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Study of the Crystal Structures of Sodium Magnesium and Sodium Nickel Diphosphates

Identifieur interne : 000B38 ( Main/Curation ); précédent : 000B37; suivant : 000B39

Study of the Crystal Structures of Sodium Magnesium and Sodium Nickel Diphosphates

Auteurs : Fatima Erragh [Maroc] ; Ali Boukhari [Maroc] ; Francis Abraham [France] ; Brahim Elouadi [France]

Source :

RBID : ISTEX:3CD9F7018DA07C91F8BC7A90E89ED447D69165B5

Descripteurs français

English descriptors

Abstract

Single-crystal X-ray crystallography studies have shown that diphosphates Na3.64Mg2.18(P2O7)2 and Na3.64Ni2.18(P2O7)2 crystallize with the same structural type and the same space group P1. Their triclinic lattice parameters are equal to a=10.901 (2), b=9.765 (2), c=6.382 (1) Å, α=112.43 (1)°, β=99.64 (1)°, γ=107.53 (1)°, Z=2 and a=10.889 (5), b=9.705 (4), c=6.358 (4) Å, α=112.46 (4)°, β=99.92 (4)°, γ=107.54 (4)°, Z=2, respectively. The structure could be regarded as a packing of diphosphate groups [P2O7]4− and [MO6] octahedra (M=Mg, Ni) delimiting cavities and tunnels which host sodium cations. The tunnels are running along [001]. The structure is characterized by mixed (Na, M) sites with an occupation factor ratio equal to ca. 0.82/0.18. Sodium cations are located in five different sites: two cavities (one penta- and the other octa-coordinated) totally occupied and three octahedral interstices, which are partially filled by Na(3), Na(4), and Na(5) according to the respective occupation factors of 0.15, 0.42, and 0.25 for Na3.64Mg2.18(P2O7)2 and 0.13, 0.40, and 0.29 in the case of Na3.64Ni2.18(P2O7)2.

Url:
DOI: 10.1006/jssc.2000.8651

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ISTEX:3CD9F7018DA07C91F8BC7A90E89ED447D69165B5

Le document en format XML

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<term>6166F</term>
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<div type="abstract" xml:lang="en">Single-crystal X-ray crystallography studies have shown that diphosphates Na
<sub>3,64</sub>
Mg
<sub>2.18</sub>
(P
<sub>2</sub>
O
<sub>7</sub>
)
<sub>2</sub>
and Na
<sub>3.64</sub>
Ni
<sub>2.18</sub>
(P
<sub>2</sub>
O
<sub>7</sub>
)
<sub>2</sub>
crystallize with the same structural type and the same space group P1. Their triclinic lattice parameters are equal to a = 10.901 (2), b = 9.765 (2), c = 6.382 (1) Å, α = 112.43 (1)°, β = 99.64 (1)°, γ = 107.53 (1)°, Z = 2 and a = 10.889 (5), b = 9.705 (4), c = 6.358 (4) A, α = 112.46 (4)°, β = 99.92 (4)°, y = 107.54 (4)°, Z = 2, respectively. The structure could be regarded as a packing of diphosphate groups [P
<sub>2</sub>
O
<sub>7</sub>
]
<sup>4-</sup>
and [MO
<sub>6</sub>
] octahedra (M = Mg, Ni) delimiting cavities and tunnels which host sodium cations. The tunnels are running along [001]. The structure is characterized by mixed (Na, M) sites with an occupation factor ratio equal to ca. 0.82/0.18. Sodium cations are located in five different sites: two cavities (one penta- and the other octa-coordinated) totally occupied and three octahedral interstices, which are partially filled by Na(3), Na(4), and Na(5) according to the respective occupation factors of 0.15, 0.42, and 0.25 for Na
<sub>3.64</sub>
Mg
<sub>2.18</sub>
(P
<sub>2</sub>
O
<sub>7</sub>
)
<sub>2</sub>
and 0.13, 0.40, and 0.29 in the case of Na
<sub>3.64</sub>
Ni
<sub>2.18</sub>
(P
<sub>2</sub>
O
<sub>7</sub>
)
<sub>2</sub>
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<title level="a" type="main" xml:lang="en">Study of the Crystal Structures of Sodium Magnesium and Sodium Nickel Diphosphates</title>
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<name sortKey="Erragh, Fatima" sort="Erragh, Fatima" uniqKey="Erragh F" first="Fatima" last="Erragh">Fatima Erragh</name>
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<country xml:lang="fr">Maroc</country>
<wicri:regionArea>Applied Solid State Chemistry Laboratory, Faculty of Sciences, Charia Ibn Batota, Rabat</wicri:regionArea>
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<settlement type="city">Rabat</settlement>
<region nuts="2">Rabat-Salé-Kénitra</region>
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</affiliation>
</author>
<author>
<name sortKey="Boukhari, Ali" sort="Boukhari, Ali" uniqKey="Boukhari A" first="Ali" last="Boukhari">Ali Boukhari</name>
<affiliation wicri:level="3">
<country xml:lang="fr">Maroc</country>
<wicri:regionArea>Applied Solid State Chemistry Laboratory, Faculty of Sciences, Charia Ibn Batota, Rabat</wicri:regionArea>
<placeName>
<settlement type="city">Rabat</settlement>
<region nuts="2">Rabat-Salé-Kénitra</region>
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<author>
<name sortKey="Abraham, Francis" sort="Abraham, Francis" uniqKey="Abraham F" first="Francis" last="Abraham">Francis Abraham</name>
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<country xml:lang="fr">France</country>
<wicri:regionArea>Laboratoire de Cristallochimie et Physicochimie du Solide, URPRES A CNRS 8012 Université de Lille I, ENSCL, 108, 59652, Villeneuve d'Ascq Cédex</wicri:regionArea>
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<region type="region" nuts="2">Hauts-de-France</region>
<region type="old region" nuts="2">Nord-Pas-de-Calais</region>
<settlement type="city">Villeneuve d'Ascq Cédex</settlement>
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<author>
<name sortKey="Elouadi, Brahim" sort="Elouadi, Brahim" uniqKey="Elouadi B" first="Brahim" last="Elouadi">Brahim Elouadi</name>
<affiliation wicri:level="4">
<country xml:lang="fr">France</country>
<wicri:regionArea>LEACIM, Département de Chimie, Université de La Rochelle, Avenue Marillac, 17042, La Rochelle, Cédex 1</wicri:regionArea>
<orgName type="university">Université de La Rochelle</orgName>
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<settlement type="city">La Rochelle</settlement>
<region type="region" nuts="2">Poitou-Charentes</region>
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<title level="j">Journal of Solid State Chemistry</title>
<title level="j" type="abbrev">YJSSC</title>
<idno type="ISSN">0022-4596</idno>
<imprint>
<publisher>ELSEVIER</publisher>
<date type="published" when="2000">2000</date>
<biblScope unit="volume">152</biblScope>
<biblScope unit="issue">2</biblScope>
<biblScope unit="page" from="323">323</biblScope>
<biblScope unit="page" to="331">331</biblScope>
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<idno type="ISSN">0022-4596</idno>
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<idno type="ISSN">0022-4596</idno>
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<language ident="en">en</language>
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<front>
<div type="abstract" xml:lang="en">Single-crystal X-ray crystallography studies have shown that diphosphates Na3.64Mg2.18(P2O7)2 and Na3.64Ni2.18(P2O7)2 crystallize with the same structural type and the same space group P1. Their triclinic lattice parameters are equal to a=10.901 (2), b=9.765 (2), c=6.382 (1) Å, α=112.43 (1)°, β=99.64 (1)°, γ=107.53 (1)°, Z=2 and a=10.889 (5), b=9.705 (4), c=6.358 (4) Å, α=112.46 (4)°, β=99.92 (4)°, γ=107.54 (4)°, Z=2, respectively. The structure could be regarded as a packing of diphosphate groups [P2O7]4− and [MO6] octahedra (M=Mg, Ni) delimiting cavities and tunnels which host sodium cations. The tunnels are running along [001]. The structure is characterized by mixed (Na, M) sites with an occupation factor ratio equal to ca. 0.82/0.18. Sodium cations are located in five different sites: two cavities (one penta- and the other octa-coordinated) totally occupied and three octahedral interstices, which are partially filled by Na(3), Na(4), and Na(5) according to the respective occupation factors of 0.15, 0.42, and 0.25 for Na3.64Mg2.18(P2O7)2 and 0.13, 0.40, and 0.29 in the case of Na3.64Ni2.18(P2O7)2.</div>
</front>
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