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LiCo2As3O10: une nouvelle structure à tunnels inter­connectés

Identifieur interne : 000219 ( Main/Exploration ); précédent : 000218; suivant : 000220

LiCo2As3O10: une nouvelle structure à tunnels inter­connectés

Auteurs : Youssef Ben Smida [Tunisie] ; Abderrahmen Guesmi [Tunisie] ; Ahmed Driss [Tunisie]

Source :

RBID : PMC:3684868

Abstract

The title compound, lithium dicobalt(II) triarsenate, LiCo2As3O10, was synthesized by a solid-state reaction. The As atoms and four out of seven O atoms lie on special positions, all with site symmetry m. The Li atoms are disordered over two independent special (site symmetry -1) and general positions with occupancies of 0.54 (7) and 0.23 (4), respectively. The structure model is supported by bond-valence-sum (BVS) and charge-distribution (CHARDI) methods. The structure can be described as a three-dimensional framework constructed from bi-octahedral Co2O10 dimers edge-connected to As3O10 groups. It delimits two sets of tunnels, running parallel to the a and b axes, the latter being the larger. The Li+ ions are located within the inter­sections of the tunnels. The possible motion of the alkali cations has been investigated by means of the BVS model. This simulation shows that the Li+ motion appears to be easier mainly along the b-axis direction and that this material may possess inter­esting conduction properties.


Url:
DOI: 10.1107/S1600536813013548
PubMed: 23794970
PubMed Central: 3684868


Affiliations:


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Le document en format XML

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As
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O
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: une nouvelle structure à tunnels inter­connectés</title>
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As
<sub>3</sub>
O
<sub>10</sub>
: une nouvelle structure à tunnels inter­connectés</title>
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<name sortKey="Ben Smida, Youssef" sort="Ben Smida, Youssef" uniqKey="Ben Smida Y" first="Youssef" last="Ben Smida">Youssef Ben Smida</name>
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<p>The title compound, lithium dicobalt(II) triarsenate, LiCo
<sub>2</sub>
As
<sub>3</sub>
O
<sub>10</sub>
, was synthesized by a solid-state reaction. The As atoms and four out of seven O atoms lie on special positions, all with site symmetry
<italic>m</italic>
. The Li atoms are disordered over two independent special (site symmetry -1) and general positions with occupancies of 0.54 (7) and 0.23 (4), respectively. The structure model is supported by bond-valence-sum (BVS) and charge-distribution (CHARDI) methods. The structure can be described as a three-dimensional framework constructed from bi-octahedral Co
<sub>2</sub>
O
<sub>10</sub>
dimers edge-connected to As
<sub>3</sub>
O
<sub>10</sub>
groups. It delimits two sets of tunnels, running parallel to the
<italic>a</italic>
and
<italic>b</italic>
axes, the latter being the larger. The Li
<sup>+</sup>
ions are located within the inter­sections of the tunnels. The possible motion of the alkali cations has been investigated by means of the BVS model. This simulation shows that the Li
<sup>+</sup>
motion appears to be easier mainly along the
<italic>b</italic>
-axis direction and that this material may possess inter­esting conduction properties.</p>
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