{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2025,1,14]],"date-time":"2025-01-14T05:17:35Z","timestamp":1736831855873,"version":"3.33.0"},"reference-count":30,"publisher":"International Union of Crystallography (IUCr)","issue":"7","license":[{"start":{"date-parts":[[2016,6,21]],"date-time":"2016-06-21T00:00:00Z","timestamp":1466467200000},"content-version":"vor","delay-in-days":0,"URL":"http:\/\/journals.iucr.org\/services\/copyrightpolicy.html"},{"start":{"date-parts":[[2016,6,21]],"date-time":"2016-06-21T00:00:00Z","timestamp":1466467200000},"content-version":"tdm","delay-in-days":0,"URL":"http:\/\/journals.iucr.org\/services\/copyrightpolicy.html#TDM"}],"content-domain":{"domain":["iucr.org","wiley.com","iucrj.org"],"crossmark-restriction":true},"short-container-title":["Acta Crystallogr C Struct Chem","Acta Crystallogr C","Acta Crystallogr C Cryst Struct Commun","Acta Cryst C","Acta Cryst C Struct Chem","Acta Cryst Sect C","Acta Cryst Sect C Struct Chem","Acta Crystallogr Sect C","Acta Crystallogr Sect C Struct Chem","Acta Crystallogr Sect C Cryst Struct Commun"],"published-print":{"date-parts":[[2016,7,1]]},"abstract":"<jats:p>Binary and multicomponent intermetallic compounds based on lithium and<jats:italic>p<\/jats:italic>-elements of Groups III\u2013V of the Periodic Table are useful as modern electrode materials in lithium-ion batteries. However, the interactions between the components in the Li\u2013Ge\u2013B ternary system have not been reported. The structure of tetralithium digermanium boride, Li<jats:sub>4<\/jats:sub>Ge<jats:sub>2<\/jats:sub>B, exhibits a new structure type, in the noncentrosymmetric space group<jats:italic>R<\/jats:italic>3<jats:italic>m<\/jats:italic>, in which all the Li, Ge and B atoms occupy sites with 3<jats:italic>m<\/jats:italic>symmetry. The title structure is closely related to the Mo<jats:sub>2<\/jats:sub>B<jats:sub>5<\/jats:sub>and Li<jats:sub>5<\/jats:sub>Sn<jats:sub>2<\/jats:sub>structure types, which crystallize in the centrosymmetric space group<jats:italic>R<\/jats:italic>\\overline{3}<jats:italic>m<\/jats:italic>. All the atoms in the title structure are coordinated by rhombic dodecahedra (coordination number = 14), similar to the atoms in related structures. According to electronic structure calculations using the tight-binding\u2013linear muffin-tin orbital\u2013atomic spheres approximation (TB\u2013LMTO\u2013ASA) method, strong covalent Ge\u2014Ge and Ge\u2014B interactions were established.<\/jats:p>","DOI":"10.1107\/s2053229616009384","type":"journal-article","created":{"date-parts":[[2016,6,22]],"date-time":"2016-06-22T18:04:58Z","timestamp":1466618698000},"page":"561-565","update-policy":"https:\/\/doi.org\/10.1107\/cm_01","source":"Crossref","is-referenced-by-count":2,"title":["Li<sub>4<\/sub>Ge<sub>2<\/sub>B as a new derivative of the Mo<sub>2<\/sub>B<sub>5<\/sub>and Li<sub>5<\/sub>Sn<sub>2<\/sub>structure types"],"prefix":"10.1107","volume":"72","author":[{"given":"Volodymyr","family":"Pavlyuk","sequence":"first","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Wojciech","family":"Ciesielski","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Beata","family":"Rozdzynska-Kielbik","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Grygoriy","family":"Dmytriv","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Helmut","family":"Ehrenberg","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"329","published-online":{"date-parts":[[2016,6,21]]},"reference":[{"key":"ku3179_bb1","doi-asserted-by":"crossref","first-page":"3060","DOI":"10.1103\/PhysRevB.12.3060","volume":"12","author":"Andersen","year":"1975","journal-title":"Phys. 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