Data for Axial–Equatorial Halide Ordering in Layered Hybrid Perovskites from Isotropic–Anisotropic 207Pb NMR
Hope, Michael A.; Cordova, Manuel; Mishra, Aditya; Gunes, Ummugulsum; Caiazzo, Alessandro; Datta, Kunal; Janssen, René; +1 Authors
Hope, Michael A.; Cordova, Manuel; Mishra, Aditya; Gunes, Ummugulsum; Caiazzo, Alessandro; Datta, Kunal; Janssen, René; Emsley, Lyndon;
Data for Axial–Equatorial Halide Ordering in Layered Hybrid Perovskites from Isotropic–Anisotropic 207Pb NMR
Supporting data for Axial–Equatorial Halide Ordering in Layered Hybrid Perovskites from Isotropic–Anisotropic 207Pb NMR Raw and processed 207Pb NMR and XRD data for BA2PbX4 and FAPbX3 where X is iodide, bromide, or a mixture of the two. BA = butylammonium, FA = formamidinium. DFT calculations of 207Pb shielding for different mixed-halide unit cells of BA2PbX4, and the python notebooks used for fitting the 207Pb PASS spectra. See README.txt for more details.
Netherlands
- Eindhoven University of Technology Netherlands
- École Polytechnique Fédérale de Lausanne EPFL Switzerland
- Technical University Eindhoven Netherlands