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Berzeliite |
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Hawthorne F C |
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Acta Crystallographica B32 (1976) 1581-1583 |
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Refinement of the crystal structure of berzeliite |
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Note: garnet structure |
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Locality: Langban, Sweden |
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_database_code_amcsd 0009564 |
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12.355 12.355 12.355 90 90 90 Ia3d |
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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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NaX .125 0 .25 .3333 .00044 .00114 .00114 0 0 .00045 |
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CaX .125 0 .25 .6667 .00044 .00114 .00114 0 0 .00045 |
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MgY 0 0 0 .85 .00090 .00090 .00090 -.00009 -.00009 -.00009 |
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MnY 0 0 0 .15 .00090 .00090 .00090 -.00009 -.00009 -.00009 |
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AsT .375 0 .25 .00031 .00032 .00032 0 0 0 |
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O .0391 .0522 .6568 .00083 .00099 .00062 .00020 -.00028 -.00004 |
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| 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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Berzeliite |
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Bubeck W, Machatschki F |
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Zeitschrift fur Kristallographie 90 (1935) 44-50 |
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Die Kristallstruktur des Berzeliit (Ca, Na)3 (Mg, Mn)2 (As O4)3 |
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_cod_database_code 1010911 |
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_database_code_amcsd 0017639 |
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12.35 12.35 12.35 90 90 90 Ia3d |
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atom x y z occ |
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Ca1 .25 .125 0 .667 |
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Na1 .25 .125 0 .333 |
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As1 .25 .375 0 |
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Mg1 0 0 0 |
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O1 -.0417 .0528 .1556 |
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| 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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Berzeliite |
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Nagashima M, Armbruster T |
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Mineralogical Magazine 76 (2012) 1081-1097 |
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Palenzonaite, berzeliite, and manganberzeliite:(As5+,V5+,Si4+)O4 tetrahedra |
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in garnet structures |
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Locality: Langban, Sweden |
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_database_code_amcsd 0019612 |
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12.3450 12.3450 12.3450 90 90 90 Ia3d |
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atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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NaX .125 0 .25 .30 .00987 .0073 .01116 .01116 0 0 .00208 |
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CaX .125 0 .25 .70 .00987 .0073 .01116 .01116 0 0 .00208 |
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MgY 0 0 0 .881 .0081 .0081 .0081 .0081 -.00047 -.00047 -.00047 |
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MnY 0 0 0 .119 .0081 .0081 .0081 .0081 -.00047 -.00047 -.00047 |
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AsT .375 0 .25 .949 .00506 .00499 .00509 .00509 0 0 0 |
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Si .375 0 .25 .04 .00506 .00499 .00509 .00509 0 0 0 |
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O .03903 .05125 .65664 .00909 .0091 .0104 .0078 .0013 -.0019 .0006 |
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| 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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Berzeliite |
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Nagashima M, Armbruster T |
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Mineralogical Magazine 76 (2012) 1081-1097 |
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Palenzonaite, berzeliite, and manganberzeliite:(As5+,V5+,Si4+)O4 tetrahedra |
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in garnet structures |
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Locality: Montaldo mine, Italy |
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_database_code_amcsd 0019613 |
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12.3404 12.3404 12.3404 90 90 90 Ia3d |
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atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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NaX .125 0 .25 .33 .00987 .00736 .01113 .01113 0 0 .00158 |
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CaX .125 0 .25 .67 .00987 .00736 .01113 .01113 0 0 .00158 |
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MgY 0 0 0 .879 .0084 .0084 .0084 .0084 -.00021 -.00021 -.00021 |
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MnY 0 0 0 .121 .0084 .0084 .0084 .0084 -.00021 -.00021 -.00021 |
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AsT .375 0 .25 .958 .00525 .00504 .00535 .00535 0 0 0 |
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VT .375 0 .25 .042 .00525 .00504 .00535 .00535 0 0 0 |
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O .03893 .05085 .65608 .00876 .0088 .0100 .0075 .0010 -.0017 .0004 |
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| 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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