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Table 5. Framework atomic parameters for the Li,Ag-LSX samples from Rietveld refinements of neutron powder diffraction data. Standard uncertainties are given in parentheses. Atom Site a T(1) 96g T(2)a 96g O(1) 96g O(2) 96g O(3) 96g O(4) 96g Li95.8Na0.2- LSX-450 x -0.0475(4) y 0.1254(4) z 0.0392(4) B(Å2)b 0.011425 x -0.0528(4) y 0.0361(5) z 0.1224(4) x -0.10383(2) y 0.00341(3) z 0.09756(2) B(Å2)b 0.0195 x 0.00060(3) y -0.00129(3) z 0.15314(1) x -0.02202(1) y 0.07273(3) z 0.06963(3) x -0.07403(1) y 0.08149(3) z 0.17121(3) Li54.0 Ag41.8 Na0.2 - LSX-450 -0.0485(4) 0.1258(4) 0.0368(5) 0.01514 -0.0498(4) .0384(5) 0.1221(4) -0.1023(4) 0.0021(5) 0.0967(4) 0.01861 -0.00040(33) -0.00026(33) 0.15355(19) -0.02227(19) 0.07392(31) 0.06850(35) -0.07414(23) 0.0808(4) 0.1717(4) Li93.3 Ag2.0 Na0.7 - LSX-350 -0.0477(4) 0.1256(4) 0.0397(4) 0.01299 -0.0523(4) .0359(5) .1226(4) -0.10306(2) 0.00381(32) 0.09785(23) 0.02099 0.00052(30) -0.00148(29) 0.15358(15) -0.02261(15) 0.07289(29) 0.06875(28) -0.07399(17) 0.08120(32) 0.17176(29) Li93.3 Ag2.0 Na0.7 - LSX-450 -0.04875(29) 0.1247(4) 0.0373(4) 0.01223 -0.05009(34) 0.0378(4) 0.1229(4) -0.10426(21) 0.00367(31) 0.09684(22) 0.02023 0.00027(26) -0.00093(26) 0.15300(15) -0.02232(15) 0.07333(26) 0.06920(27) -0.07414(17) 0.08156(29) 0.17165(27) a The T(1) site is completely occupied by Si. The T(2) site is completely occupied by Al. b Displacement parameters were fixed for each refinement as follows: T(1) = T(2), O(1) = O(2) = O(3) = O(4) 109PDF Image | PSA USING SUPERIOR ADSORBENTS
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