Thulium nickel/lithium distannide, TmNi1−xLixSn2 (x = 0.035)
Identifieur interne : 000168 ( Pmc/Checkpoint ); précédent : 000167; suivant : 000169Thulium 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
Affiliations:
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<record><TEI><teiHeader><fileDesc><titleStmt><title xml:lang="en">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)</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><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></titleStmt><publicationStmt><idno type="wicri:source">PMC</idno><idno type="pmid">24454012</idno><idno type="pmc">3884236</idno><idno type="url">http://www.ncbi.nlm.nih.gov/pmc/articles/PMC3884236</idno><idno type="RBID">PMC:3884236</idno><idno type="doi">10.1107/S1600536813027335</idno><date when="2013">2013</date><idno type="wicri:Area/Pmc/Corpus">000341</idno><idno type="wicri:explorRef" wicri:stream="Pmc" wicri:step="Corpus" wicri:corpus="PMC">000341</idno><idno type="wicri:Area/Pmc/Curation">000341</idno><idno type="wicri:explorRef" wicri:stream="Pmc" wicri:step="Curation">000341</idno><idno type="wicri:Area/Pmc/Checkpoint">000168</idno><idno type="wicri:explorRef" wicri:stream="Pmc" wicri:step="Checkpoint">000168</idno></publicationStmt><sourceDesc><biblStruct><analytic><title xml:lang="en" level="a" type="main">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)</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><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></analytic><series><title level="j">Acta Crystallographica Section E: Structure Reports Online</title><idno type="eISSN">1600-5368</idno><imprint><date when="2013">2013</date></imprint></series></biblStruct></sourceDesc></fileDesc><profileDesc><textClass></textClass></profileDesc></teiHeader><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><back><div1 type="bibliography"><listBibl><biblStruct></biblStruct><biblStruct></biblStruct><biblStruct></biblStruct><biblStruct></biblStruct><biblStruct></biblStruct><biblStruct></biblStruct><biblStruct></biblStruct><biblStruct></biblStruct><biblStruct></biblStruct><biblStruct></biblStruct><biblStruct></biblStruct><biblStruct></biblStruct><biblStruct></biblStruct></listBibl></div1></back></TEI><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
<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><affiliations><list><country><li>Pologne</li><li>Ukraine</li></country></list><tree><country name="Ukraine"><noRegion><name sortKey="Stetskiv, Andrij" sort="Stetskiv, Andrij" uniqKey="Stetskiv A" first="Andrij" last="Stetskiv">Andrij Stetskiv</name></noRegion><name sortKey="Pavlyuk, Volodymyr" sort="Pavlyuk, Volodymyr" uniqKey="Pavlyuk V" first="Volodymyr" last="Pavlyuk">Volodymyr Pavlyuk</name><name sortKey="Tarasiuk, Ivan" sort="Tarasiuk, Ivan" uniqKey="Tarasiuk I" first="Ivan" last="Tarasiuk">Ivan Tarasiuk</name></country><country name="Pologne"><noRegion><name sortKey="Misztal, Renata" sort="Misztal, Renata" uniqKey="Misztal R" first="Renata" last="Misztal">Renata Misztal</name></noRegion><name sortKey="Pavlyuk, Volodymyr" sort="Pavlyuk, Volodymyr" uniqKey="Pavlyuk V" first="Volodymyr" last="Pavlyuk">Volodymyr Pavlyuk</name></country></tree></affiliations></record>Pour manipuler ce document sous Unix (Dilib)
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