Electronic structure, phase formation, and defect distribution in the Ba(Ce,Fe,Acc)O3-δ system investigated by density functional theory calculations

Rotraut Merkle; Andrei Chesnokov; Maximilian Felix Hoedl; Denis Gryaznov; Christina Nader; Andreas Egger; Edith Bucher; Eugene A. Kotomin; Joachim Maier; Werner Sitte

Electronic structure, phase formation, and defect distribution in the Ba(Ce,Fe,Acc)O_3-δ system investigated by density functional theory calculations

Rotraut Merkle, Andrei Chesnokov, Maximilian Felix Hoedl, Denis Gryaznov, Christina Nader, Andreas Egger, Edith Bucher, Eugene A. Kotomin, Joachim Maier, Werner Sitte

Chair of Physical Chemistry (480)

Research output: Contribution to conference › Poster › Research

Original language	English
Publication status	Published - 16 Jul 2024
Event	24th International Conference on Solid State Ionics (SSI24) - London, United Kingdom Duration: 14 Jul 2024 → 19 Jul 2024 https://www.nanoge.org/SSI24/home

Conference

Conference	24th International Conference on Solid State Ionics (SSI24)
Country/Territory	United Kingdom
City	London
Period	14/07/24 → 19/07/24
Internet address	https://www.nanoge.org/SSI24/home

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This output contributes to the following UN Sustainable Development Goals (SDGs)

Cite this

Merkle, R., Chesnokov, A., Hoedl, M. F., Gryaznov, D., Nader, C., Egger, A., Bucher, E., Kotomin, E. A., Maier, J., & Sitte, W. (2024). Electronic structure, phase formation, and defect distribution in the Ba(Ce,Fe,Acc)O_3-δ system investigated by density functional theory calculations. Poster session presented at 24th International Conference on Solid State Ionics (SSI24), London, United Kingdom.

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title = "Electronic structure, phase formation, and defect distribution in the Ba(Ce,Fe,Acc)O3-δ system investigated by density functional theory calculations",

author = "Rotraut Merkle and Andrei Chesnokov and Hoedl, {Maximilian Felix} and Denis Gryaznov and Christina Nader and Andreas Egger and Edith Bucher and Kotomin, {Eugene A.} and Joachim Maier and Werner Sitte",

year = "2024",

month = jul,

day = "16",

language = "English",

note = "24th International Conference on Solid State Ionics (SSI24) ; Conference date: 14-07-2024 Through 19-07-2024",

url = "https://www.nanoge.org/SSI24/home",

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Merkle, R, Chesnokov, A, Hoedl, MF, Gryaznov, D, Nader, C, Egger, A , Bucher, E, Kotomin, EA, Maier, J & Sitte, W 2024, 'Electronic structure, phase formation, and defect distribution in the Ba(Ce,Fe,Acc)O_3-δ system investigated by density functional theory calculations', 24th International Conference on Solid State Ionics (SSI24), London, United Kingdom, 14/07/24 - 19/07/24.

Electronic structure, phase formation, and defect distribution in the Ba(Ce,Fe,Acc)O_3-δ system investigated by density functional theory calculations. / Merkle, Rotraut; Chesnokov, Andrei; Hoedl, Maximilian Felix et al.
2024. Poster session presented at 24th International Conference on Solid State Ionics (SSI24), London, United Kingdom.

Research output: Contribution to conference › Poster › Research

TY - CONF

T1 - Electronic structure, phase formation, and defect distribution in the Ba(Ce,Fe,Acc)O3-δ system investigated by density functional theory calculations

AU - Merkle, Rotraut

AU - Chesnokov, Andrei

AU - Hoedl, Maximilian Felix

AU - Gryaznov, Denis

AU - Nader, Christina

AU - Egger, Andreas

AU - Bucher, Edith

AU - Kotomin, Eugene A.

AU - Maier, Joachim

AU - Sitte, Werner

PY - 2024/7/16

Y1 - 2024/7/16

M3 - Poster

T2 - 24th International Conference on Solid State Ionics (SSI24)

Y2 - 14 July 2024 through 19 July 2024

ER -