069  .0083  .0067  .0057      0       0  .0002
SiT5 .17033      0      0         .0079  .0086  .0085  .0066      0       0 -.0004
SiT6 .21415 .85491 .14311        .00740  .0076  .0076  .0070  .0003   .0005  .0004
O1        0  .5757 .18288         .0088  .0111  .0076  .0077      0       0 -.0017
O2        0  .0362 .11344         .0103  .0107  .0074  .0127      0       0  -.000
O3   .05763  .5997 .07143         .0118  .0133  .0123  .0098  .0037   .0040  .0009
O4   .13163  .2302 .03624         .0114  .0144  .0109  .0088  .0038   .0006  .0005
O5   .20832  .8638 .05984         .0118  .0136  .0134  .0084  .0030  -.0003  .0005
O6   .23368  .5556 .16476         .0097  .0114  .0065  .0111  .0013   .0016  .0019
O7   .15462  .9287 .17986         .0103  .0100  .0102  .0106  .0024   .0029  .0019
O8   .12102  .4879    .25         .0108  .0090  .0081  .0151  -.000       0      0
O9   .05862  .9523    .25         .0083  .0069  .0081  .0100 -.0004       0      0
H8    .1626   .454    .25          .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Bavenite
Download hom/bavenite.pdf
Lussier A J, Hawthorne F C
 
Mineralogical Magazine 75 (2011) 213-239
Short-range constraints on chemical and structural variations in bavenite
Locality: Lily Pad Lake, Fort Hope, Ontario, Canada
Sample: 19BAV
_database_code_amcsd 0019882
23.2075 5.0063 19.4428 90 90 90 Cmcm
atom      x      y      z    occ   Uiso U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3) U(2,3)
Na   .08394 .24425 .15255 .00075 .01119  .0113  .0119 .01033 -.00039 -.00041 .00119
Ca   .08394 .24425 .15255   .994 .01119  .0113  .0119 .01033 -.00039 -.00041 .00119
SiT1      0  .7782    .25         .0077  .0063  .0083  .0084       0       0      0
BeT2 .12516  .8141    .25         .0086  .0091  .0081  .0086  -.0007       0      0
SiT3      0 .72302 .10442   .859  .0075  .0076  .0077  .0072       0       0 -.0004
BeT3      0 .72302 .10442    .13  .0075  .0076  .0077  .0072       0       0 -.0004
SiT4 .09529     .5      0   .141  .0071  .0081  .0073  .0060       0       0  .0003
AlT4 .09529     .5      0   .859  .0071  .0081  .0073  .0060       0       0  .0003
SiT5 .17028      0      0        .00872  .0088  .0092  .0082       0       0 -.0006
SiT6 .21415 .85518 .14322        .00814  .0077  .0085  .0083  .00036  .00039 .00055
O1        0  .5750 .18271         .0099   .013  .0095  .0069       0       0 -.0007
O2        0  .0350 .11309         .0118  .0107  .0092   .016       0       0 -.0002
O3   .05752  .5995 .07113         .0136  .0139  .0147  .0123   .0033   .0040  .0002
O4   .13125  .2317 .03601         .0131  .0146  .0130  .0115   .0033   .0015 -.0011
O5   .20830  .8648 .06005         .0125  .0130  .0158  .0086   .0022  -.0010  .0007
O6   .23353  .5551 .16495         .0111  .0114  .0088  .0131   .0024   .0020  .0020
O7   .15456  .9298 .17998         .0112  .0096  .0114  .0127   .0027   .0035  .0023
O8   .12113  .4883    .25         .0112  .0098  .0091  .0158  -.0010       0      0
O9   .05864  .9528    .25         .0095  .0080  .0098  .0106  -.0005       0      0
H8    .1629   .461    .25          .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Bavenite
Download hom/bavenite.pdf
Lussier A J, Hawthorne F C
 
Mineralogical Magazine 75 (2011) 213-239
Short-range constraints on chemical and structural variations in bavenite
Locality: Aple Rossa, Oresco, Novara, Italy
Sample: 21BAV
_database_code_amcsd 0019883
23.2077 5.0096 19.4422 90 90 90 Cmcm
atom      x      y      z    occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Na   .08389 .24434 .15255 .00075 .01062  .0122  .0110  .0087 -.0003 -.0002  .0013
Ca   .08389 .24434 .15255        .01062  .0122  .0110  .0087 -.0003 -.0002  .0013
SiT1      0  .7782    .25         .0075  .0083  .0067  .0074      0      0      0
BeT2  .1250   .814    .25          .009   .008   .013   .008 -.0008      0      0
SiT3      0  .7230 .10446    .89   .006  .0078  .0061  .0050      0      0  .0005
BeT3      0  .7230 .10446    .11   .006  .0078  .0061  .0050      0      0  .0005
SiT4 .09546     .5      0   .092  .0070  .0091  .0071  .0047      0      0   .000
AlT4 .09546     .5      0   .908  .0070  .0091  .0071  .0047      0      0   .000
SiT5 .17025      0      0         .0085  .0099  .0088  .0067      0      0 -.0001
SiT6 .21412 .85569 .14323        .00785  .0087  .0082  .0066  .0004  .0006  .0007
O1        0  .5758 .18297         .0089  .0128  .0075  .0063      0      0 -.0021
O2        0  .0363 .11309         .0111  .0126  .0079  .0128      0      0  .0008
O3   .05764  .5991 .07132         .0123  .0151  .0124  .0094  .0028  .0040  .0012
O4   .13157  .2307 .03596         .0118  .0152  .0099  .0104  .0035  .0004 -.0010
O5   .20836  .8644 .06003         .0124  .0152   .015  .0070  .0037 -.0011  .0008
O6   .23378  .5563 .16470         .0102  .0130  .0071  .0107  .0013  .0016  .0011
O7   .15469  .9292 .17972         .0111  .0111  .0121  .0102  .0027  .0033  .0020
O8   .12100  .4885    .25         .0115  .0107  .0099  .0137  .0014      0      0
O9   .05853  .9526    .25         .0091  .0106  .0079  .0088  -.001      0      0
H8    .1625   .453    .25          .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Bavenite
Download hom/bavenite.pdf
Lussier A J, Hawthorne F C
 
Mineralogical Magazine 75 (2011) 213-239
Short-range constraints on chemical and structural variations in bavenite
Locality: Oresco, Val Vigeddo, Italy
Sample: 23BAV
_database_code_amcsd 0019884
23.197 4.9847 19.416 90 90 90 Cmcm
atom      x     y      z    occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Na   .08300 .2506 .15317   .003 .0119  .0123  .0128  .0105 -.0013 -.0013  .0008
Ca   .08300 .2506 .15317 .99975 .0119  .0123  .0128  .0105 -.0013 -.0013  .0008
SiT1      0 .7756    .25        .0077  .0054  .0082  .0093      0      0      0
BeT2  .1251 .8196    .25         .005   .005   .000   .010   .003      0      0
SiT3      0 .7212 .10402  .6495  .007  .0093  .0063  .0052      0      0  .0010
BeT3      0 .7212 .10402  .3505  .007  .0093  .0063  .0052      0      0  .0010
SiT4 .09423    .5      0   .345 .0067  .0073  .0066  .0062      0      0 -.0002
AlT4 .09423    .5      0  .6505 .0067  .0073  .0066  .0062      0      0 -.0002
SiT5 .17016     0      0        .0098  .0115  .0095  .0086      0      0  -.001
SiT6 .21386 .8603 .14393        .0083  .0084  .0082  .0083 -.0000  .0003  .0004
O1        0 .5755  .1831        .0092   .010   .008   .009      0      0  -.002
O2        0 .0382  .1108        .0129   .013   .002   .023      0      0   .001
O3   .05737 .5942 .06987        .0112   .015   .008  .0113  .0039  .0042 -.0004
O4   .13128 .2360 .03429        .0128   .017  .0067   .015 -.0006 -.0001 -.0025
O5   .20816 .8698 .06059        .0126   .014   .016  .0077  .0023 -.0027 -.0010
O6   .23354 .5601 .16556        .0109   .013  .0048   .015  .0036  .0007  .0041
O7   .15479 .9346 .17973        .0107   .008   .013  .0103  .0019  .0023  .0015
O8    .1205  .492    .25        .0094  .0012   .013   .015   .002      0      0
O9    .0585  .955    .25        .0102   .011   .010   .010  -.004      0      0
H8    .1601  .424    .25         .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Bavenite
Download hom/bavenite.pdf
Lussier A J, Hawthorne F C
 
Mineralogical Magazine 75 (2011) 213-239
Short-range constraints on chemical and structural variations in bavenite
Locality: Ascham Alm, Untersulzbachtal, Salzburg, Austria
Sample: 25BAV
_database_code_amcsd 0019885
23.2120 5.0043 19.4439 90 90 90 Cmcm
atom      x      y      z    occ   Uiso U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3) U(2,3)
Na   .08388 .24491 .15264 .00375 .01245 .01352 .01360 .01024 -.00026 -.00042 .00131
Ca   .08388 .24491 .15264        .01245 .01352 .01360 .01024 -.00026 -.00042 .00131
SiT1      0 .77755    .25        .00868  .0084  .0098  .0079       0       0      0
BeT2 .12506  .8139    .25         .0094  .0089  .0110  .0085   .0003       0      0
SiT3      0 .72270 .10440  .8615  .0087  .0093  .0092  .0076       0       0 -.0005
BeT3      0 .72270 .10440  .1385  .0087  .0093  .0092  .0076       0       0 -.0005
SiT4 .09497     .5      0  .1275  .0085  .0102  .0088  .0063       0       0   .004
AlT4 .09497     .5      0  .8725  .0085  .0102  .0088  .0063       0       0   .004
SiT5 .17021      0      0        .00974  .0106  .0107  .0079       0       0 -.0003
SiT6 .21413 .85570 .14332        .00903  .0094  .0098  .0079  .00029  .00040 .00058
O1        0  .5751 .18258         .0106  .0140  .0102  .0076       0       0 -.0015
O2        0  .0346 .11255         .0136  .0131  .0123  .0155       0       0  .0017
O3   .05739  .5988 .07101         .0152  .0161  .0166  .0128   .0037   .0042  .0009
O4   .13109  .2325 .03575         .0141  .0161  .0142  .0119   .0030   .0014 -.0014
O5   .20829  .8655 .06025         .0138  .0151  .0176  .0086   .0031  -.0008  .0006
O6   .23343  .5556 .16518         .0125  .0135  .0106  .0133   .0023   .0020  .0017
O7   .15456  .9307 .18002         .0127  .0121  .0139  .0122   .0031   .0037  .0021
O8   .12116  .4884    .25         .0122  .0113  .0108  .0146  -.0003       0      0
O9   .05854  .9529    .25         .0102  .0087  .0117  .0104  -.0006       0      0
H8    .1624  .4458    .25          .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Bavenite
Download hom/bavenite.pdf
Lussier A J, Hawthorne F C
 
Mineralogical Magazine 75 (2011) 213-239
Short-range constraints on chemical and structural variations in bavenite
Locality: Lily Pad Lake, Fort Hope, Ontario, Canada
Sample: 27BAV
_database_code_amcsd 0019886
23.2090 5.0129 19.4494 90 90 90 Cmcm
atom      x      y      z    occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2)  U(1,3) U(2,3)
Na   .08411 .24308 .15241   .003 .01111 .01139 .01155 .01038 .00002 -.00013 .00117
Ca   .08411 .24308 .15241 .97975 .01111 .01139 .01155 .01038 .00002 -.00013 .00117
SiT1      0 .77933    .25        .00781  .0070  .0086  .0079      0       0      0
BeT2 .12519  .8137    .25         .0096  .0091  .0085  .0112  .0005       0      0
SiT3      0 .72297 .10453   .935  .0078  .0081  .0078  .0074      0       0 -.0005
BeT3      0 .72297 .10453   .065  .0078  .0081  .0078  .0074      0       0 -.0005
SiT4 .09553     .5      0  .0995  .0077  .0085  .0079  .0068      0       0   .003
AlT4 .09553     .5      0  .9005  .0077  .0085  .0079  .0068      0       0   .003
SiT5 .17034      0      0        .00878  .0093  .0092  .0078      0       0 -.0002
SiT6 .21415 .85448 .14301        .00838  .0082  .0086  .0083 .00014  .00042 .00066
O1        0  .5751 .18274         .0099  .0125  .0092  .0079      0       0 -.0003
O2        0  .0354 .11354         .0119  .0119  .0084  .0155      0       0  .0004
O3   .05761  .5998 .07149         .0137  .0141  .0142  .0128  .0037   .0044  .0003
O4   .13148  .2302 .03639         .0123  .0147  .0116  .0105  .0033   .0016  .0001
O5   .20829  .8640 .05992         .0127  .0139  .0157  .0084  .0034  -.0010  .0005
O6   .23361  .5549 .16479         .0116  .0124  .0090  .0135  .0020   .0010  .0021
O7   .15464  .9288 .18000         .0119  .0111  .0118  .0128  .0026   .0033  .0022
O8   .12104  .4877    .25         .0118  .0116  .0087  .0150  .0004       0      0
O9   .05876  .9523    .25         .0095  .0080  .0102  .0101 -.0005       0      0
H8    .1626   .453    .25          .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Bavenite
Download hom/bavenite.pdf
Lussier A J, Hawthorne F C
 
Mineralogical Magazine 75 (2011) 213-239
Short-range constraints on chemical and structural variations in bavenite
Locality: Lily Pad Lake, Fort Hope, Ontario, Canada
Sample: 28BAV
_database_code_amcsd 0019887
23.2074 5.0098 19.4477 90 90 90 Cmcm
atom      x      y      z   occ   Uiso U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3) U(2,3)
Na   .08398 .24394 .15248 .0015 .01172 .01178 .01338  .0100 -.00012 -.00032 .00124
Ca   .08398 .24394 .15248       .01172 .01178 .01338  .0100 -.00012 -.00032 .00124
SiT1      0  .7785    .25        .0083  .0069  .0100  .0080       0       0      0
BeT2 .12505  .8136    .25        .0098  .0125  .0097  .0071  -.0007       0      0
SiT3      0 .72301 .10448  .925  .0083  .0086  .0093  .0070       0       0 -.0003
BeT3      0 .72301 .10448  .075  .0083  .0086  .0093  .0070       0       0 -.0003
SiT4 .09541     .5      0 .0665  .0081  .0089  .0096  .0058       0       0 -.0001
AlT4 .09541     .5      0 .9335  .0081  .0089  .0096  .0058       0       0 -.0001
SiT5 .17026      0      0       .00938  .0098  .0108  .0076       0       0 -.0004
SiT6 .21413 .85503 .14315       .00878  .0082  .0102  .0080   .0002   .0006  .0006
O1        0  .5755 .18293        .0100  .0120  .0112   .007       0       0 -.0015
O2        0  .0354 .11329        .0127  .0117   .011  .0153       0       0  .0009
O3   .05763  .5998 .07138        .0140  .0144  .0153  .0123   .0035   .0039  .0005
O4   .13145  .2311 .03606        .0131  .0147  .0136  .0111   .0032   .0014 -.0006
O5   .20825  .8642 .05994        .0132  .0137  .0175  .0083   .0026  -.0007  .0008
O6   .23358  .5556 .16475        .0115  .0113  .0106  .0125   .0015   .0015  .0015
O7   .15463  .9291 .17986        .0120  .0101  .0140  .0121   .0022   .0027  .0014
O8   .12109  .4879    .25        .0123   .010   .011  .0151  -.0006       0      0
O9   .05870  .9523    .25        .0101  .0078  .0123  .0102  -.0004       0      0
H8    .1624   .448    .25         .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Bavenite
Download hom/bavenite.pdf
Lussier A J, Hawthorne F C
 
Mineralogical Magazine 75 (2011) 213-239
Short-range constraints on chemical and structural variations in bavenite
Locality: Lily Pad Lake, Fort Hope, Ontario, Canada
Sample: 29BAV
_database_code_amcsd 0019888
23.2066 4.9960 19.4373 90 90 90 Cmcm
atom      x      y      z    occ   Uiso U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3) U(2,3)
Na   .08358 .24703 .15280 .00225 .01269 .01307 .01318 .01181 -.00095 -.00062 .00119
Ca   .08358 .24703 .15280  .9915 .01269 .01307 .01318 .01181 -.00095 -.00062 .00119
SiT1      0 .77710    .25        .00829  .0070  .0085  .0094       0       0      0
BeT2 .12482  .8159    .25         .0093  .0098  .0086  .0096   .0005       0      0
SiT3      0 .72305 .10413    .56  .0088  .0090  .0085  .0089       0       0 -.0004
BeT3      0 .72305 .10413    .44  .0088  .0090  .0085  .0089       0       0 -.0004
SiT4 .09471     .5      0  .4525  .0075  .0087  .0073  .0066       0       0  .0003
AlT4 .09471     .5      0  .5475  .0075  .0087  .0073  .0066       0       0  .0003
SiT5 .17021      0      0        .00968  .0099  .0102  .0090       0       0 -.0009
SiT6 .21409 .85745 .14361        .00865  .0085  .0087  .0088  .00052  .00065 .00051
O1        0  .5750 .18243         .0103  .0121  .0094  .0093       0       0 -.0013
O2        0  .0355 .11164         .0126  .0115  .0093  .0172       0       0  .0009
O3   .05747  .5982 .07027         .0148  .0152  .0150  .0143   .0036   .0046  .0006
O4   .13104  .2348 .03515         .0140  .0145  .0140  .0136   .0030   .0007 -.0019
O5   .20829  .8673 .06048         .0138  .0151  .0169  .0093   .0019  -.0011  .0009
O6   .23337  .5573 .16539         .0119  .0117  .0096  .0148   .0020   .0022  .0012
O7   .15439  .9324 .18002         .0123  .0111  .0124  .0133   .0028   .0042  .0028
O8   .12114  .4897    .25         .0119  .0093  .0100  .0165  -.0006       0      0
O9   .05842  .9540    .25         .0097  .0075  .0102  .0116  -.0009       0      0
H8    .1625 .44942    .25          .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Bavenite
Download hom/bavenite.pdf
Lussier A J, Hawthorne F C
 
Mineralogical Magazine 75 (2011) 213-239
Short-range constraints on chemical and structural variations in bavenite
Locality: Drahonin A, Czech Republic
Sample: 31BAV
_database_code_amcsd 0019889
23.2096 5.0020 19.4386 90 90 90 Cmcm
atom      x      y      z   occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2)  U(1,3) U(2,3)
Na   .08362 .24636 .15276 .0055 .01103  .0116  .0119  .0096 -.0009 -.00077  .0013
Ca   .08362 .24636 .15276       .01103  .0116  .0119  .0096 -.0009 -.00077  .0013
SiT1      0  .7779    .25        .0068  .0063  .0074  .0067      0       0      0
BeT2 .12497   .816    .25        .0072   .007   .008  .0061 -.0003       0      0
SiT3      0  .7229 .10423 .7865  .0068  .0079  .0067  .0059      0       0 -.0001
BeT3      0  .7229 .10423 .2135  .0068  .0079  .0067  .0059      0       0 -.0001
SiT4 .09494     .5      0 .2015  .0065  .0078  .0070  .0047      0       0 -.0001
AlT4 .09494     .5      0 .7985  .0065  .0078  .0070  .0047      0       0 -.0001
SiT5 .17020      0      0        .0080  .0082  .0089  .0068      0       0 -.0004
SiT6 .21410 .85725 .14345       .00717  .0072  .0079  .0064 -.0002   .0006  .0007
O1        0  .5754 .18264        .0085  .0104  .0096  .0056      0       0  -.001
O2        0  .0359 .11197        .0108  .0088  .0086  .0149      0       0  .0003
O3   .05752  .5988 .07061        .0126  .0133  .0140  .0103  .0035   .0040  .0014
O4   .13131  .2333 .03538        .0126  .0143   .012  .0117  .0048   .0014 -.0017
O5   .20825  .8663 .06026        .0122  .0129   .015  .0089  .0028  -.0010  .0001
O6   .23336  .5572 .16516        .0104  .0126  .0069  .0116  .0024   .0016  .0025
O7   .15452  .9314 .17988        .0103  .0104   .010  .0104  .0027   .0040  .0023
O8   .12093  .4900    .25        .0102  .0089  .0082  .0134   .001       0      0
O9   .05851  .9533    .25        .0086  .0069  .0094  .0095   .001       0      0
H8    .1627   .463    .25         .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Bavenite
Download hom/bavenite.pdf
Lussier A J, Hawthorne F C
 
Mineralogical Magazine 75 (2011) 213-239
Short-range constraints on chemical and structural variations in bavenite
Locality: Marsikov, Schinderhubel 1, Czech Republic
Sample: 32BAV
_database_code_amcsd 0019890
23.1995 4.9743 19.4255 90 90 90 Cmcm
atom      x      y      z    occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2)  U(1,3) U(2,3)
Na   .08269 .25323 .15349  .0035 .01248  .0131  .0142  .0102 -.0015 -.00071  .0015
Ca   .08269 .25323 .15349 .99425 .01248  .0131  .0142  .0102 -.0015 -.00071  .0015
SiT1      0  .7748    .25         .0074  .0061  .0075  .0084      0       0      0
BeT2 .12453  .8206    .25         .0090  .0094   .010  .0076  .0001       0      0
SiT3      0  .7218 .10384  .5575  .0076  .0084  .0087  .0058      0       0  .0007
BeT3      0  .7218 .10384  .4425  .0076  .0084  .0087  .0058      0       0  .0007
SiT4 .09378     .5      0  .4475  .0065  .0085  .0067  .0043      0       0  .0002
AlT4 .09378     .5      0  .5525  .0065  .0085  .0067  .0043      0       0  .0002
SiT5 .17030      0      0         .0090  .0089  .0098  .0083      0       0 -.0013
SiT6 .21400 .86186 .14435        .00779  .0079  .0082  .0073  .0002   .0009  .0002
O1        0  .5748 .18221         .0094  .0118  .0096  .0067      0       0 -.0010
O2        0  .0365 .10951         .0119  .0109  .0084  .0164      0       0  .0009
O3   .05758  .5959 .06888         .0134  .0142   .014  .0120  .0043   .0048 -.0003
O4   .13074  .2393 .03352         .0141  .0147  .0150  .0126  .0041   .0003 -.0030
O5   .20825  .8724 .06123         .0137  .0139   .018  .0094  .0029  -.0004  .0002
O6   .23303  .5597 .16607         .0110  .0126  .0087  .0117  .0021   .0021  .0023
O7   .15429  .9380 .18013         .0110  .0104  .0112  .0115  .0017   .0039  .0029
O8   .12109  .4938    .25         .0109  .0099  .0065  .0163 -.0001       0      0
O9   .05811  .9564    .25         .0083  .0068  .0077  .0103  .0004       0      0
H8    .1625  .4554    .25          .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Bavenite
Download hom/bavenite.pdf
Lussier A J, Hawthorne F C
 
Mineralogical Magazine 75 (2011) 213-239
Short-range constraints on chemical and structural variations in bavenite
Locality: Vlastejovice, Czech Republic
Sample: 33BAV
_database_code_amcsd 0019891
23.1949 5.0067 19.4370 90 90 90 Cmcm
atom      x      y      z   occ   Uiso U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3) U(2,3)
Na   .08406 .24351 .15246 .0025 .01240  .0133  .0123  .0116 -.00010 -.00040 .00122
Ca   .08406 .24351 .15246       .01240  .0133  .0123  .0116 -.00010 -.00040 .00122
SiT1      0  .7790    .25        .0091  .0094  .0093  .0087       0       0      0
BeT2 .12507  .8133    .25        .0096  .0106  .0078  .0104  -.0012       0      0
SiT3      0 .72308 .10456  .815  .0090  .0100  .0085  .0084       0       0 -.0002
BeT3      0 .72308 .10456  .185  .0090  .0100  .0085  .0084       0       0 -.0002
SiT4 .09524     .5      0  .168  .0090  .0105  .0085  .0079       0       0  .0008
AlT4 .09524     .5      0  .832  .0090  .0105  .0085  .0079       0       0  .0008
SiT5 .17018      0      0       .00998  .0108  .0101  .0090       0       0 -.0001
SiT6 .21414 .85474 .14310       .00942  .0097  .0092  .0094   .0000   .0005  .0008
O1        0  .5751 .18272        .0114  .0153  .0101  .0088       0       0 -.0019
O2        0  .0347 .11328        .0136  .0123  .0124  .0162       0       0  .0005
O3   .05741  .5993 .07145        .0149  .0163  .0156  .0128   .0041   .0043 -.0000
O4   .13141  .2309 .03626        .0138  .0162  .0127  .0124   .0033   .0014 -.0000
O5   .20825  .8637 .05998        .0140  .0152  .0168  .0100   .0034  -.0005  .0009
O6   .23346  .5552 .16476        .0124  .0145  .0089  .0138   .0026   .0016  .0020
O7   .15457  .9287 .18000        .0127  .0127  .0119  .0136   .0019   .0032  .0020
O8   .12101  .4881    .25        .0128  .0128  .0094  .0163   .0007       0      0
O9   .05877  .9524    .25        .0099   .008  .0099  .0113  -.0006       0      0
H8    .1628   .460    .25         .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Bavenite
Download hom/bavenite.pdf
Lussier A J, Hawthorne F C
 
Mineralogical Magazine 75 (2011) 213-239
Short-range constraints on chemical and structural variations in bavenite
Locality: Mont Saint-Hilaire, Quebec, Canada
Sample: 35BAV
_database_code_amcsd 0019892
23.251 4.9734 19.4678 90 90 90 Cmcm
atom      x     y      z    occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Na   .08173 .2584 .15440 .03625 .0127  .0139  .0167  .0075 -.0005 -.0006  .0023
Ca   .08173 .2584 .15440 .95075 .0127  .0139  .0167  .0075 -.0005 -.0006  .0023
SiT1      0 .7744    .25        .0065  .0054  .0088  .0053      0      0      0
BeT2  .1242  .828    .25         .010   .009   .015   .005  -.000      0      0
SiT3      0 .7204  .1030   .321 .0105   .012   .015  .0046      0      0 -.0022
BeT3      0 .7204  .1030   .679 .0105   .012   .015  .0046      0      0 -.0022
SiT4 .09319    .5      0   .705 .0070  .0106  .0104  .0001      0      0 -.0004
AlT4 .09319    .5      0   .295 .0070  .0106  .0104  .0001      0      0 -.0004
SiT5 .16995     0      0        .0081  .0084  .0117  .0043      0      0 -.0022
SiT6 .21375 .8671 .14453        .0067  .0086  .0094  .0021  .0001 -.0003 -.0004
O1        0 .5745  .1818        .0101   .012   .013   .006      0      0  -.002
O2        0 .0359  .1083        .0121   .014   .008   .014      0      0   .006
O3   .05761 .5933 .06826        .0127   .014   .017  .0070  .0050  .0046 -.0019
O4   .13070 .2415  .0323        .0131   .017   .015  .0081  .0024 -.0012 -.0058
O5   .20778 .8789 .06122        .0121   .015   .018  .0028  .0013  .0025  .0042
O6   .23297 .5654 .16575        .0092  .0106   .008  .0087  .0023  .0012  .0049
O7   .15418 .9434  .1802        .0101   .012   .013  .0056 -.0007  .0006  .0028
O8    .1211 .4980    .25        .0096   .007   .008   .015   .002      0      0
O9    .0578 .9574    .25        .0079  .0043   .015   .005   .000      0      0
H8    .1602  .425    .25         .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Bavenite
Download hom/bavenite.pdf
Lussier A J, Hawthorne F C
 
Mineralogical Magazine 75 (2011) 213-239
Short-range constraints on chemical and structural variations in bavenite
Locality: Nye Rull, Buskerud, Norway
Sample: 36ABAV
_database_code_amcsd 0019893
23.2043 5.0005 19.4426 90 90 90 Cmcm
atom      x      y      z    occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Na   .08377 .24583 .15279  .0045 .01111  .0120  .0124  .0090 -.0005 -.0007  .0016
Ca   .08377 .24583 .15279 .98575 .01111  .0120  .0124  .0090 -.0005 -.0007  .0016
SiT1      0  .7784    .25         .0069  .0065  .0075  .0068      0      0      0
BeT2  .1248  .8151    .25          .007   .007   .008   .005   .002      0      0
SiT3      0  .7223 .10425  .8495  .0065  .0068  .0062  .0066      0      0 -.0003
BeT3      0  .7223 .10425  .1505  .0065  .0068  .0062  .0066      0      0 -.0003
SiT4 .09506     .5      0    .17  .0068  .0076  .0080  .0047      0      0 -.0001
AlT4 .09506     .5      0    .83  .0068  .0076  .0080  .0047      0      0 -.0001
SiT5 .17040      0      0         .0079  .0086  .0089  .0062      0      0 -.0005
SiT6 .21418 .85648 .14350        .00737  .0073  .0086  .0063 -.0003   .005   .006
O1        0  .5757 .18264         .0097  .0121  .0097  .0073      0      0 -.0006
O2        0  .0367 .11201         .0115  .0127  .0069  .0150      0      0  .0010
O3   .05756  .5985 .07053         .0133  .0145  .0134  .0119   .004  .0048  .0015
O4   .13117  .2334 .03555         .0127  .0141  .0127  .0114  .0040  .0012 -.0023
O5   .20826  .8659 .06041         .0123  .0130  .0167   .007   .004 -.0001  .0006
O6   .23347  .5563 .16528         .0109  .0115  .0102  .0110  .0014  .0021  .0015
O7   .15458  .9314 .18011         .0108   .010  .0118  .0110  .0020  .0040  .0033
O8   .12101  .4902    .25         .0107  .0083  .0111  .0128   .003      0      0
O9   .05859  .9530    .25         .0078  .0062  .0101  .0071  .0002      0      0
H8    .1601   .427    .25          .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Bavenite
Download hom/bavenite.pdf
Lussier A J, Hawthorne F C
 
Mineralogical Magazine 75 (2011) 213-239
Short-range constraints on chemical and structural variations in bavenite
Locality: Baveno, Italy
Sample: 37BAV
_database_code_amcsd 0019894
23.2272 5.0028 19.4518 90 90 90 Cmcm
atom      x      y      z    occ   Uiso U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3) U(2,3)
Na   .08346 .24646 .15288 .00675 .01205  .0133  .0123  .0106 -.00072 -.00060 .00152
Ca   .08346 .24646 .15288   .989 .01205  .0133  .0123  .0106 -.00072 -.00060 .00152
SiT1      0  .7775    .25         .0077  .0078  .0077  .0076       0       0      0
BeT2 .12486  .8144    .25         .0087  .0095  .0085  .0080  -.0010       0      0
SiT3      0  .7229 .10424   .711  .0078  .0085  .0075  .0074       0       0  .0002
BeT3      0  .7229 .10424   .289  .0078  .0085  .0075  .0074       0       0  .0002
SiT4 .09493     .5      0  .2975  .0066  .0089  .0060  .0049       0       0 -.0001
AlT4 .09493     .5      0  .7025  .0066  .0089  .0060  .0049       0       0 -.0001
SiT5 .17018      0      0        .00810  .0088  .0083  .0072       0       0 -.0006
SiT6 .21410 .85831 .14347        .00775  .0085  .0075  .0072   .0001   .0007  .0008
O1        0  .5755 .18268         .0097  .0120  .0100  .0072       0       0 -.0007
O2        0  .0368 .11203         .0128  .0128  .0092  .0166       0       0  .0001
O3   .05757  .5985 .07051         .0135  .0153  .0135  .0117   .0047   .0038  .0012
O4   .13129  .2331 .03518         .0127  .0148  .0112  .0121   .0040   .0009 -.0020
O5   .20816  .8673 .06037         .0121  .0146  .0152  .0065   .0018  -.0007  .0002
O6   .23366  .5584 .16507         .0110  .0130  .0082  .0119   .0020   .0015  .0016
O7   .15459  .9319 .17991         .0113  .0107  .0127  .0105   .0029   .0034  .0030
O8   .12103  .4898    .25         .0116  .0103  .0101  .0144  -.0010       0      0
O9   .05841  .9532    .25         .0092   .007  .0107  .0098  -.0006       0      0
H8    .1615   .435    .25          .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Bavenite
Download hom/bavenite.pdf
Lussier A J, Hawthorne F C
 
Mineralogical Magazine 75 (2011) 213-239
Short-range constraints on chemical and structural variations in bavenite
Locality: Norway
Sample: 39BAV
_database_code_amcsd 0019895
23.2051 4.9986 19.4375 90 90 90 Cmcm
atom      x      y      z   occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2)  U(1,3) U(2,3)
Na   .08366  .2466 .15275 .0045 .01178  .0127  .0125  .0102 -.0008 -.00052  .0013
Ca   .08366  .2466 .15275       .01178  .0127  .0125  .0102 -.0008 -.00052  .0013
SiT1      0  .7779    .25        .0079  .0067  .0095  .0075      0       0      0
BeT2 .12468  .8160    .25        .0079  .0074   .009   .007 -.0011       0      0
SiT3      0  .7231 .10413 .6665  .0075  .0083  .0080  .0063      0       0  .0002
BeT3      0  .7231 .10413 .3335  .0075  .0083  .0080  .0063      0       0  .0002
SiT4 .09497     .5      0 .3245  .0063  .0084  .0065  .0042      0       0  .0003
AlT4 .09497     .5      0 .6755  .0063  .0084  .0065  .0042      0       0  .0003
SiT5 .17032      0      0        .0090  .0095  .0098  .0076      0       0 -.0006
SiT6 .21415 .85694 .14362       .00777  .0082  .0082  .0069  .0004   .0007  .0003
O1        0  .5755 .18262        .0100  .0123  .0096  .0082      0       0  -.001
O2        0  .0371 .11200        .0123  .0113  .0095  .0159      0       0  .0004
O3   .05757  .5991 .07021        .0135  .0150  .0136  .0118  .0041   .0044  .0010
O4   .13122  .2343 .03513        .0130  .0158  .0119  .0113  .0040   .0009 -.0025
O5   .20827  .8660 .06043        .0128  .0148  .0163  .0072  .0022  -.0005  .0004
O6   .23345  .5568 .16530        .0111  .0131  .0078  .0125  .0017   .0017  .0009
O7   .15446 .93122 .17990        .0112  .0102  .0124  .0111  .0017   .0031  .0023
O8   .12107  .4888    .25        .0113  .0107  .0084  .0147  -.001       0      0
O9   .05830  .9538    .25        .0087  .0073  .0093  .0094  .0001       0      0
H8    .1630   .466    .25         .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Bavenite
Download hom/bavenite.pdf
Lussier A J, Hawthorne F C
 
Mineralogical Magazine 75 (2011) 213-239
Short-range constraints on chemical and structural variations in bavenite
Locality: Lily Pad Lake, Fort Hope, Ontario, Canada
Sample: 40BAV
_database_code_amcsd 0019896
23.1895 4.9725 19.4488 90 90 90 Cmcm
atom      x      y      z   occ   Uiso U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3) U(2,3)
Na   .08215 .25394 .15377 .0075 .01369  .0144  .0159  .0107 -.00208 -.00083 .00163
Ca   .08215 .25394 .15377  .983 .01369  .0144  .0159  .0107 -.00208 -.00083 .00163
SiT1      0  .7721    .25        .0090  .0068  .0094  .0109       0       0      0
BeT2 .12437  .8208    .25        .0063  .0073  .0078  .0039   .0012       0      0
SiT3      0  .7201 .10421  .529  .0095  .0087  .0102  .0096       0       0 -.0006
BeT3      0  .7201 .10421  .471  .0095  .0087  .0102  .0096       0       0 -.0006
SiT4 .09375     .5      0   .49  .0070  .0110  .0099  .0077       0       0 -.0003
AlT4 .09375     .5      0   .51  .0070  .0110  .0099  .0077       0       0 -.0003
SiT5 .17016      0      0       .00972  .0093  .0109 .00906       0       0 -.0012
SiT6 .21392 .86269 .14405       .00865  .0089  .0094  .0077  .00007   .0008  .0005
O1        0  .5729 .18240        .0113  .0120  .0125  .0096       0       0 -.0017
O2        0  .0354 .10949        .0145  .0126  .0103      0       0       0 -.0002
O3   .05753  .5955 .06913        .0151  .0146  .0165  .0143   .0041   .0040  .0006
O4   .13086  .2387 .03381        .0147  .0140  .0168  .0133   .0048   .0003 -.0030
O5   .20814  .8735 .06087        .0139  .0155  .0198  .0065   .0030  -.0005 -.0002
O6   .23313  .5602 .16560        .0123  .0127  .0105  .0137   .0023   .0025  .0011
O7   .15435  .9394 .18036        .0125  .0116  .0141  .0118   .0027   .0046  .0024
O8   .12132  .4939    .25        .0121  .0097  .0107  .0160 -.00004       0      0
O9   .05801  .9554    .25        .0093   .007  .0102  .0106  -.0010       0      0
H8    .1617    .43    .25         .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Bavenite
Download hom/bavenite.pdf
Lussier A J, Hawthorne F C
 
Mineralogical Magazine 75 (2011) 213-239
Short-range constraints on chemical and structural variations in bavenite
Locality: Ekaterinburg (near), Ural, Russia
Sample: 41BAV
_database_code_amcsd 0019897
23.1961 4.9937 19.4296 90 90 90 Cmcm
atom      x     y      z    occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3)  U(2,3)
Na   .08367 .2462 .15286 .00375 .0108  .0117  .0127  .0081 -.0005 -.0005   .0017
Ca   .08367 .2462 .15286 .99725 .0108  .0117  .0127  .0081 -.0005 -.0005   .0017
SiT1      0 .7773    .25        .0071  .0061  .0067  .0086      0      0       0
BeT2  .1250 .8151    .25        .0061   .007   .006   .005   .004      0       0
SiT3      0 .7211 .10440  .7485 .0066  .0060  .0061  .0080      0      0   .0003
BeT3      0 .7211 .10440  .2515 .0066  .0060  .0061  .0080      0      0   .0003
SiT4 .09468    .5      0    .25 .0066  .0096  .0102   .008      0      0   .0001
AlT4 .09468    .5      0    .75 .0066  .0096  .0102   .008      0      0   .0001
SiT5 .17044     0      0        .0079  .0084  .0082  .0072      0      0  -.0007
SiT6 .21420 .8562 .14357        .0069  .0062  .0082  .0064 -.0007  .0002   .0003
O1        0 .5750  .1824         .010   .012   .011   .008      0      0 -.00004
O2        0 .0356  .1120        .0117   .013   .008   .015      0      0   .0025
O3   .05735 .5982 .07057        .0136  .0153  .0139  .0119  .0055  .0056   .0004
O4   .13109 .2339 .03546        .0124  .0142  .0117  .0115  .0037  .0018  -.0028
O5   .20812 .8654 .06044        .0114  .0111  .0171  .0062  .0040 -.0008   .0002
O6   .23336 .5558 .16547        .0099  .0107  .0088  .0104  .0016  .0008   .0011
O7   .15447 .9310 .18009        .0100  .0083  .0098  .0120  .0021  .0046   .0033
O8    .1209 .4898    .25        .0101   .006   .011   .014   .002      0       0
O9    .0587 .9525    .25        .0072   .004   .010   .008  .0007      0       0
H8    .1603  .420    .25         .015
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: 26
View in amc, download in amc

Return to AMCSD Home Page