R. Federicci, B. Baptiste, F.Finocchi, A. Popa, L. Brohan, K. Béneut, P. Giura, G. Rousse, A. Descamps‐Mandine, T. Douillard, A. Shukla, B. Léridon
{"title":"The crystal structure of Rb2Ti2O5","authors":"R. Federicci, B. Baptiste, F.Finocchi, A. Popa, L. Brohan, K. Béneut, P. Giura, G. Rousse, A. Descamps‐Mandine, T. Douillard, A. Shukla, B. Léridon","doi":"10.1107/S2052520617013646","DOIUrl":null,"url":null,"abstract":"Recent results have demonstrated an exceptionally high permittivity in the range 200–330 K in crystalline titanium oxide Rb2Ti2O5. In this article, the possibility of a structural transition giving rise to ferroelectricity is carefully inspected. In particular, X-ray diffraction, high-resolution transmission electron microscopy and Raman spectroscopy are performed. The crystal structure is shown to remain invariant and centrosymmetric at all temperatures between 90 K and 450 K. The stability of the C2/m structure is confirmed by density functional theory calculations. These important findings allow the existence of a conventional ferroelectric phase transition to be ruled out as a possible mechanism for the colossal permittivity and polarization observed in this material.","PeriodicalId":6887,"journal":{"name":"Acta Crystallographica Section B Structural Crystallography and Crystal Chemistry","volume":"79 1","pages":"1142-1150"},"PeriodicalIF":0.0000,"publicationDate":"2017-03-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"5","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Acta Crystallographica Section B Structural Crystallography and Crystal Chemistry","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.1107/S2052520617013646","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
引用次数: 5
Abstract
Recent results have demonstrated an exceptionally high permittivity in the range 200–330 K in crystalline titanium oxide Rb2Ti2O5. In this article, the possibility of a structural transition giving rise to ferroelectricity is carefully inspected. In particular, X-ray diffraction, high-resolution transmission electron microscopy and Raman spectroscopy are performed. The crystal structure is shown to remain invariant and centrosymmetric at all temperatures between 90 K and 450 K. The stability of the C2/m structure is confirmed by density functional theory calculations. These important findings allow the existence of a conventional ferroelectric phase transition to be ruled out as a possible mechanism for the colossal permittivity and polarization observed in this material.