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Fe Na O7 P2 |
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Gabelica-Robert M, Goreaud M, Labbe P, Raveau B |
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Journal of Solid State Chemistry 45 (1982) 389-395 |
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The pyrophosphate Na Fe P2 O7: A cage structure |
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_cod_database_code 1001846 |
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_database_code_amcsd 0013500 |
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7.3244 7.9045 9.5745 90 111.858 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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Na1 .28768 .47768 .29340 .01897 .02535 .02517 .00226 .01272 .01093 |
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Fe1 .25959 .00883 .24937 .00454 .00411 .00334 -.00020 .00185 -.00031 |
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P1 .07355 .25412 .45559 .00389 .00399 .00288 .00032 .00163 -.00031 |
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P2 .67295 .21144 .45472 .00405 .00437 .00320 -.00041 .00146 .00061 |
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O1 .87705 .15348 .44124 .00446 .00620 .01221 -.00020 .00419 .00100 |
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O2 .18939 .28450 .62093 .01294 .00643 .00413 .00023 .00028 -.00188 |
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O3 .01146 .41546 .36353 .00606 .00608 .00752 .00108 .00178 .00322 |
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O4 .18136 .13467 .39169 .01294 .00953 .00896 .00375 .00806 -.00119 |
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O5 .53313 .08587 .35008 .00530 .00918 .00864 -.00326 .00153 -.00330 |
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O6 .69212 .20154 .61750 .01291 .00665 .00390 .00064 .00398 .00153 |
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O7 .63560 .39363 .39793 .00932 .00541 .00864 .00185 .00554 .00337 |
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