Sato M, Morikawa K, Kurosawa S
European Journal of Mineralogy 2 (1990) 851-859
X-ray Rietveld analysis of cation exchanged zeolite-L (LTL)
Sample: Na-L
_database_code_amcsd 0006405
18.358 18.358 7.521 90 90 120 P6/mmm
atom x y z occ Biso
K1 2/3 1/3 1/2 .95 5.9
K2 1/2 0 1/2 .91 5.0
Na .3056 0 0 4.4
AlT1 .0927 .3578 1/2 .885 4.2
SiT1 .0927 .3578 1/2 .115 4.2
SiT2 .1712 .5055 .2134 3.7
O1 0 .2886 1/2 2.7
O2 .1606 .3211 1/2 .5
O3 .2581 .5162 .246 2.9
O4 .1058 .4173 .3159 3.4
O5 .4292 .8583 .273 2.4
O6 .1547 .4798 0 4.1
Wat1 .211 0 0 .59 7
Wat2 .12775 .2555 .074 .42 5
Wat3 .1388 .0694 .282 .67 10
Wat4 .109 0 1/2 .45 6
Sample: Sr-L
_database_code_amcsd 0006406
18.358 18.358 7.523 90 90 120 P6/mmm
K1 2/3 1/3 1/2 .88 5.9
K2 1/2 0 1/2 .96 6.5
Sr1 .3094 0 0 .16 5.3
Sr2 0 0 1/2 .5 7.9
AlT1 .0928 .3556 1/2 .51 5.5
SiT1 .0928 .3556 1/2 .49 5.5
SiT2 .1677 .5019 .2136 4.4
O1 0 .2814 1/2 5.8
O2 .1593 .3196 1/2 .6
O3 .2622 .5244 .2837 5.5
O4 .1074 .4244 .3124 5.0
O5 .4212 .8424 .2818 5.8
O6 .1508 .4856 0 3.3
Wat1 .1287 .2574 0 .35 6
Wat2 .6665 .090 .096 .27 7
Wat3 .248 .124 .144 .13 1
Wat4 .082 .164 .334 .15 9
Sample: Ba-L
_database_code_amcsd 0006407
18.361 18.361 7.525 90 90 120 P6/mmm
K1 2/3 1/3 1/2 .93 5.4
K2 1/2 0 1/2 6.5
Ba1 .2980 0 0 .18 5.4
Ba2 0 0 1/2 .06 8
AlT1 .0940 .3610 1/2 .5 5.5
SiT1 .0940 .3610 1/2 .5 5.5
SiT2 .1671 .5022 .2176 4.8
O1 0 .2752 1/2 4.9
O2 .1648 .3305 1/2 4.2
O3 .2659 .5318 .2920 5.5
O4 .1073 .4213 .3124 4.2
O5 .4213 .8426 .2816 5.1
O6 .1465 .4793 0 5.3
Wat1 .1405 .2810 0 .9 7
Wat2 .1345 0 .896 .42 12
Wat3 .683 .569 .23 .16 8
Wat4 .0700 .14 .395 .34 8
Sample: Cs-L
Note: We are unable to reproduce the reported bond lengths to T1 and K1,
and we have not been able to locate the authors to find out what is wrong.
_database_code_amcsd 0006408
18.411 18.411 7.558 90 90 120 P6/mmm
K1 2/3 1/3 1/2 2.2
K2 1/2 0 1/2 2.2
Cs .2779 0 0 .61 6.6
AlT1 .0938 .3508 1/2 .722 6.0
SiT1 .0938 .3508 1/2 .278 6.0
SiT2 .1650 .4995 .2060 4.3
O1 0 .2738 1/2 8.6
O2 .1617 .3234 1/2 1.4
O3 .2660 .5320 .2648 2.7
O4 .1078 .4251 .3140 3.9
O5 .4300 .8600 .2756 3.3
O6 .1472 .4799 0 .7
Wat1 .107 0 0 .21 20
Wat2 .239 .478 .188 .14 4
Wat3 .765 .1530 .313 .44 16
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Total number of retrieved datasets: 4 View in amc, download in amc
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