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Chrysoberyl |
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Farrell E F, Fang J H, Newnham R E |
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American Mineralogist 48 (1963) 804-810 |
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Refinement of the chrysoberyl structure |
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_database_code_amcsd 0000124 |
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9.404 5.476 4.427 90 90 90 Pnma |
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atom x y z Biso |
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Al1 0 0 0 .073 |
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Al2 .27319 .25 -.00595 .103 |
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Be .09294 .25 .43347 .151 |
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O1 .09051 .25 .79016 .061 |
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O2 .43343 .25 .24097 .226 |
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O3 .16318 .01718 .25850 .140 |
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Pollucite |
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Newnham R E |
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American Mineralogist 52 (1967) 1515-1518 |
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Crystal structure and optical properties of pollucite |
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_database_code_amcsd 0000159 |
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13.682 13.682 13.682 90 90 90 Ia-3d |
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atom x y z occ Biso |
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Cs .125 .125 .125 .7 1.7 |
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Na .125 .125 .125 .3 1.7 |
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Al .125 .6631 .5869 .33 0.3 |
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Si .125 .6631 .5869 .67 0.3 |
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O .1036 .1333 .7216 1.8 |
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Fluorophlogopite |
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McCauley J W, Newnham R E, Gibbs G V |
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American Mineralogist 58 (1973) 249-254 |
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Crystal structure analysis of synthetic fluorophlogopite |
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_database_code_amcsd 0000311 |
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5.308 9.183 10.139 90 100.07 90 C2/m |
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atom x y z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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K 0 0 0 .0269 .0075 .0052 0 .0016 0 |
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Mg1 0 .5 .5 .0073 .0011 .0005 .0001 .0001 0 |
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Mg2 0 .8306 .5 .0056 .0021 .0014 0 .0012 0 |
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Al .5751 .1663 .2245 .25 .0070 .0018 .0023 .00001 .0006 .0002 |
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Si .5751 .1663 .2245 .75 .0070 .0018 .0023 .00001 .0006 .0002 |
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O1 .8208 .2347 .1682 .0116 .0076 .0022 -.00036 .00001 -.0010 |
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O2 .5274 0 .1678 .0174 .0039 .0021 0 -.0001 0 |
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O3 .6291 .1661 .3896 .0062 .0018 .0014 .0008 .0009 -.0002 |
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F1 .1327 0 .4017 .0068 .0021 .0032 0 .0010 0 |
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Corundum |
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Newnham R E, de Haan Y M |
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Zeitschrift fur Kristallographie 117 (1962) 235-237 |
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Refinement of the alpha Al2O3, Ti2O3, V2O3 and Cr2O3 structures |
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Locality: synthetic |
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_database_code_amcsd 0010593 |
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4.7589 4.7589 12.991 90 90 120 R-3c |
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atom x y z |
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Al 0 0 .3520 |
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O .306 0 .25 |
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Tistarite |
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Newnham R E, de Haan Y M |
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Zeitschrift fur Kristallographie 117 (1962) 235-237 |
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Refinement of the alpha Al2O3, Ti2O3, V2O3 and Cr2O3 structures |
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Locality: synthetic |
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_database_code_amcsd 0010594 |
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5.149 5.149 13.642 90 90 120 R-3c |
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atom x y z |
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Ti 0 0 .3450 |
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O .317 0 .25 |
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Karelianite |
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Newnham R E, de Haan Y M |
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Zeitschrift fur Kristallographie 117 (1962) 235-237 |
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Refinement of the alpha Al2O3, Ti2O3, V2O3 and Cr2O3 structures |
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Locality: synthetic |
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_database_code_amcsd 0010595 |
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4.952 4.952 14.002 90 90 120 R-3c |
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atom x y z |
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V 0 0 .3463 |
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O .315 0 .25 |
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Eskolaite |
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Newnham R E, de Haan Y M |
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Zeitschrift fur Kristallographie 117 (1962) 235-237 |
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Refinement of the alpha Al2O3, Ti2O3, V2O3 and Cr2O3 structures |
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Locality: synthetic |
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_database_code_amcsd 0010596 |
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4.9607 4.9607 13.599 90 90 120 R-3c |
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atom x y z |
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Cr 0 0 .3475 |
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O .306 0 .25 |
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Co3B2O6 |
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Newnham R E, Redman M J, Santoro R P |
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Zeitschrift fur Kristallographie 121 (1965) 418-424 |
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Neutron-diffraction study of Co3B2O6 |
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_database_code_amcsd 0010624 |
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5.462 8.436 4.529 90 90 90 Pnmn |
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atom x y z |
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Co1 0 0 0 |
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Co2 0 .321 .5 |
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B .25 0 .56 |
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O1 .316 0 .258 |
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O2 .218 .139 .705 |
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Eulytine |
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Segal D J, Santoro R P, Newnham R E |
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Zeitschrift fur Kristallographie 123 (1966) 73-76 |
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Neutron-diffraction study of Bi4Si3O12 |
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Locality: synthetic |
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_database_code_amcsd 0010629 |
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10.300 10.300 10.300 90 90 90 I-43d |
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atom x y z |
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Bi .0857 .0857 .0857 |
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Si .375 0 .25 |
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O .0607 .1335 .2875 |
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Sinhalite |
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Fang J H, Newnham R E |
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Mineralogical Magazine 35 (1965) 196-199 |
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The crystal structure of sinhalite |
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Locality: Sri Lanka |
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_database_code_amcsd 0014441 |
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9.878 5.675 4.328 90 90 90 Pnma |
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atom x y z Biso |
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Al 0 0 0 .06 |
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Mg .2762 1/4 -.0164 .16 |
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B .0884 1/4 .4057 .10 |
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O1 .0798 1/4 .7418 .25 |
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O2 .4450 1/4 .2559 .21 |
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O3 .1487 .0410 .2658 .22 |
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