Crystal Unit Cell Question
Uncle Al
UncleAl0 at hate.spam.net
Thu Nov 15 15:19:01 EST 2001
Uncle Al asks a probably silly and very obvious question about some
crystal data...
REFERENCE STRUCTURE = 20626 A,B,C = 5.482 5.482 5.173
ALPHA,BETA,GAMMA = 90.000 90.000 120.000 SPGR =173 P63
3 0 CODEN= 46025 SYMOPS= 389
40 RFAC= 2.1 ERRFLAG=0 (C-C)ESD=0
1 Li1 0.00000 0.00000 0.07830
2 O1 0.24750 0.34220 -0.16200
3 I1 0.33333 0.66667 0.00000
Lithium iodate, LiIO(3), has two formula units in its unit cell:
2 lithiums
2 iodines
6 oxygens
----- Where are the rest of the atoms? -----
REFERENCE STRUCTURE = 47670 A,B,C = 4.913 4.913 5.405
ALPHA,BETA,GAMMA = 90.000 90.000 120.000 SPGR =154 P3221
2 0 CODEN= 83849 SYMOPS= 398
40 RFAC= 2.4 ERRFLAG=0 (C-C)ESD=0
1 Si1 0.46980 0.00000 0.16667
2 O1 0.41380 0.26510 0.28710
Alpha-quartz, SiO(2), has three formula units in its unit cell,
3 silicons
6 oxygens
----- Where are the rest of the atoms? -----
Remember, I am an organic chemist. We do our best work unclogging
drains and making soybean waste taste like hamburger. The Devil lies
in the details, so make it simple for a simple person. Post 'em if
you've got 'em!
Thank you.
--
Uncle Al
http://www.mazepath.com/uncleal/
(Toxic URL! Unsafe for children and most mammals)
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