Luca Grisanti | Modelling and Theory of Materials

Computational investigation of uracil dimers in water and the role of classical potentials

Fri, 23 May 2025 00:00:00 +0000

Luca Grisanti

Fri, 23 May 2025 00:00:00 +0000

Luca Grisanti, PhD worked at the intersection of computational materials science, chemical physics, and biophysics. He developed and applied computer-simulation methods to study how the atomic structure and dynamics of molecular and hybrid materials shape their electronic, optical, and energy-transfer properties, including charge and exciton transport, electron–phonon interactions, and theoretical spectroscopy.

From 2021, he led the Croatian Science Foundation project HYMO4EXNOMOMA, combining excited-state calculations, molecular dynamics, model Hamiltonians, and machine learning to predict optical properties and exciton dynamics in organic and biomolecular materials. He also contributed to research on amyloid-protein fluorescence, Förster energy transfer, natural anthocyanin dyes, and light-emitting two-dimensional halide perovskites.

Luca was a research associate in the Condensed Matter and Statistical Physics Group / Modelling and Theory of Materials Group from October 2018 to November 2022. He currently works at CNR-IOM, Italy.

Crystal structure prediction of quasi-two-dimensional lead halide perovskites

Mon, 15 May 2023 00:00:00 +0000

Mixed halide ordering as a tool for the stabilization of Ruddlesden--Popper Structures

Thu, 05 May 2022 00:00:00 +0000

Enhanced light emission performance of mixed cation perovskite films—The effect of solution stoichiometry on crystallization

Fri, 20 Aug 2021 00:00:00 +0000

Phase control for quasi-2D blue emitters by spacer cation engineering

Thu, 07 May 2020 00:00:00 +0000

Mixed Spacer Cation Stabilization of Blue-Emitting n= 2 Ruddlesden--Popper Organic--Inorganic Halide Perovskite Films

Sun, 15 Dec 2019 00:00:00 +0000