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Ba Cu F2 O3 |
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Leblanc M, Mercier N, Attfield J |
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European Journal of Solid State and Inorganic Chemistry 32 (1995) 535-538 |
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Revision of the structure of Ba Cu (C O3) F2 by neutron diffraction |
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_cod_database_code 1000394 |
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_database_code_amcsd 0012598 |
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4.8866 8.531 9.582 90 90 90 Pbcm |
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atom x y z |
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Ba1 .2733 .25 0 |
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Cu1 .7521 .4139 .25 |
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F1 .7599 .4144 .4489 |
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C1 .2117 .5843 .25 |
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O1 .2851 .4410 .25 |
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O2 -.0480 .6171 .25 |
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O3 .6183 .1957 .25 |
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La2 O5 Pd2 |
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Attfield J, Ferey G |
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Journal of Solid State Chemistry 80 (1989) 286-298 |
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Structural correlations within the lanthanum palladium oxide family |
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_cod_database_code 1000482 |
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_database_code_amcsd 0013657 |
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6.703 6.703 5.630 90 90 90 P4_2/m |
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atom x y z |
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La1 .2648 .1080 0 |
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Pd1 .3099 .5951 0 |
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O1 .198 .402 .255 |
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O2 0 0 .25 |
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La2 O4 Pd |
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Attfield J, Ferey G |
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Journal of Solid State Chemistry 80 (1989) 286-298 |
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Structural correlations within the lanthanum palladium oxide family |
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_cod_database_code 1000483 |
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_database_code_amcsd 0013658 |
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4.055 4.055 12.62 90 90 90 I4/mmm |
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atom x y z |
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La1 0 0 .351 |
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Pd1 0 0 0 |
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O1 0 .5 0 |
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O2 0 .5 .25 |
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La4 O7 Pd |
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Attfield J, Ferey G |
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Journal of Solid State Chemistry 80 (1989) 286-298 |
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Structural correlations within the lanthanum palladium oxide family |
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_cod_database_code 1000484 |
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_database_code_amcsd 0013659 |
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13.469 4.0262 9.448 90 133.42 90 C2/m |
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atom x y z |
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La1 .2470 .5 .1540 |
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La2 .5839 0 .3889 |
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Pd1 0 0 0 |
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O1 0 .5 0 |
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O2 .3673 0 .3101 |
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O3 .0875 0 -.1126 |
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O4 .2961 .5 .4462 |
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La2 O5 |
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Attfield J, Ferey G |
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Journal of Solid State Chemistry 82 (1989) 132-138 |
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Structure determination of La2 O2 C O3-II and the unusual disordered |
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phase La2 O2.52 (C O3)0.74 Li0.52 using powder diffraction |
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_cod_database_code 1000463 |
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_database_code_amcsd 0013662 |
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4.0755 4.0755 15.957 90 90 120 P6_3/mmc |
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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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La1 1/3 2/3 .09570 .224 .224 .336 .112 0 0 |
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O1 1/3 2/3 .5577 |
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O2 0 0 .1786 |
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O3 .235 .47 .25 .333 |
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C1 .040 .08 .25 .333 |
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La2 O4.85 |
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Attfield J, Ferey G |
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Journal of Solid State Chemistry 82 (1989) 132-138 |
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Structure determination of La2 O2 C O3-II and the unusual disordered |
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phase La2 O2.52 (C O3)0.74 Li0.52 using powder diffraction |
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_cod_database_code 1000464 |
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_database_code_amcsd 0013663 |
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4.0852 4.0852 16.2211 90 90 120 P6_3/mmc |
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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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La1 1/3 2/3 .09422 .438 .438 .674 .219 0 0 |
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O1 1/3 2/3 .5566 |
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O2 0 0 .1804 |
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O3 .228 .456 .25 .282 |
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C1 .058 .116 .25 .282 |
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La2 Li0.52 O4.74 |
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Attfield J, Ferey G |
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Journal of Solid State Chemistry 82 (1989) 132-138 |
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Structure determination of La2 O2 C O3-II and the unusual disordered |
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phase La2 O2.52 (C O3)0.74 Li0.52 using powder diffraction |
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_cod_database_code 1000465 |
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_database_code_amcsd 0013664 |
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4.0580 4.0580 16.22189 90 90 120 P6_3/mmc |
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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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La1 1/3 2/3 .0943 .45 .45 .82 .225 0 0 |
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O1 1/3 2/3 .5569 .33 .33 1.2 .165 0 0 |
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O2 -.0341 -.0681 .1755 .266 |
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O3 .228 .456 .25 .247 |
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O4 .262 .131 .133 .067 |
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C1 .0470 .094 .25 .247 |
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Li1 2/3 1/3 .25 .52 |
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Bonaccordite |
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Perkins D A, Attfield J P |
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Journal of the Chemical Society, Chemical Communications 1991 (1991) 229-231 |
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Resonant powder X-ray determination of the cation distribution in FeNi2BO5 |
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Locality: synthetic |
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_database_code_amcsd 0014105 |
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9.21048 12.23794 3.00620 90 90 90 Pbam |
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atom x y z occ Biso |
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FeM1 0 0 0 .088 .13 |
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NiM1 0 0 0 .912 .13 |
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FeM2 .5 0 .5 .385 .13 |
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NiM2 .5 0 .5 .615 .13 |
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FeM3 -.0001 .2814 0 .144 .13 |
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NiM3 -.0001 .2814 0 .856 .13 |
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FeM4 .7378 .3848 .5 .619 .13 |
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NiM4 .7378 .3848 .5 .381 .13 |
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B .274 .3602 .5 .3 |
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O1 .8516 .0438 .5 .13 |
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O2 .3910 .0763 0 .13 |
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O3 .6276 .1394 .5 .13 |
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O4 .1038 .1444 0 .13 |
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O5 .8497 .2395 .5 .13 |
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