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ICSD for WWW : Details

ICSD for WWW

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CC=Collection Code: [AB2X4]=ANX Form: [cF56]=Pearson: [e d a]=Wyckoff Symbol: [Al2MgO4]=Structure Type:
***Click the ANX, Pearson or Wyckoff Symbol to find structures with that symbol***.
CC=96949 Help
TitleMultiple Li positions inside oxygen octahedra in lithiated Ti O2 anatase.
AuthorsWagemaker, M.; Kearley, G.J.; van Well, A.A.; Mutka, H.; Mulder, F.M.
ReferenceJournal of the American Chemical Society (2003) 125, 840-848
Link XRef SCOPUS SCIRUS Google
CompoundLi0.59 O2 Ti1 - [Anatase] Lithium titanium oxide (0.59/1/2) [AB2X4] [oI14] [e5] []
Cell3.8141, 4.0771, 9.042, 90, 90, 90
IMMA (74) V=140.61
RemarksR=0.034000 : MIN =Anatase : NDP RVP TEM =10 : DEF
At least one temperature factor missing in the paper.

Atom (site) Oxid. x, y, z, B, Occupancy
Ti1(4e)3.41
O1(4e)-2
O2(4e)-2
Li1(4e)1
Li2(4e)1
0.0.2500.886901
0.0.2500.104101
0.0.2500.652501
0.0.2500.356900.38
0.0.2500.288800.21

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