American Mineralogist Crystal Structure Database

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Tavorite
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Marx N, Croguennec L, Carlier D, Wattiaux A, Le Cras F, Suard E, Delmas C
Dalton Transactions 39 (2010) 5108-5116
The structure of tavorite LiFePO4(OH) from diffraction and GGA + U
studies and its preliminary electrochemical characterization
Locality: synthetic
_database_code_amcsd 0020848
5.3528 7.2896 5.1187 109.359 97.733 106.359 P-1
atom    x    y    z Biso
Li   .610 .187 .255  1.4
Fe1     0   .5    0   .5
Fe2     0    0    0  1.0
P    .638 .769 .326   .5
O1   .660 .879 .112   .7
O2   .338 .664 .313  1.0
O3   .950 .278 .163   .7
O4   .789 .614 .268  1.0
O5   .241 .066 .367   .9
H    .069 .342 .355  3.0
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