American Mineralogist Crystal Structure Database

2 matching records for this search.

Ba(BF4)2
 
Bunic T, Tavcar G, Goreshnik E, Zemva B
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-2701&volume=63&spage=75
Acta Crystallographica C63 (2007) i75-i76
Strontium tetrafluoridoborate and barium tetrafluoridoborate
_database_code_amcsd 0010335
12.513 5.0135 4.7628 90 111.854 90 C2/m
atom       x      y      z  Uiso U(1,1) U(2,2) U(3,3)  U(1,2) U(1,3) U(2,3)
Ba1    .0000  .0000 1.0000 .0151  .0149  .0145  .0135       0  .0026      0
B      .1531  .5000  .7084 .0118   .016   .009   .008       0   .003      0
F1     .1010  .5000  .9273 .0152  .0160   .017   .014       0  .0076      0
F2     .2704  .5000  .8507 .0156  .0106   .017   .018       0  .0038      0
F3     .1154  .2718  .5323 .0206  .0223  .0168  .0189   .0011  .0034 -.0093
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View JMOL 3-D Structure (permalink)
 
Sr(BF4)2
 
Bunic T, Tavcar G, Goreshnik E, Zemva B
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-2701&volume=63&spage=75
Acta Crystallographica C63 (2007) i75-i76
Strontium tetrafluoridoborate and barium tetrafluoridoborate
_database_code_amcsd 0010336
9.121 8.714 13.180 90 90 90 Pbca
atom      x      y      z  Uiso U(1,1) U(2,2) U(3,3)  U(1,2) U(1,3) U(2,3)
Sr1  .03288 .78148 .60416 .0087  .0082  .0086  .0092 -.00038 .00023 .00025
B1    .7770  .4970  .5596 .0241   .021   .026   .025   -.001  -.004   .002
B2    .8943  .8161  .3424 .0241   .024   .028   .020    .001  -.003  -.006
F11   .8753  .5772  .6205 .0288   .029   .029  .0282  -.0052 -.0043  .0008
F12   .6983  .3937  .6186 .0319   .029   .034   .033  -.0095 -.0014  .0058
F13   .6772  .5992  .5156 .0345   .035   .035   .034   .0085 -.0038  .0020
F14   .8550  .4215  .4832 .0322   .029   .031   .037   .0013  .0027 -.0075
F21   .9248  .7683  .4418 .0303   .032   .039   .021  -.0011  .0001  .0017
F22   .7504  .7765  .3172 .0324  .0226   .047   .027  -.0050  .0010 -.0036
F23   .9134  .9745  .3345 .0364   .047   .029   .033   -.004  -.001 -.0035
F24   .9899  .7414  .2754 .0303   .029   .037   .025    .004  .0037 -.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)
 
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Total number of retrieved datasets: 2
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