Fechtelkord M, Stief F, Buhl J-C
American Mineralogist 86 (2001) 165-175
Sodium cation dynamics in nitrate cancrinite: A low and high temperature Na and H
MAS NMR study and high temperature Rietveld structure refinement
Sample: T = 296 K
_database_code_amcsd 0002623
12.6666 12.6666 5.1808 90 90 120 P6_3
atom x y z occ Uiso
Na1 1/3 2/3 .627 .99 .019
Na2 .134 .2710 .286 .99 .021
Si1 .082 .410 .75 .005
Al1 .337 .412 .742 .005
O1 .201 .403 .663 .006
O2 .1163 .552 .730 .006
O3 .038 .358 .044 .006
O4 .323 .353 .055 .006
N1 0 0 .56 .37 .01
N2 0 0 .75 .50 .01
ON1 .015 .908 .55 .37 .03
ON2 .884 .939 .803 .50 .03
OH1 .620 .33 .680 .39 .03
Sample: T = 673 K
_database_code_amcsd 0002624
12.7261 12.7261 5.2214 90 90 120 P6_3
Na1 1/3 2/3 .654 .93 .052
Na2 .137 .2741 .287 .98 .066
Si1 .080 .413 .75 .028
Al1 .332 .411 .756 .028
O1 .200 .406 .684 .030
O2 .115 .557 .737 .030
O3 .023 .349 .035 .030
O4 .323 .359 .060 .030
N1 0 0 .56 .41 .03
N2 0 0 .78 .41 .03
ON1 .980 .083 .48 .41 .07
ON2 .890 .940 .71 .41 .07
OH1 1/3 2/3 .68 .08 .01
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Total number of retrieved datasets: 2 View in amc, download in amc
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