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Santarosaite |
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Martinez-Ripoll M, Martinez-Carrera S, Garcia-Blanco S |
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Acta Crystallographica B27 (1971) 677-681 |
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The crystal structure of copper metaborate, CuB2O4 |
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Locality: synthetic |
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_database_code_amcsd 0009389 |
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11.484 11.484 5.620 90 90 90 I-42d |
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atom x y z Biso |
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Cu1 0 0 .5 .75 |
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Cu2 .0815 .25 .125 .76 |
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B1 .1838 .1484 .6992 .10 |
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B2 -.0011 .25 .625 .10 |
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O1 .1590 .0708 .4981 .20 |
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O2 .2528 .25 .625 .20 |
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O3 .25 .0827 .8750 .88 |
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O4 .0745 .1890 .7956 .20 |
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Takedaite |
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Vegas A, Cano F H, Garcia-Blanco S |
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Acta Crystallographica B31 (1975) 1416-1419 |
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The crystal structure of calcium orthoborate: a redetermination |
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_database_code_amcsd 0009534 |
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8.6377 8.6377 11.849 90 90 120 R-3c |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Ca .35814 0 .25 .00563 .00665 .01064 .00332 .00056 .00111 |
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B 0 0 .11761 .00645 .00645 .00774 .00323 0 0 |
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O .16624 .01297 .11496 .00650 .00788 .01541 .00411 -.00235 -.00050 |
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AlBO3 |
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Vegas A, Cano F H, Garcia-Blanco S |
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Acta Crystallographica B33 (1977) 3607-3609 |
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Refinement of aluminium orthoborate |
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Sample: 0-50 degree reflections |
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Note: calcite structure type |
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_database_code_amcsd 0009614 |
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4.4638 4.4638 13.745 90 90 120 R-3c |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Al 0 0 0 .00290 .00290 .00318 .00145 0 0 |
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B 0 0 .25 .00326 .00326 .00428 .00163 0 0 |
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O .69093 0 .25 .00296 .00296 .00420 .00148 -.00033 -.00066 |
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AlBO3 |
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Vegas A, Cano F H, Garcia-Blanco S |
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Acta Crystallographica B33 (1977) 3607-3609 |
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Refinement of aluminium orthoborate |
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Sample: 0-50 degree reflections, Al3+, O- |
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Note: calcite structure type |
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_database_code_amcsd 0009615 |
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4.4638 4.4638 13.745 90 90 120 R-3c |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Al 0 0 0 .00286 .00286 .00313 .00143 0 0 |
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B 0 0 .25 .00330 .00330 .00436 .00165 0 0 |
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O .69095 0 .25 .00300 .00300 .00427 .00150 -.00033 -.00066 |
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AlBO3 |
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Vegas A, Cano F H, Garcia-Blanco S |
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Acta Crystallographica B33 (1977) 3607-3609 |
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Refinement of aluminium orthoborate |
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Sample: 0-30 degree reflections |
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Note: calcite structure type |
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_database_code_amcsd 0009616 |
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4.4638 4.4638 13.745 90 90 120 R-3c |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Al 0 0 0 .00270 .00270 .00262 .00135 0 0 |
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B 0 0 .25 .00334 .00334 .00355 .00167 0 0 |
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O .69096 0 .25 .00272 .00272 .00352 .00136 -.00036 -.00072 |
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AlBO3 |
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Vegas A, Cano F H, Garcia-Blanco S |
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Acta Crystallographica B33 (1977) 3607-3609 |
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Refinement of aluminium orthoborate |
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Sample: 0-30 degree reflections, Al3+, O- |
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Note: calcite structure type |
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_database_code_amcsd 0009617 |
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4.4638 4.4638 13.745 90 90 120 R-3c |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Al 0 0 0 .00296 .00296 .00266 .00148 0 0 |
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B 0 0 .25 .00432 .00432 .00301 .00216 0 0 |
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O .69064 0 .25 .00290 .00290 .00404 .00145 -.00039 -.00078 |
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AlBO3 |
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Vegas A, Cano F H, Garcia-Blanco S |
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Acta Crystallographica B33 (1977) 3607-3609 |
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Refinement of aluminium orthoborate |
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Sample: 30-50 degree reflections |
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Note: calcite structure type |
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_database_code_amcsd 0009618 |
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4.4638 4.4638 13.745 90 90 120 R-3c |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Al 0 0 0 .00306 .00306 .00332 .00153 0 0 |
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B 0 0 .25 .00336 .00336 .00455 .00168 0 0 |
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O .69098 0 .25 .00312 .00312 .00449 .00156 -.00030 -.00060 |
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AlBO3 |
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Vegas A, Cano F H, Garcia-Blanco S |
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Acta Crystallographica B33 (1977) 3607-3609 |
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Refinement of aluminium orthoborate |
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Sample: 30-50 degree reflections, Al3+, O- |
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Note: calcite structure type |
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_database_code_amcsd 0009619 |
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4.4638 4.4638 13.745 90 90 120 R-3c |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Al 0 0 0 .00308 .00308 .00333 .00154 0 0 |
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B 0 0 .25 .00346 .00346 .00465 .00173 0 0 |
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O .69099 0 .25 .00320 .00320 .00458 .00160 -.00030 -.00060 |
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| Download AMC data (View Text File)
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Jeremejevite |
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Rodellas C, Garcia-Blanco S, Vegas A |
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Zeitschrift fur Kristallographie 165 (1983) 255-260 |
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Crystal structure refinement of jeremejevite (Al6B5F3O15) |
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Locality: Cape Cross, Namibia |
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_database_code_amcsd 0010860 |
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8.556 8.556 8.175 90 90 120 P6_3/m |
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atom x y z Uiso |
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Al .35261 .01544 .07532 .0038 |
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B1 .23322 .00232 .75 .0048 |
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B2 2/3 1/3 -.05402 .0047 |
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F .50014 .11314 .25 .0056 |
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O1 .28512 .19661 .10135 .0046 |
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O2 .56079 .15000 -.05455 .0045 |
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O3 .30286 .18636 .75 .0050 |
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