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

Identifieur interne : 000729 ( Istex/Corpus ); précédent : 000728; suivant : 000730

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

Auteurs : Fatima Erragh ; Ali Boukhari ; Francis Abraham ; Brahim Elouadi

Source :

RBID : ISTEX:3CD9F7018DA07C91F8BC7A90E89ED447D69165B5

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

Links to Exploration step

ISTEX:3CD9F7018DA07C91F8BC7A90E89ED447D69165B5

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<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>
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<p>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.</p>
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<ce:simple-para>Single-crystal X-ray crystallography studies have shown that diphosphates Na
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Mg
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Ni
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O
<ce:inf>7</ce:inf>
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<ce:inf>2</ce:inf>
crystallize with the same structural type and the same space group
<ce:italic>P</ce:italic>
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. Their triclinic lattice parameters are equal to
<ce:italic>a</ce:italic>
=10.901 (2),
<ce:italic>b</ce:italic>
=9.765 (2),
<ce:italic>c</ce:italic>
=6.382 (1) Å,
<ce:italic>α</ce:italic>
=112.43 (1)°,
<ce:italic>β</ce:italic>
=99.64 (1)°,
<ce:italic>γ</ce:italic>
=107.53 (1)°,
<ce:italic>Z</ce:italic>
=2 and
<ce:italic>a</ce:italic>
=10.889 (5),
<ce:italic>b</ce:italic>
=9.705 (4),
<ce:italic>c</ce:italic>
=6.358 (4) Å,
<ce:italic>α</ce:italic>
=112.46 (4)°,
<ce:italic>β</ce:italic>
=99.92 (4)°,
<ce:italic>γ</ce:italic>
=107.54 (4)°,
<ce:italic>Z</ce:italic>
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O
<ce:inf>7</ce:inf>
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<ce:sup>4−</ce:sup>
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O
<ce:inf>6</ce:inf>
] octahedra (
<ce:italic>M</ce:italic>
=Mg, Ni) delimiting cavities and tunnels which host sodium cations. The tunnels are running along [001]. The structure is characterized by mixed (Na,
<ce:italic>M</ce:italic>
) 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
<ce:inf>3.64</ce:inf>
Mg
<ce:inf>2.18</ce:inf>
(P
<ce:inf>2</ce:inf>
O
<ce:inf>7</ce:inf>
)
<ce:inf>2</ce:inf>
and 0.13, 0.40, and 0.29 in the case of Na
<ce:inf>3.64</ce:inf>
Ni
<ce:inf>2.18</ce:inf>
(P
<ce:inf>2</ce:inf>
O
<ce:inf>7</ce:inf>
)
<ce:inf>2</ce:inf>
.</ce:simple-para>
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<title>Study of the Crystal Structures of Sodium Magnesium and Sodium Nickel Diphosphates</title>
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<titleInfo type="alternative" lang="en" contentType="CDATA">
<title>Study of the Crystal Structures of Sodium Magnesium and Sodium Nickel Diphosphates</title>
</titleInfo>
<name type="personal">
<namePart type="given">Fatima</namePart>
<namePart type="family">Erragh</namePart>
<affiliation>Applied Solid State Chemistry Laboratory, Faculty of Sciences, Charia Ibn Batota, Rabat, Morocco</affiliation>
<role>
<roleTerm type="text">author</roleTerm>
</role>
</name>
<name type="personal">
<namePart type="given">Ali</namePart>
<namePart type="family">Boukhari</namePart>
<affiliation>Applied Solid State Chemistry Laboratory, Faculty of Sciences, Charia Ibn Batota, Rabat, Morocco</affiliation>
<role>
<roleTerm type="text">author</roleTerm>
</role>
</name>
<name type="personal">
<namePart type="given">Francis</namePart>
<namePart type="family">Abraham</namePart>
<affiliation>Laboratoire de Cristallochimie et Physicochimie du Solide, URPRES A CNRS 8012 Université de Lille I, ENSCL, 108, 59652, Villeneuve d'Ascq Cédex, France</affiliation>
<role>
<roleTerm type="text">author</roleTerm>
</role>
</name>
<name type="personal">
<namePart type="given">Brahim</namePart>
<namePart type="family">Elouadi</namePart>
<affiliation>LEACIM, Département de Chimie, Université de La Rochelle, Avenue Marillac, 17042, La Rochelle, Cédex 1, France</affiliation>
<description>To whom correspondence should be addressed.</description>
<role>
<roleTerm type="text">author</roleTerm>
</role>
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<typeOfResource>text</typeOfResource>
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<dateIssued encoding="w3cdtf">2000</dateIssued>
<dateModified encoding="w3cdtf">2000-02-16</dateModified>
<copyrightDate encoding="w3cdtf">2000</copyrightDate>
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<languageTerm type="code" authority="iso639-2b">eng</languageTerm>
<languageTerm type="code" authority="rfc3066">en</languageTerm>
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<abstract 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.</abstract>
<note type="content">Section title: Regular Article</note>
<relatedItem type="host">
<titleInfo>
<title>Journal of Solid State Chemistry</title>
</titleInfo>
<titleInfo type="abbreviated">
<title>YJSSC</title>
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<genre type="journal">journal</genre>
<originInfo>
<dateIssued encoding="w3cdtf">200007</dateIssued>
</originInfo>
<identifier type="ISSN">0022-4596</identifier>
<identifier type="PII">S0022-4596(00)X0020-5</identifier>
<part>
<date>200007</date>
<detail type="volume">
<number>152</number>
<caption>vol.</caption>
</detail>
<detail type="issue">
<number>2</number>
<caption>no.</caption>
</detail>
<extent unit="issue pages">
<start>323</start>
<end>583</end>
</extent>
<extent unit="pages">
<start>323</start>
<end>331</end>
</extent>
</part>
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<identifier type="istex">3CD9F7018DA07C91F8BC7A90E89ED447D69165B5</identifier>
<identifier type="DOI">10.1006/jssc.2000.8651</identifier>
<identifier type="PII">S0022-4596(00)98651-1</identifier>
<accessCondition type="use and reproduction" contentType="copyright">©2000 Academic Press</accessCondition>
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