Kaolinite Lee S, Xu H Minerals 10 (2020) 124 Using complementary methods of synchrotron radiation powder diffraction and pair distribution functions to refine crystal structures with high quality parameters - A review Note: Neutron data, chemistry data provided by author Locality: Murfreesboro, Arkansas, USA _database_code_amcsd 0020862 5.1528 8.9415 7.3985 91.715 104.756 89.866 C1 atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) Al1 .2988 .4959 .4747 .996 .012836 .01270 .01350 .01220 -.00090 .00300 .00010 Fe1 .2988 .4959 .4747 .008 .012836 .01270 .01350 .01220 -.00090 .00300 .00010 Mg1 .2988 .4959 .4747 .004 .012836 .01270 .01350 .01220 -.00090 .00300 .00010 Ca1 .2988 .4959 .4747 .006 .012836 .01270 .01350 .01220 -.00090 .00300 .00010 Al2 .7934 .3299 .4721 .996 .013672 .01260 .01450 .01330 -.00030 .00220 .00010 Fe2 .7934 .3299 .4721 .008 .013672 .01260 .01450 .01330 -.00030 .00220 .00010 Mg2 .7934 .3299 .4721 .004 .013672 .01260 .01450 .01330 -.00030 .00220 .00010 Ca2 .7934 .3299 .4721 .006 .013672 .01260 .01450 .01330 -.00030 .00220 .00010 Si1 .9935 .3387 .0912 .978 .011837 .01150 .01290 .01100 -.00060 .00280 -.00090 Ti1 .9935 .3387 .0912 .009 .011837 .01150 .01290 .01100 -.00060 .00280 -.00090 Si2 .5095 .1668 .0931 .978 .012587 .01180 .01320 .01260 -.00030 .00290 -.00040 Ti2 .5095 .1668 .0931 .009 .012587 .01180 .01320 .01260 -.00030 .00290 -.00040 O1 .0501 .3519 .3165 .014782 .01350 .01880 .01160 -.00310 .00270 -.00260 O2 .1204 .6610 .3172 .018215 .01910 .02050 .01330 -.00030 .00090 .00070 O3 0 .5 0 .023960 .02940 .02040 .02080 -.00030 .00410 .00010 O4 .2078 .2308 .0261 .022219 .01420 .02780 .02400 .00520 .00410 -.00270 O5 .2021 .7641 .0006 .020832 .01570 .02760 .01920 -.00460 .00440 .00080 OH1 .0502 .9688 .3266 .022375 .01890 .02140 .02660 .00420 .00500 .00440 OH2 .9593 .1655 .6055 .022217 .02350 .01880 .02010 .00040 -.00220 .00020 OH3 .0372 .4729 .6045 .024725 .02570 .02770 .02110 -.00710 .00720 -.00550 OH4 .0371 .8561 .6092 .024592 .02490 .03030 .01940 .00550 .00680 .00430