American Mineralogist Crystal Structure Database

2 matching records for this search.

Colquiriite
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Bolotina N B, Maksimov B A, Simonov V I, Derzhavin S I, Uvarova T V, Apollonov V V
 
Crystallography Reports 38 (1993) 446-450
Atomic structure and spectral properties of LiCaAlF6:Cr3+ single crystals
Locality: synthetic
_database_code_amcsd 0012340
5.007 5.007 9.642 90 90 120 P-31c
atom     x     y     z  Biso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ca       0     0     0  .612  .0089  .0089  .0013  .0045      0      0
Li     1/3   2/3   .25 1.330  .0143  .0143  .0049  .0072      0      0
Al     2/3   1/3   .25  .517  .0066  .0066  .0015  .0033      0      0
F    .3769 .0311 .1434  .926  .0117  .0100  .0026  .0040 -.0023 -.0007
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Colquiriite
Download hom/colquiriite.pdf
Bolotina N B, Maksimov B A, Simonov V I, Derzhavin S I, Uvarova T V, Apollonov V V
 
Crystallography Reports 38 (1993) 446-450
Atomic structure and spectral properties of LiCaAlF6:Cr3+ single crystals
Locality: synthetic
Sample: LiCaAlF6:Cr3+
_database_code_amcsd 0012341
5.008 5.008 9.642 90 90 120 P-31c
atom     x     y     z  Biso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ca       0     0     0  .634  .0095  .0095  .0013  .0048      0      0
Li     1/3   2/3   .25 1.359  .0154  .0154  .0047  .0077      0      0
Al     2/3   1/3   .25  .513  .0068  .0068  .0014  .0034      0      0
F    .3768 .0310 .1434  .935  .0123  .0105  .0026  .0043 -.0023 -.0007
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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