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@ARTICLE{Wiedemann:821015,
author = {Wiedemann, Dennis and Indris, Sylvio and Meven, Martin and
Pedersen, Björn and Boysen, Hans and Uecker, Reinhard and
Heitjans, Paul and Lerch, Martin},
title = {{S}ingle-crystal neutron diffraction on γ-{L}i{A}l{O}2:
structure determination and estimation of lithium diffusion
pathway},
journal = {Zeitschrift für Kristallographie / Crystalline materials},
volume = {231},
number = {3},
issn = {2196-7105},
address = {Berlin},
publisher = {De Gruyter},
reportid = {FZJ-2016-06272},
pages = {189–193},
year = {2016},
abstract = {γ-Lithium aluminum oxide is a paradigmatic example of an
ultraslow lithium ion conductor. This characteristic plays a
crucial role in its proposed and actual applications.
Herein, we report on the outcome of single-crystal neutron
diffraction studies at ambient and high temperature. Careful
evaluation confirms the commonly assumed room-temperature
structure as derived by powder neutron diffraction in 1965.
At 1043 K, a split of the lithium position hints at the
onset of intrinsic diffusion. Analysis of the negative
scattering-length density using the maximum-entropy method
(MEM) indicates a preference for a strongly curved diffusion
pathway traversing octahedral voids between adjacent lithium
sites. These results help to understand ultraslow lithium
diffusion in well-ordered ionic solids on the microscopic
scale and, ultimately, to establish structure–property
relationships.},
cin = {JCNS (München) ; Jülich Centre for Neutron Science JCNS
(München) ; JCNS-FRM-II / JCNS-2},
ddc = {540},
cid = {I:(DE-Juel1)JCNS-FRM-II-20110218 /
I:(DE-Juel1)JCNS-2-20110106},
pnm = {6G15 - FRM II / MLZ (POF3-6G15) / 6G4 - Jülich Centre for
Neutron Research (JCNS) (POF3-623)},
pid = {G:(DE-HGF)POF3-6G15 / G:(DE-HGF)POF3-6G4},
experiment = {EXP:(DE-MLZ)HEIDI-20140101 / EXP:(DE-MLZ)RESI-20140101},
typ = {PUB:(DE-HGF)16},
UT = {WOS:000371880500006},
doi = {10.1515/zkri-2015-1896},
url = {https://juser.fz-juelich.de/record/821015},
}