Issue 12, 2011

Quantum-mechanics-based design principles for solid oxidefuel cell cathode materials

Abstract

Low oxide ion conductivity in perovskite-type transition metal oxides is one of the major problems with solid oxide fuel cells (SOFCs). Here, simple quantum mechanical analyses of LaMO3 (M = Cr, Mn, Fe, Co) materials provide new insights into what drives the relative ease of formation of oxygen vacancies, which is a prerequisite for and predictor of oxide ion bulk diffusion. From our results, we derive design principles based on easily measurable or computable properties to improve SOFC cathode materials.

Graphical abstract: Quantum-mechanics-based design principles for solid oxide fuel cell cathode materials

Supplementary files

Article information

Article type
Communication
Submitted
15 Aug 2011
Accepted
28 Sep 2011
First published
17 Oct 2011

Energy Environ. Sci., 2011,4, 4933-4937

Quantum-mechanics-based design principles for solid oxide fuel cell cathode materials

M. Pavone, A. M. Ritzmann and E. A. Carter, Energy Environ. Sci., 2011, 4, 4933 DOI: 10.1039/C1EE02377B

To request permission to reproduce material from this article, please go to the Copyright Clearance Center request page.

If you are an author contributing to an RSC publication, you do not need to request permission provided correct acknowledgement is given.

If you are the author of this article, you do not need to request permission to reproduce figures and diagrams provided correct acknowledgement is given. If you want to reproduce the whole article in a third-party publication (excluding your thesis/dissertation for which permission is not required) please go to the Copyright Clearance Center request page.

Read more about how to correctly acknowledge RSC content.

Social activity

Spotlight

Advertisements