Go to content
UR Home

Examination of possible high-pressure candidates of SnTiO3: The search for novel ferroelectric materials

URN to cite this document:
DOI to cite this document:
Pielnhofer, Florian ; Diehl, Leo ; Jiménez-Solano, Alberto ; Bussmann-Holder, Anette ; Schön, Christian J. ; Lotsch, Bettina V.
License: Creative Commons Attribution 4.0
PDF - Published Version
Date of publication of this fulltext: 06 May 2021 14:23


Following the recent successful synthesis and characterization of bulk SnTiO3, its energy landscape was studied by means of density functional theory, applying different exchange-correlation and hybrid functionals. Experimentally accessible structure candidates with composition ABX(3) were identified by a database search and global exploration approach. Besides the common octahedral coordination ...


Owner only: item control page
  1. Homepage UR

University Library

Publication Server


Publishing: oa@ur.de
0941 943 -4239 or -69394

Dissertations: dissertationen@ur.de
0941 943 -3904

Research data: datahub@ur.de
0941 943 -5707

Contact persons