open access publication

Article, 2023

Phase equilibria and defect chemistry of the La-Sr-Co-O system

Journal of the European Ceramic Society, ISSN 1873-619X, 0955-2219, Volume 43, 10, Pages 4419-4430, 10.1016/j.jeurceramsoc.2023.03.026

Contributors

Zhang, Wei-Wei [1] [2] Povoden-Karadeniz, Erwin 0000-0001-8891-6627 [3] Shang, Yijing 0000-0002-1866-6041 [2] Hendriksen, Peter Vang 0000-0002-4748-532X [2] Chen, Ming 0000-0001-6387-3739 (Corresponding author) [2]

Affiliations

  1. [1] Thermo-Calc Software Inc., Pittsburgh, PA 15317, USA
  2. [NORA names: United States; America, North; OECD];
  3. [2] Technical University of Denmark
  4. [NORA names: DTU Technical University of Denmark; University; Denmark; Europe, EU; Nordic; OECD];
  5. [3] TU Wien
  6. [NORA names: Austria; Europe, EU; OECD]

Abstract

Strontium doped lanthanum cobaltite (LSC, La1−x Sr x CoO3−δ) is a promising oxygen electrode material for intermediate temperature solid oxide cells (SOCs) and oxygen membranes. Its application in service is however impeded by its thermodynamic instability. The present work is aiming to identify the phase stability of LSC by thermodynamic modeling of the La-Sr-Co-O system using the CALculation of PHAse Diagrams (CALPHAD) method coupled with experiments. The calculated results based on the developed database are validated using experimental data both from literature and the present work. General agreement is achieved between model predictions and experimental results. Other properties of the LSC perovskite, such as oxygen non-stoichiometry and cation distribution, are also calculated and predicted based on the developed La-Sr-Co-O database. These calculations can provide important guidance in designing LSC-based materials for various applications and the established thermodynamic functions can serve as input for further thermodynamic calculations on altered and even more complex perovskites.

Keywords

General Agreement, LSC, La-Sr-Co-O, agreement, applications, calculated results, calculations, cation distribution, cations, cells, chemistry, cobaltite, complex perovskites, data, database, defect chemistry, defects, distribution, doped lanthanum cobaltite, electrode materials, equilibrium, experimental data, experimental results, experiments, function, guidance, input, instability, intermediate temperature solid oxide cells, lanthanum cobaltite, literature, materials, membrane, model, model predictions, non-stoichiometry, oxide cells, oxygen, oxygen electrode materials, oxygen membranes, oxygen non-stoichiometry, perovskites, phase, phase equilibria, phase stability, prediction, properties, results, services, solid oxide cells, strontium, system, thermodynamic calculations, thermodynamic functions, thermodynamic instability, thermodynamic model

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