Na.5Li.5MnFe2(PO4)3
Hatert F, Keller P, Lissner F, Antenucci D, Fransolet A-M
European Journal of Mineralogy 12 (2000) 847-857
First experimental evidence of alluaudite-like phosphates with high
Li-content: the (Na1-xLix)MnFe2(PO4)3 series (x= 0 to 1)
Sample: Na.5Li.5MnFe2(PO4)3
_database_code_amcsd 0006841
11.988 12.500 6.392 90 114.67 90 C2/c
atom       x       y      z  occ Biso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
LiA2'      0  -.0106    1/4   .5  4.6   .030   .047   .046      0  -.002      0
NaA2'      0  -.0106    1/4  .23  4.6   .030   .047   .046      0  -.002      0
NaA1     1/2       0      0  .27  6.8   .065   .006   .055   .002  -.052  -.001
MnM1       0  .26410    1/4       .85  .0090  .0095  .0091      0  .0061      0
FeM2  .28030  .65277 .36868       .48  .0059  .0044  .0051 -.0007  .0031 -.0008
P1         0 -.28733    1/4       .46  .0056  .0036  .0037      0  .0012      0
P2    .24184 -.10815  .1330       .47  .0066  .0036  .0044 -.0001  .0026 -.0003
O1     .4525   .7164  .5324       .97   .011   .011   .007 -.0005  .0036 -.0015
O2     .0987   .6375  .2386      1.18   .009   .010   .014  .0010  .0030 -.0039
O3     .3284   .6643  .1022      1.11   .017   .009   .006 -.0019  .0036 -.0009
O4     .1221   .3994  .3096      1.50   .012   .012   .022  .0008  .0087  -.001
O5     .2244   .8221  .3180       .98   .011   .012   .007 -.0008  .0045  .0015
O6     .3148   .5023  .3772      1.27   .018   .007   .013 -.0018  .0057  .0010