Phase stability determination of negative thermal expansion silicates by theory and experiment-Reference-Cited by-同舟云学术

Phase stability determination of negative thermal expansion silicates by theory and experiment

Published:2021 Issue:45 Volume:23 Page:25533-25541
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Erlebach Andreas¹^ORCID,Belhadj Hassine Ghada¹^ORCID,Thieme Christian²^ORCID,Thieme Katrin²^ORCID,Rüssel Christian³^ORCID,Sierka Marek¹^ORCID

Affiliation:

1. Otto-Schott-Institute for Materials Research, Friedrich Schiller University Jena, Löbdergraben 32, 07743 Jena, Germany

2. Fraunhofer Institute for Microstructure of Materials and Systems IMWS, Walter-Hülse-Straße 1, 06120, Halle (Saale), Germany

3. Otto-Schott-Institute for Materials Research, Friedrich Schiller University Jena, Fraunhoferstr. 6, 07743 Jena, Germany

Abstract

An approach for rapid prediction of the phase stability of silicates with negative thermal expansion is presented, based on density functional theory simulations and experiments.

Funder

Bundesministerium für Bildung und Forschung

Carl-Zeiss-Stiftung

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2021/CP/D1CP03862A

Reference35 articles.

1. H.Bach and D.Krause , Low Thermal Expansion Glass Ceramics , Springer , Berlin, Heidelberg , 2nd edn, 2005

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3. Negative thermal expansion: a review

4. Thermal expansion of Ba2ZnSi2O7, BaZnSiO4 and the solid solution series BaZn2−xMgxSi2O7 (0≤x≤2) studied by high-temperature X-ray diffraction and dilatometry

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