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Na3Li3Ti2F12 |
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de Pape R, Portier J, Gauthier G, Hagenmuller P |
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Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences 265 (1967) 1244-1246 |
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Les grenats fluores des elements de transition Na3Li3M2F12 |
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Note: garnet structure |
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_cod_database_code 1000209 |
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_database_code_amcsd 0012265 |
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12.498 12.498 12.498 90 90 90 Ia3d |
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atom x y z |
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Ti1 0 0 0 |
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Na1 .25 .125 0 |
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Li1 .25 .375 0 |
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F1 -.035 .050 .14 |
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F12 Li3 Na3 V2 |
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de Pape R, Portier J, Gauthier G, Hagenmuller P |
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Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences 265 (1967) 1244-1246 |
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Les grenats fluores des elements de transition Na3 Li3 M2 F12 |
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Note: garnet structure |
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_cod_database_code 1008312 |
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_database_code_amcsd 0016227 |
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12.409 12.409 12.409 90 90 90 Ia3d |
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atom x y z |
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V1 0 0 0 |
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Na1 .25 .125 0 |
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Li1 .25 .375 0 |
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F1 -.035 .050 .14 |
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Cr2 F12 Li3 Na3 |
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de Pape R, Portier J, Gauthier G, Hagenmuller P |
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Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences 265 (1967) 1244-1246 |
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Les grenats fluores des elements de transition Na3 Li3 M2 F12 |
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Note: garnet structure |
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_cod_database_code 1008313 |
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_database_code_amcsd 0016228 |
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12.328 12.328 12.328 90 90 90 Ia3d |
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atom x y z |
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Cr1 0 0 0 |
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Na1 .25 .125 0 |
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Li1 .25 .375 0 |
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F1 -.035 .050 .14 |
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F12 Fe2 Li3 Na3 |
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de Pape R, Portier J, Gauthier G, Hagenmuller P |
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Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences 265 (1967) 1244-1246 |
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Les grenats fluores des elements de transition Na3 Li3 M2 F12 |
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Note: garnet structure |
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_cod_database_code 1008314 |
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_database_code_amcsd 0016229 |
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12.393 12.393 12.393 90 90 90 Ia3d |
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atom x y z |
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Fe1 0 0 0 |
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Na1 .25 .125 0 |
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Li1 .25 .375 0 |
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F1 -.035 .050 .14 |
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Co2 F12 Li3 Na3 |
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de Pape R, Portier J, Gauthier G, Hagenmuller P |
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Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences 265 (1967) 1244-1246 |
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Les grenats fluores des elements de transition Na3 Li3 M2 F12 |
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Note: garnet structure |
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_cod_database_code 1008315 |
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_database_code_amcsd 0016230 |
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12.326 12.326 12.326 90 90 90 Ia3d |
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atom x y z |
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Co1 0 0 0 |
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Na1 .25 .125 0 |
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Li1 .25 .375 0 |
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F1 -.035 .050 .14 |
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Li3Na3Sc2F12 |
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de Pape R, Portier J, Grannec J, Gauthier G, Hagenmueller P |
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Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences 269 (1969) 1120-1121 |
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Sur quelques nouveaux grenats fluores |
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Note: garnet structure |
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_cod_database_code 1000176 |
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_database_code_amcsd 0012280 |
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12.607 12.607 12.607 90 90 90 Ia3d |
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atom x y z |
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Sc1 0 0 0 |
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Na1 .25 .125 0 |
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Li1 .25 .375 0 |
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F1 -.0343 .0499 .1407 |
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Li3Na3In2F12 |
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de Pape R, Portier J, Grannec J, Gauthier G, Hagenmueller P |
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Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences 269 (1969) 1120-1121 |
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Sur quelques nouveaux grenats fluores |
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Note: garnet structure |
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_cod_database_code 1000177 |
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_database_code_amcsd 0012281 |
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12.693 12.693 12.693 90 90 90 Ia3d |
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atom x y z |
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In1 0 0 0 |
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Na1 .25 .125 0 |
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Li1 .25 .375 0 |
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F1 -.0349 .0507 .1422 |
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Ce K3 P2 S8 |
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Gauthier G, Jobic S, Brec R, Rouxel J |
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Inorganic Chemistry 37 (1998) 2332-2333 |
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K3 Ce P2 S8: a new cerium thiophosphate with one-dimensional anionic chains |
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_cod_database_code 1008883 |
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_database_code_amcsd 0016750 |
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9.121 17.02399 9.491 90 90.25 90 P2_1/c |
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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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Ce1 .77264 .01341 .02895 .0142 .0137 .0175 -.0002 .0049 .0001 |
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P1 .5229 .0991 .7773 .0131 .0154 .0193 .0013 .0073 .0013 |
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P2 .0072 .1027 .2464 .0173 .017 .0174 -.0012 .0053 -.0033 |
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S1 .9499 .0154 .7451 .0312 .0174 .0274 -.0008 .0036 -.0002 |
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S2 .1266 .1740 .3678 .033 .028 .036 -.0091 .0004 -.0121 |
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S3 .4614 .0201 .1827 .0191 .0146 .0248 -.0009 .0032 -.0008 |
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S4 .6625 .1574 .9084 .0296 .0150 .029 -.0023 -.0027 -.0006 |
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S5 .7900 .1179 .2791 .0177 .033 .0242 .0034 .0095 -.0041 |
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S6 .0382 .1254 .0361 .025 .023 .0210 .0060 .0105 .0028 |
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S7 .5658 .1264 .5762 .030 .032 .0175 .0027 .0088 .0059 |
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S8 .3135 .1297 .8248 .0188 .023 .039 .0050 .0158 .0099 |
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K1 .2709 .0277 .5144 .0336 .030 .0285 -.0011 -.0050 .0013 |
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K2 .8811 .2042 .6253 .048 .032 .075 -.0114 .028 -.006 |
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K3 .3863 .2118 .1340 .088 .035 .079 -.025 .051 -.025 |
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Ce3 I S8 Si2 |
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Gauthier G, Kawasaki S, Jobic S, Macaudiere P, Brec R, Rouxel J |
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Journal of Alloys and Compounds 275 (1998) 46-49 |
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Synthesis and structure of the first cerium iodothiosilicate: Ce3 (Si S4)2 I |
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_cod_database_code 1008894 |
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_database_code_amcsd 0016761 |
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15.9634 7.8502 10.8664 90 97.931 90 C2/c |
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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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Ce1 .19688 .12029 .68020 .0083 .0116 .0081 .0012 .0015 .0007 |
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Ce2 .5 .09620 .75 .0055 .0146 .0141 0 .0020 0 |
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I1 0 .98401 .25 .0107 .0150 .0396 0 .0105 0 |
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Si1 .1596 .4628 .0292 .0070 .012 .011 .0005 .0017 .0014 |
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S1 .1446 .2557 .1463 .0095 .0125 .014 .0012 .0039 .0028 |
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S2 .28161 .5690 .0857 .0071 .0152 .011 -.0019 .0007 .0010 |
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S3 .0682 .6538 .0426 .0075 .0125 .015 .0002 .0000 -.0020 |
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S4 .1501 .3994 .8395 .0095 .0142 .010 .0013 .0012 -.0015 |
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Ce3 I S8 Si2 |
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Gauthier G, Kawasaki S, Jobic S, Macaudiere P, Brec R, Rouxel J |
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Journal of Materials Chemistry 8 (1998) 179-186 |
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Characterization of Ce3 (Si S4)2 I, a compound with a new structure type |
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_cod_database_code 1008901 |
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_database_code_amcsd 0016768 |
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15.9634 7.8502 10.8664 90 97.931 90 C2/c |
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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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Ce1 .19688 .12029 .68020 .0083 .0116 .0081 .0012 .0015 .0007 |
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Ce2 .5 .09620 .75 .0055 .0146 .0141 0 .0020 0 |
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I1 0 .98401 .25 .0107 .0150 .0396 0 .105 0 |
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Si1 .1596 .4628 .0292 .0070 .012 .011 .0005 .0017 .0014 |
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S1 .1446 .2557 .1463 .0095 .0125 .014 .0012 .0039 .0028 |
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S2 .28161 .5690 .0857 .0071 .0152 .011 -.0019 .0007 .0010 |
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S3 .0682 .6538 .0426 .0075 .0125 .015 .0002 .0000 -.0020 |
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S4 .1501 .3994 .8395 .0095 .0142 .010 .0013 .0012 -.0015 |
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| Download AMC data (View Text File)
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