On Journal of Chemical Information and Modelling, Vicent recently show DFTB method, in particular GFN1-x originally developed by Grimme et al , is very promising in predicting the the structures and electronic properties of halide perovskites. The method perfectly...
Congratulations to our bachelor students Hans and Allard for their successfully completion of their bachelor end projects. Hans worked on the DFT study on the reactivities of perovskite precursors with electron transport layer SnO2 and he has gained important...
Following eleven months of hard work, Mike has successfully defended his Master thesis on the 22 of February and received mark of 9.5. During these months, Mike focused on the development of a reactive force field (ReaxFF) for metal halide perovskites, in...
With the tunability of perovskites through compositional alloying being one of their most attractive properties, the photoinstability arising from the mixing is a very serious drawback. Specifically, in mixed halide perovskites a light induced halide segregation is...
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