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Ni3 O9 Sr4 |
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Abraham F, Minaud S, Renard C |
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Journal of Materials Chemistry 4 (1994) 1763-1764 |
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Preliminary crystal structure of mixed-valency Sr4 Ni3 O9, the actual |
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formula of the so-called Sr5 Ni4 O11 |
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_cod_database_code 1004109 |
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_database_code_amcsd 0013072 |
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9.477 9.477 7.825 90 90 120 P321 |
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atom x y z occ |
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Sr1 .0233 .6918 .2476 |
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Sr2 .3276 0 .5 |
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Sr3 .3603 0 0 |
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Ni1 1/3 2/3 .1086 |
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Ni2 1/3 2/3 .4217 |
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Ni3 0 0 .3383 |
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Ni4 2/3 1/3 .237 .58 |
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Ni5 0 0 0 .655 |
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Ni6 .610 .273 .241 .14 |
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Ni7 .924 0 0 .115 |
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O1 .819 .5 .038 |
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O2 .158 .007 .190 |
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O3 .172 .519 .263 |
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O4 .671 .177 .445 |
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O5 .846 0 .5 |
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O10 Ru3 Sr2 |
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Renard C, Daviero-Minaud S, Abraham F |
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Journal of Solid State Chemistry 143 (1999) 266-272 |
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High-pressure synthesis and crystal structure of a new strontium |
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ruthenium oxide: Sr2 Ru3 O10 |
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_cod_database_code 1004145 |
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_database_code_amcsd 0013971 |
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10.985 5.635 6.452 90 105.3 90 C2/m |
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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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Ru1 0 0 0 .0065 .0032 .0042 0 .0036 0 |
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Ru2 0 .2299 .5 .0044 .0036 .0042 0 .0030 0 |
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Sr1 .67081 0 .1455 .0068 .0078 .0100 0 .0043 0 |
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O1 -.0193 .2458 .1915 .013 .005 .004 .001 .005 -.002 |
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O2 .1918 0 .116 .008 .017 .007 0 .004 0 |
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O3 .3839 0 .475 .003 .006 .010 0 .002 0 |
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O4 .8611 0 .459 .003 .008 .014 0 .003 0 |
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| Download AMC data (View Text File)
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O12 Ru3.05 Sr4 |
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Renard C, Daviero-Minaud S, Huve M, Abraham F |
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Journal of Solid State Chemistry 144 (1999) 125-135 |
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Sr4 Ru3.05 O12: a new member of the hexagonal perovskite family |
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_cod_database_code 1004146 |
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_database_code_amcsd 0013973 |
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5.566 5.566 18.18599 90 90 120 P6_3mc |
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atom x y z occ |
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Sr1 0 0 0 |
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Sr2 2/3 1/3 .125 |
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Sr3 1/3 2/3 .239 |
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Sr4 2/3 1/3 .3560 |
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Ru1 1/3 2/3 .0533 |
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Ru2 1/3 2/3 .4292 |
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Ru3 0 0 .1756 .50 |
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Ru4 0 0 .3094 .55 |
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O1 .518 .482 -.002 |
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O2 .176 -.176 .122 |
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O3 .839 .161 .249 |
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O4 .166 -.166 .380 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
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View JMOL 3-D Structure
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