Expertises

  • Material Science

    • Halide
    • Density
  • Chemistry

    • Perovskites
    • First Principle
    • Band Gap
    • Electronic State
    • Density Functional Theory
    • Structure

Organisaties

Publicaties

2023

First principles atomistic theory of halide perovskites (2023)In Halide Perovskite Semiconductors: Structures, Characterization, Properties, and Phenomena (pp. 215-250). Wiley-Blackwell. Leppert, L.https://doi.org/10.1002/9783527829026.ch8Understanding the evolution of double perovskite band structure upon dimensional reduction (2023)Chemical science, 14(42), 11858-11871. Connor, B. A., Su, A. C., Slavney, A. H., Leppert, L. & Karunadasa, H. I.https://doi.org/10.1039/D3SC03105ERight band gaps for the right reason at low computational cost with a meta-GGA (2023)Physical Review Materials , 7(9). Article 093803. Lebeda, T., Aschebrock, T., Sun, J., Leppert, L. & Kümmel, S.https://doi.org/10.1103/PhysRevMaterials.7.093803Chemical Mapping of Excitons in Halide Double Perovskites (2023)Nano letters, 23(17), 8155–8161. Biega, R. I., Chen, Y., Filip, M. R. & Leppert, L.https://doi.org/10.1021/acs.nanolett.3c02285Conduction Band Tuning by Controlled Alloying of Fe into Cs2AgBiBr6 Double Perovskite Powders (2023)Advanced functional materials. Article 2306106 (E-pub ahead of print/First online). Jöbsis, H. J., Fykouras, K., Reinders, J. W. C., van Katwijk, J., Dorresteijn, J. M., Arens, T., Vollmer, I., Muscarella, L. A., Leppert, L. & Hutter, E. M.https://doi.org/10.1002/adfm.202306106Towards an Inclusive and Representative Academic Landscape (2023)European review, 31(4), 382-390. Leppert, L., Solymosi, K. & Galligan, Y.https://doi.org/10.1017/S1062798723000108Conduction band tuning by controlled alloying of Fe into Cs2AgBiBr6 double perovskite powders (2023)[Working paper › Preprint]. ArXiv.org. Jöbsis, H. J., Fykouras, K., Reinders, J. W. C., Katwijk, J. v., Dorresteijn, J. M., Arens, T., Vollmer, I., Muscarella, L. A., Leppert, L. & Hutter, E. M.https://doi.org/10.48550/arXiv.2307.12747

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