Phillipsite-K
Gualtieri A F
Journal of Applied Crystallography 33 (2000) 267-278
Accuracy of XRPD QPA using the combined Rietveld-RIR method
Locality: Vallerano, Rome, Italy
_database_code_amcsd 0012860
9.8881 14.4040 8.6848 90 124.2711 90 P2_1/m
atom     x     y     z  occ Uiso
K1   .8428   .25 .1876  .85 .037
Ca2  .5873 .6261 .4148 .185 .067
K2   .5873 .6261 .4148 .185 .067
Na3  .5592 .1378 .4014 .205 .051
Ca3  .5592 .1378 .4014 .205 .051
Si1  .7389 .0256 .2824   .6 .019
Al1  .7389 .0256 .2824   .4 .019
Si2  .4107 .1419 .0060   .6 .031
Al2  .4107 .1419 .0060   .4 .031
Si3  .0525 .0038 .2749   .6 .029
Al3  .0525 .0038 .2749   .4 .029
Si4  .1149 .1394 .0511   .6 .041
Al4  .1149 .1394 .0511   .4 .041
O1   .1386 .0926 .2425       .02
O2   .6615 .5708 .1847       .03
O3   .6078 .1063 .1655      .069
O4   .0307 .9164 .1531      .014
O5   .8918 .0495 .2642      .067
O6   .3013 .3666 .0929       .07
O7   .8172 .4877 .5020      .038
O8   .5659   .75 .0216      .038
O9   .0578   .25 .0199       .03
Wat1 .7776   .75 .5288  .78  .02
Wat2 .1891   .75 .4947  .88  .06
Wat3 .3413 .8589 .1736  .90  .12
Wat4 .4420   .25 .4497       .04
Wat5    .5    .5    .5  .67  .09