Thulium nickel/lithium distannide, TmNi1−xLixSn2 (x = 0.035)
Identifieur interne : 000341 ( Pmc/Curation ); précédent : 000340; suivant : 000342Thulium nickel/lithium distannide, TmNi1−xLixSn2 (x = 0.035)
Auteurs : Andrij Stetskiv [Ukraine] ; Ivan Tarasiuk [Ukraine] ; Renata Misztal [Pologne] ; Volodymyr Pavlyuk [Ukraine, Pologne]Source :
- Acta Crystallographica Section E: Structure Reports Online [ 1600-5368 ] ; 2013.
Abstract
The quaternary thulium nickel/lithium distannide, TmNi1−
Url:
DOI: 10.1107/S1600536813027335
PubMed: 24454012
PubMed Central: 3884236
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</sub>
Li<sub><italic>x</italic>
</sub>
Sn<sub>2</sub>
(<italic>x</italic>
= 0.035)</title>
<author><name sortKey="Stetskiv, Andrij" sort="Stetskiv, Andrij" uniqKey="Stetskiv A" first="Andrij" last="Stetskiv">Andrij Stetskiv</name>
<affiliation wicri:level="1"><nlm:aff id="a">Ivano-Frankivsk National Medical University, Department of Chemistry, Galytska str. 2, 76018 Ivano-Frankivsk,<country>Ukraine</country>
</nlm:aff>
<country xml:lang="fr">Ukraine</country>
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<author><name sortKey="Tarasiuk, Ivan" sort="Tarasiuk, Ivan" uniqKey="Tarasiuk I" first="Ivan" last="Tarasiuk">Ivan Tarasiuk</name>
<affiliation wicri:level="1"><nlm:aff id="b">Department of Inorganic Chemistry, Ivan Franko Lviv National University, Kyryla and Mefodiya str. 6, 79005 Lviv,<country>Ukraine</country>
</nlm:aff>
<country xml:lang="fr">Ukraine</country>
<wicri:regionArea># see nlm:aff country strict</wicri:regionArea>
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<author><name sortKey="Misztal, Renata" sort="Misztal, Renata" uniqKey="Misztal R" first="Renata" last="Misztal">Renata Misztal</name>
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</nlm:aff>
<country xml:lang="fr">Pologne</country>
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<author><name sortKey="Pavlyuk, Volodymyr" sort="Pavlyuk, Volodymyr" uniqKey="Pavlyuk V" first="Volodymyr" last="Pavlyuk">Volodymyr Pavlyuk</name>
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</nlm:aff>
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</sub>
Li<sub><italic>x</italic>
</sub>
Sn<sub>2</sub>
(<italic>x</italic>
= 0.035)</title>
<author><name sortKey="Stetskiv, Andrij" sort="Stetskiv, Andrij" uniqKey="Stetskiv A" first="Andrij" last="Stetskiv">Andrij Stetskiv</name>
<affiliation wicri:level="1"><nlm:aff id="a">Ivano-Frankivsk National Medical University, Department of Chemistry, Galytska str. 2, 76018 Ivano-Frankivsk,<country>Ukraine</country>
</nlm:aff>
<country xml:lang="fr">Ukraine</country>
<wicri:regionArea># see nlm:aff country strict</wicri:regionArea>
</affiliation>
</author>
<author><name sortKey="Tarasiuk, Ivan" sort="Tarasiuk, Ivan" uniqKey="Tarasiuk I" first="Ivan" last="Tarasiuk">Ivan Tarasiuk</name>
<affiliation wicri:level="1"><nlm:aff id="b">Department of Inorganic Chemistry, Ivan Franko Lviv National University, Kyryla and Mefodiya str. 6, 79005 Lviv,<country>Ukraine</country>
</nlm:aff>
<country xml:lang="fr">Ukraine</country>
<wicri:regionArea># see nlm:aff country strict</wicri:regionArea>
</affiliation>
</author>
<author><name sortKey="Misztal, Renata" sort="Misztal, Renata" uniqKey="Misztal R" first="Renata" last="Misztal">Renata Misztal</name>
<affiliation wicri:level="1"><nlm:aff id="c">Institute of Chemistry, Environment Protection and Biotechnology, Jan Dlugosz University, al. Armii Krajowej 13/15, 42-200 Czestochowa,<country>Poland</country>
</nlm:aff>
<country xml:lang="fr">Pologne</country>
<wicri:regionArea># see nlm:aff country strict</wicri:regionArea>
</affiliation>
</author>
<author><name sortKey="Pavlyuk, Volodymyr" sort="Pavlyuk, Volodymyr" uniqKey="Pavlyuk V" first="Volodymyr" last="Pavlyuk">Volodymyr Pavlyuk</name>
<affiliation wicri:level="1"><nlm:aff id="b">Department of Inorganic Chemistry, Ivan Franko Lviv National University, Kyryla and Mefodiya str. 6, 79005 Lviv,<country>Ukraine</country>
</nlm:aff>
<country xml:lang="fr">Ukraine</country>
<wicri:regionArea># see nlm:aff country strict</wicri:regionArea>
</affiliation>
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</nlm:aff>
<country xml:lang="fr">Pologne</country>
<wicri:regionArea># see nlm:aff country strict</wicri:regionArea>
</affiliation>
</author>
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<series><title level="j">Acta Crystallographica Section E: Structure Reports Online</title>
<idno type="eISSN">1600-5368</idno>
<imprint><date when="2013">2013</date>
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<front><div type="abstract" xml:lang="en"><p>The quaternary thulium nickel/lithium distannide, TmNi<sub>1−<italic>x</italic>
</sub>
Li<sub><italic>x</italic>
</sub>
Sn<sub>2</sub>
(<italic>x</italic>
= 0.035), crystallizes in the orthorhombic LuNiSn<sub>2</sub>
structure type. The asymmetric unit contains three Tm sites, six Sn sites, two Ni sites and one Ni/Li site [relative occupancies = 0.895 (8):0.185 (8)]. Site symmetries are .<italic>m</italic>
. for all atoms. The 17-, 18- and 19-vertex distorted pseudo-Frank–Kasper polyhedra are typical for all Tm atoms. Four Sn atoms are enclosed in a 12-vertex deformed cubooctahedron, and another Sn atom is enclosed in a pentagonal prism with three added atoms. A tricapped trigonal prism is typical for a further Sn atom. The coordination number for all Ni atoms and Ni/Li statistical mixtures is 12 (fourcapped trigonal prism [Ni/LiTm<sub>5</sub>
Sn<sub>5</sub>
]). Tm atoms form the base of a prism and Ni/Li atoms are at the centres of the side faces of an [SnTm<sub>6</sub>
Ni/Li<sub>3</sub>
] prism. These isolated prisms are implemented into three-dimensional-nets built out of Sn atoms. Electronic structure calculations using TB-LMTO-ASA suggest that the Tm and Ni/Li atoms form positively charged <italic>n</italic>
[TmNi/Li]<sup><italic>m</italic>
+</sup>
polycations which compensate the negative charge of 2<italic>n</italic>
[Sn]<sup><italic>m</italic>
−</sup>
polyanions. Analysis of the interatomic distances and electronic structure calculations indicate the dominance of a metallic type of bonding.</p>
</div>
</front>
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<pmc article-type="research-article"><pmc-dir>properties open_access</pmc-dir>
<front><journal-meta><journal-id journal-id-type="nlm-ta">Acta Crystallogr Sect E Struct Rep Online</journal-id>
<journal-id journal-id-type="iso-abbrev">Acta Crystallogr Sect E Struct Rep Online</journal-id>
<journal-id journal-id-type="publisher-id">Acta Cryst. E</journal-id>
<journal-title-group><journal-title>Acta Crystallographica Section E: Structure Reports Online</journal-title>
</journal-title-group>
<issn pub-type="epub">1600-5368</issn>
<publisher><publisher-name>International Union of Crystallography</publisher-name>
</publisher>
</journal-meta>
<article-meta><article-id pub-id-type="pmid">24454012</article-id>
<article-id pub-id-type="pmc">3884236</article-id>
<article-id pub-id-type="publisher-id">ff2120</article-id>
<article-id pub-id-type="doi">10.1107/S1600536813027335</article-id>
<article-id pub-id-type="coden">ACSEBH</article-id>
<article-id pub-id-type="pii">S1600536813027335</article-id>
<article-categories><subj-group subj-group-type="heading"><subject>Inorganic Papers</subject>
</subj-group>
</article-categories>
<title-group><article-title>Thulium nickel/lithium distannide, TmNi<sub>1−<italic>x</italic>
</sub>
Li<sub><italic>x</italic>
</sub>
Sn<sub>2</sub>
(<italic>x</italic>
= 0.035)</article-title>
<alt-title><italic>TmNi<sub>0.965</sub>
Li<sub>0.035</sub>
Sn<sub>2</sub>
</italic>
</alt-title>
</title-group>
<contrib-group><contrib contrib-type="author"><name><surname>Stetskiv</surname>
<given-names>Andrij</given-names>
</name>
<xref ref-type="aff" rid="a">a</xref>
</contrib>
<contrib contrib-type="author"><name><surname>Tarasiuk</surname>
<given-names>Ivan</given-names>
</name>
<xref ref-type="aff" rid="b">b</xref>
<xref ref-type="corresp" rid="cor">*</xref>
</contrib>
<contrib contrib-type="author"><name><surname>Misztal</surname>
<given-names>Renata</given-names>
</name>
<xref ref-type="aff" rid="c">c</xref>
</contrib>
<contrib contrib-type="author"><name><surname>Pavlyuk</surname>
<given-names>Volodymyr</given-names>
</name>
<xref ref-type="aff" rid="b">b</xref>
<xref ref-type="aff" rid="c">c</xref>
</contrib>
<aff id="a"><label>a</label>
Ivano-Frankivsk National Medical University, Department of Chemistry, Galytska str. 2, 76018 Ivano-Frankivsk,<country>Ukraine</country>
</aff>
<aff id="b"><label>b</label>
Department of Inorganic Chemistry, Ivan Franko Lviv National University, Kyryla and Mefodiya str. 6, 79005 Lviv,<country>Ukraine</country>
</aff>
<aff id="c"><label>c</label>
Institute of Chemistry, Environment Protection and Biotechnology, Jan Dlugosz University, al. Armii Krajowej 13/15, 42-200 Czestochowa,<country>Poland</country>
</aff>
</contrib-group>
<author-notes><corresp id="cor">Correspondence e-mail: <email>tarasiuk.i@gmail.com</email>
</corresp>
</author-notes>
<pub-date pub-type="collection"><day>01</day>
<month>11</month>
<year>2013</year>
</pub-date>
<pub-date pub-type="epub"><day>12</day>
<month>10</month>
<year>2013</year>
</pub-date>
<pub-date pub-type="pmc-release"><day>12</day>
<month>10</month>
<year>2013</year>
</pub-date>
<pmc-comment> PMC Release delay is 0 months and 0 days and was based on the
. </pmc-comment>
<volume>69</volume>
<issue>Pt 11</issue>
<issue-id pub-id-type="publisher-id">e131100</issue-id>
<fpage>i76</fpage>
<lpage>i76</lpage>
<history><date date-type="received"><day>27</day>
<month>9</month>
<year>2013</year>
</date>
<date date-type="accepted"><day>04</day>
<month>10</month>
<year>2013</year>
</date>
</history>
<permissions><copyright-statement>© Stetskiv et al. 2013</copyright-statement>
<copyright-year>2013</copyright-year>
<license license-type="open-access" xlink:href="http://creativecommons.org/licenses/by/2.0/uk/"><license-p>This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.</license-p>
</license>
</permissions>
<self-uri xlink:type="simple" xlink:href="http://dx.doi.org/10.1107/S1600536813027335">A full version of this article is available from Crystallography Journals Online.</self-uri>
<abstract><p>The quaternary thulium nickel/lithium distannide, TmNi<sub>1−<italic>x</italic>
</sub>
Li<sub><italic>x</italic>
</sub>
Sn<sub>2</sub>
(<italic>x</italic>
= 0.035), crystallizes in the orthorhombic LuNiSn<sub>2</sub>
structure type. The asymmetric unit contains three Tm sites, six Sn sites, two Ni sites and one Ni/Li site [relative occupancies = 0.895 (8):0.185 (8)]. Site symmetries are .<italic>m</italic>
. for all atoms. The 17-, 18- and 19-vertex distorted pseudo-Frank–Kasper polyhedra are typical for all Tm atoms. Four Sn atoms are enclosed in a 12-vertex deformed cubooctahedron, and another Sn atom is enclosed in a pentagonal prism with three added atoms. A tricapped trigonal prism is typical for a further Sn atom. The coordination number for all Ni atoms and Ni/Li statistical mixtures is 12 (fourcapped trigonal prism [Ni/LiTm<sub>5</sub>
Sn<sub>5</sub>
]). Tm atoms form the base of a prism and Ni/Li atoms are at the centres of the side faces of an [SnTm<sub>6</sub>
Ni/Li<sub>3</sub>
] prism. These isolated prisms are implemented into three-dimensional-nets built out of Sn atoms. Electronic structure calculations using TB-LMTO-ASA suggest that the Tm and Ni/Li atoms form positively charged <italic>n</italic>
[TmNi/Li]<sup><italic>m</italic>
+</sup>
polycations which compensate the negative charge of 2<italic>n</italic>
[Sn]<sup><italic>m</italic>
−</sup>
polyanions. Analysis of the interatomic distances and electronic structure calculations indicate the dominance of a metallic type of bonding.</p>
</abstract>
</article-meta>
</front>
</pmc>
</record>
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