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@ARTICLE{Dashjav:185506,
author = {Dashjav, Enkhtsetseg and Tietz, Frank},
title = {{N}eutron {D}iffraction {A}nalysis of {NASICON}-type {L}i
$_{1+ x}$ {A}l $_{x}$ {T}i $_{2- x}$ {P} $_{3}$ {O} $_{12}$},
journal = {Zeitschrift für anorganische und allgemeine Chemie},
volume = {640},
number = {15},
issn = {0044-2313},
address = {Weinheim},
publisher = {Wiley-VCH},
reportid = {FZJ-2014-06933},
pages = {3070 - 3073},
year = {2014},
abstract = {Powder neutron diffraction analysis was carried out on a
sample of Li1+xAlxTi2–xP3O12 at two temperatures, 10 K and
300 K. After heat treatment the material contained small
amounts of LiTiOPO4 as impurity. Refinement of the neutron
diffraction data confirmed that the main phase crystallized
with a NASICON structure. No structural change was observed
at low temperature. Al atoms randomly substituted Ti atoms,
and additional Li atoms occupied a second site in the
crystal structure. A detailed analysis of the diffraction
data, including the inspection of Fourier difference maps,
indicated that these excess Li+ ions occupied a 6a site
within the ion conduction channels of the NASICON-type
structure instead of the formerly reported 18e or 36f
sites.},
cin = {IEK-1},
ddc = {540},
cid = {I:(DE-Juel1)IEK-1-20101013},
pnm = {123 - Fuel Cells (POF2-123)},
pid = {G:(DE-HGF)POF2-123},
typ = {PUB:(DE-HGF)16},
doi = {10.1002/zaac.201400195},
url = {https://juser.fz-juelich.de/record/185506},
}