34th IUPAP Conference on Computational Physics(CCP2023)

講演情報

Contributed talks (Condensed matter physics)

Condensed matter physics

Parallel session 3

2023年8月7日(月) 14:00 〜 15:20 502 (Room 4) (5F)

Chair: Chisa Hotta (University of Tokyo)

15:00 〜 15:20

[C07-3-06] Phase separation of Br-doped CsPbI3: A combined cluster expansion, Monte Carlo and DFT study

*Prettier Morongoa Maleka1,2, David Tshwane1, Steve Dima1, Odireleng Ntwaeaborwa2, Regina Maphanga1,3 (1. Council for Scientific and Industrial Research (CSIR) (South Africa), 2. University of Witwatersrand (South Africa), 3. National Institution of Physics (South Africa))

On-demand video

キーワード:Density Functional Theory, Electronic, Optical

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